data_5ks6_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 5ks6 _Structure_validation_residue.Date_analyzed 2016-10-08 loop_ _Residue_analysis_software.Software_ID _Residue_analysis_software.Software_label _Residue_analysis_software.Method_ID _Residue_analysis_software.Method_label _Residue_analysis_software.Entry_ID _Residue_analysis_software.Structure_validation_oneline_list_ID 1 MolProbity . . ? 1 2 CYRANGE . . ? 1 stop_ loop_ _Residue_analysis.ID _Residue_analysis.PDB_model_num _Residue_analysis.Hydrogen_positions _Residue_analysis.MolProbity_flips _Residue_analysis.Cyrange_core_flag _Residue_analysis.Two_letter_chain_ID _Residue_analysis.PDB_strand_ID _Residue_analysis.PDB_residue_no _Residue_analysis.PDB_ins_code _Residue_analysis.PDB_residue_name _Residue_analysis.Assembly_ID _Residue_analysis.Entity_assembly_ID _Residue_analysis.Entity_ID _Residue_analysis.Comp_ID _Residue_analysis.Comp_index_ID _Residue_analysis.Clash_value _Residue_analysis.Clash_source_PDB_atom_name _Residue_analysis.Clash_destination_PDB_atom_name _Residue_analysis.Clash_destination_PDB_strand_ID _Residue_analysis.Clash_destination_PDB_residue_no _Residue_analysis.Clash_destination_PDB_ins_code _Residue_analysis.Clash_destination_PDB_residue_name _Residue_analysis.Cbeta_deviation_value _Residue_analysis.Rotamer_score _Residue_analysis.Rotamer_name _Residue_analysis.Ramachandran_phi _Residue_analysis.Ramachandran_psi _Residue_analysis.Ramachandran_score _Residue_analysis.Ramachandran_evaluation _Residue_analysis.Ramachandran_type _Residue_analysis.Bond_outlier_count _Residue_analysis.Worst_bond _Residue_analysis.Worst_bond_value _Residue_analysis.Worst_bond_sigma _Residue_analysis.Angle_outlier_count _Residue_analysis.Worst_angle _Residue_analysis.Worst_angle_value _Residue_analysis.Worst_angle_sigma _Residue_analysis.RNA_phosphate_perpendicular_outlier _Residue_analysis.RNA_suitness_score _Residue_analysis.RNA_suite_conformer _Residue_analysis.RNA_suite_triage _Residue_analysis.Max_b_factor _Residue_analysis.Tau_angle _Residue_analysis.Omega_dihedral _Residue_analysis.Disulfide_chi1 _Residue_analysis.Disulfide_chi2 _Residue_analysis.Disulfide_chi3 _Residue_analysis.Disulfide_ss_angle _Residue_analysis.Disulfide_ss _Residue_analysis.Disulfide_ss_angle_prime _Residue_analysis.Disulfide_chi2prime _Residue_analysis.Disulfide_chi1prime _Residue_analysis.Outlier_count_separate_geometry _Residue_analysis.Outlier_count _Residue_analysis.Entry_ID _Residue_analysis.Structure_validation_residue_list_ID . 001 nuclear orig core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 24.6 ptm . . . . . 0 N--CA 1.483 1.221 0 CA-C-O 119.706 -0.188 . . . . 71.349999999999994 111.327 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 26.2 p -56.05 -39.65 72.35 Favored 'General case' 0 N--CA 1.484 1.267 0 C-N-CA 123.286 0.634 . . . . 75.239999999999995 111.739 -179.934 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 48.3 m -68.46 -30.76 69.7 Favored 'General case' 0 CA--C 1.54 0.593 0 C-N-CA 123.375 0.67 . . . . 74.420000000000002 111.637 177.124 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 4' ' ' THR . . . . . 0.493 ' HA ' ' HG3' ' A' ' 53' ' ' PRO . 12.4 m -74.42 -35.99 63.43 Favored 'General case' 0 C--N 1.351 0.668 0 C-N-CA 123.04 0.536 . . . . 73.120000000000005 111.226 177.207 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 48.7 t -66.27 -40.29 86.47 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.745 0 N-CA-C 109.248 -0.649 . . . . 74.140000000000001 109.248 175.478 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 6' ' ' GLU . . . . . 0.503 ' O ' ' HG3' ' A' ' 10' ' ' ARG . 5.0 tm-20 -65.34 -37.21 86.37 Favored 'General case' 0 CA--C 1.542 0.652 0 CA-C-N 114.466 -1.243 . . . . 65.109999999999999 110.062 176.157 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 7' ' ' PHE . . . . . 0.417 ' O ' ' HB2' ' A' ' 10' ' ' ARG . 69.0 t80 -67.88 -44.62 76.63 Favored 'General case' 0 N--CA 1.48 1.069 0 C-N-CA 124.516 1.126 . . . . 65.120000000000005 112.103 178.4 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 8' ' ' ILE . . . . . 0.474 HD12 HG22 ' A' ' 60' ' ' ILE . 83.9 mt -65.49 -37.68 80.63 Favored 'Isoleucine or valine' 0 C--O 1.214 -0.813 0 N-CA-C 108.752 -0.832 . . . . 74.450000000000003 108.752 175.611 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 28.4 t-20 -65.2 -28.87 69.69 Favored 'General case' 0 N--CA 1.482 1.131 0 C-N-CA 124.594 1.157 . . . . 75.349999999999994 110.937 175.762 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . 0.595 ' HB3' HG23 ' A' ' 47' ' ' VAL . 65.4 mtt180 -62.56 -53.78 49.53 Favored 'General case' 0 N--CA 1.484 1.251 0 CA-C-O 121.766 0.793 . . . . 74.239999999999995 109.216 172.408 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 11' ' ' TRP . . . . . . . . . . . . . 98.3 m95 -73.89 -20.62 60.35 Favored 'General case' 0 N--CA 1.475 0.801 0 CA-C-N 114.927 -1.033 . . . . 74.230000000000004 112.741 -177.963 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . 0.441 ' HG3' ' O ' ' A' ' 8' ' ' ILE . 58.7 mt-30 -72.18 -38.86 69.01 Favored 'General case' 0 C--O 1.214 -0.813 0 N-CA-C 108.795 -0.817 . . . . 63.32 108.795 170.117 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 16.5 tpt180 -58.57 -52.34 66.07 Favored 'General case' 0 CA--C 1.54 0.563 0 O-C-N 123.812 0.695 . . . . 74.030000000000001 109.702 178.996 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 14' ' ' ILE . . . . . 0.445 HG23 ' OG1' ' A' ' 71' ' ' THR . 22.8 mt -65.04 -46.83 90.21 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.24 0 O-C-N 123.459 0.474 . . . . 72.450000000000003 111.03 179.507 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . 0.602 ' HA ' ' HB ' ' A' ' 71' ' ' THR . . . -58.54 -46.78 86.1 Favored 'General case' 0 N--CA 1.491 1.604 0 C-N-CA 123.703 0.801 . . . . 63.450000000000003 111.919 -177.278 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 82.7 mt -70.26 -44.6 68.11 Favored 'General case' 0 N--CA 1.479 1.014 0 CA-C-N 114.891 -1.049 . . . . 75.129999999999995 111.101 -176.445 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . 0.482 ' O ' ' HG ' ' A' ' 21' ' ' LEU . 74.3 mt -64.83 -45.29 86.78 Favored 'General case' 0 CA--C 1.544 0.717 0 O-C-N 123.607 0.567 . . . . 74.040000000000006 111.092 -179.531 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 80.4 p -64.68 -39.01 92.93 Favored 'General case' 0 N--CA 1.484 1.248 0 C-N-CA 123.159 0.584 . . . . 74.450000000000003 111.392 -179.36 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 6.0 tp-100 -58.98 -48.3 82.04 Favored 'General case' 0 C--N 1.354 0.777 0 O-C-N 123.972 0.795 . . . . 74.25 110.079 175.045 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 38.4 m -56.74 -50.97 70.65 Favored 'General case' 0 C--N 1.354 0.793 0 O-C-N 124.14 0.9 . . . . 74.349999999999994 110.188 177.517 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . 0.491 HD21 ' HA ' ' A' ' 33' ' ' LEU . 81.1 mt -65.32 -30.23 71.06 Favored 'General case' 0 CA--C 1.538 0.507 0 C-N-CA 123.754 0.822 . . . . 73.409999999999997 111.163 -175.497 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . 0.682 ' HA ' HD21 ' A' ' 78' ' ' LEU . 63.9 tp -64.72 -58.13 7.09 Favored 'General case' 0 C--N 1.353 0.752 0 N-CA-C 109.534 -0.543 . . . . 75.340000000000003 109.534 176.989 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 39.3 mt-10 -57.12 -47.28 81.49 Favored 'General case' 0 N--CA 1.475 0.779 0 O-C-N 124.396 1.06 . . . . 73.150000000000006 110.991 -178.015 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 95.9 mt -64.33 -40.33 95.68 Favored 'General case' 0 N--CA 1.473 0.714 0 C-N-CA 123.899 0.88 . . . . 74.150000000000006 111.442 -177.372 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . 0.442 ' HB1' HD23 ' A' ' 33' ' ' LEU . . . -61.42 -44.73 96.62 Favored 'General case' 0 N--CA 1.476 0.863 0 C-N-CA 122.895 0.478 . . . . 73.519999999999996 110.847 178.195 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 89.6 mt-30 -64.84 -30.81 71.83 Favored 'General case' 0 N--CA 1.477 0.883 0 O-C-N 124.088 0.868 . . . . 62.43 111.2 178.351 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 53.6 mtt180 -83.16 -5.79 59.25 Favored 'General case' 0 N--CA 1.481 1.106 0 C-N-CA 123.568 0.747 . . . . 73.200000000000003 112.071 177.271 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 86.67 7.65 78.21 Favored Glycine 0 C--N 1.349 1.271 0 N-CA-C 114.027 0.371 . . . . 63.450000000000003 114.027 178.144 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 11.2 mm-40 -82.37 57.63 3.74 Favored 'General case' 0 CA--C 1.546 0.791 0 C-N-CA 124.281 1.032 . . . . 71.340000000000003 111.251 178.382 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 30' ' ' TRP . . . . . . . . . . . . . 84.7 m95 -63.43 -32.04 73.37 Favored 'General case' 0 N--CA 1.477 0.917 0 C-N-CA 123.656 0.782 . . . . 72.129999999999995 110.942 -178.769 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 10.1 m-20 -56.66 -42.17 78.52 Favored 'General case' 0 N--CA 1.476 0.846 0 C-N-CA 124.032 0.933 . . . . 75.549999999999997 110.706 177.846 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 83.3 mt -66.12 -34.51 78.21 Favored 'General case' 0 N--CA 1.474 0.742 0 C-N-CA 123.395 0.678 . . . . 72.109999999999999 111.199 179.743 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . 0.491 ' HA ' HD21 ' A' ' 21' ' ' LEU . 9.9 mp -66.22 -39.61 89.71 Favored 'General case' 0 N--CA 1.481 1.101 0 C-N-CA 122.563 0.345 . . . . 74.420000000000002 110.299 173.023 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 84.9 mt -73.66 -22.94 59.81 Favored 'General case' 0 N--CA 1.478 0.945 0 C-N-CA 123.504 0.722 . . . . 73.329999999999998 111.661 -179.091 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 48.7 mt-30 -85.98 -32.73 21.37 Favored 'General case' 0 N--CA 1.486 1.372 0 C-N-CA 123.515 0.726 . . . . 70.019999999999996 110.774 176.09 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 25.5 mm-40 -86.19 -12.66 49.2 Favored 'General case' 0 N--CA 1.479 1.02 0 C-N-CA 124.017 0.927 . . . . 72.5 111.521 176.136 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . 0.464 ' O ' ' HG ' ' A' ' 41' ' ' LEU . 36.3 tt0 -44.57 -65.0 0.58 Allowed 'General case' 0 N--CA 1.477 0.889 0 C-N-CA 124.543 1.137 . . . . 72.510000000000005 113.055 -178.531 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 93.2 t -65.49 -33.26 62.44 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.692 0 C-N-CA 122.955 0.502 . . . . 72.510000000000005 110.866 -175.911 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 57.7 m -63.85 -38.31 90.62 Favored 'General case' 0 N--CA 1.476 0.831 0 C-N-CA 123.069 0.548 . . . . 75.540000000000006 111.415 175.406 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 42.4 t80 -78.11 -43.04 30.09 Favored 'General case' 0 C--N 1.344 0.348 0 C-N-CA 123.326 0.65 . . . . 75.200000000000003 110.547 -174.705 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . 0.464 ' HG ' ' O ' ' A' ' 37' ' ' GLU . 63.2 mt -64.95 -41.52 95.42 Favored 'General case' 0 C--O 1.245 0.854 0 O-C-N 123.955 0.785 . . . . 74.430000000000007 109.554 178.529 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 53.9 tt0 -56.71 -53.4 58.22 Favored 'General case' 0 C--N 1.358 0.962 0 CA-C-N 115.157 -0.929 . . . . 72.420000000000002 110.014 173.713 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 43' ' ' SER . . . . . 0.546 ' O ' HG22 ' A' ' 47' ' ' VAL . 71.5 m -56.45 -57.16 13.51 Favored 'General case' 0 C--N 1.35 0.607 0 O-C-N 124.216 0.947 . . . . 73.519999999999996 111.658 -178.606 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 16.8 tt -61.03 -41.03 87.64 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.812 0 O-C-N 123.728 0.642 . . . . 73.219999999999999 111.335 -172.328 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 30.6 mt-10 -72.24 -37.07 69.23 Favored 'General case' 0 N--CA 1.477 0.89 0 N-CA-C 111.975 0.361 . . . . 74.510000000000005 111.975 178.824 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 46' ' ' THR . . . . . 0.494 ' O ' ' HB2' ' A' ' 50' ' ' LYS . 96.0 m -57.65 -40.2 78.74 Favored 'General case' 0 N--CA 1.486 1.36 0 C-N-CA 123.008 0.523 . . . . 71.239999999999995 110.589 174.424 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 47' ' ' VAL . . . . . 0.595 HG23 ' HB3' ' A' ' 10' ' ' ARG . 87.3 t -68.69 -49.56 63.49 Favored 'Isoleucine or valine' 0 C--O 1.243 0.724 0 C-N-CA 124.201 1.001 . . . . 74.409999999999997 111.371 -179.517 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 48' ' ' MET . . . . . . . . . . . . . 78.6 mtm -62.12 -43.74 98.18 Favored 'General case' 0 N--CA 1.482 1.165 0 O-C-N 123.877 0.735 . . . . 72.400000000000006 111.399 -176.608 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 46.0 mt-10 -85.02 4.12 35.36 Favored 'General case' 0 N--CA 1.476 0.84 0 C-N-CA 123.721 0.808 . . . . 72.450000000000003 111.944 -174.779 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . 0.494 ' HB2' ' O ' ' A' ' 46' ' ' THR . 1.5 tppt? -103.62 135.82 44.49 Favored 'General case' 0 N--CA 1.476 0.834 0 N-CA-C 109.56 -0.533 . . . . 74.150000000000006 109.56 179.117 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 9.0 tt0 -69.42 148.61 49.35 Favored 'General case' 0 CA--C 1.547 0.831 0 C-N-CA 123.653 0.781 . . . . 75.040000000000006 111.856 -169.615 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 15.9 m -68.68 130.58 91.78 Favored Pre-proline 0 CA--C 1.554 1.104 0 C-N-CA 124.511 1.124 . . . . 73.219999999999999 110.461 176.548 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 53' ' ' PRO . . . . . 0.493 ' HG3' ' HA ' ' A' ' 4' ' ' THR . 94.7 Cg_endo -75.38 155.89 41.25 Favored 'Trans proline' 0 CA--C 1.557 1.662 0 C-N-CA 122.591 2.194 . . . . 75.310000000000002 112.289 178.0 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_endo -70.03 -46.86 0.97 Allowed 'Trans proline' 0 C--N 1.369 1.643 0 C-N-CA 122.764 2.31 . . . . 75.420000000000002 113.413 179.029 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . -79.92 70.74 2.85 Favored Glycine 0 C--N 1.348 1.227 0 N-CA-C 114.336 0.495 . . . . 75.439999999999998 114.336 -170.179 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 56' ' ' ILE . . . . . 0.711 HG21 HD11 ' A' ' 113' ' ' LEU . 8.3 mm -101.75 142.86 15.5 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.906 0 C-N-CA 124.012 0.925 . . . . 75.430000000000007 108.781 175.518 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 72.9 p -113.18 174.32 5.96 Favored 'General case' 0 N--CA 1.478 0.93 0 N-CA-C 109.005 -0.739 . . . . 74.409999999999997 109.005 170.134 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 16.0 tpt180 -59.13 -42.74 91.36 Favored 'General case' 0 N--CA 1.478 0.934 0 C-N-CA 123.128 0.571 . . . . 72.120000000000005 109.584 176.197 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 19.8 m -56.64 -50.61 71.54 Favored 'General case' 0 C--N 1.356 0.88 0 C-N-CA 123.972 0.909 . . . . 75.420000000000002 111.082 176.733 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 60' ' ' ILE . . . . . 0.474 HG22 HD12 ' A' ' 8' ' ' ILE . 99.1 mt -60.28 -42.17 89.61 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.809 0 O-C-N 123.972 0.795 . . . . 75.230000000000004 110.985 179.483 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 54.7 tt0 -58.73 -47.34 84.93 Favored 'General case' 0 CA--C 1.542 0.656 0 C-N-CA 123.51 0.724 . . . . 72.310000000000002 110.785 -179.715 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 14.4 m-20 -72.77 -32.82 65.89 Favored 'General case' 0 N--CA 1.48 1.027 0 N-CA-C 112.827 0.677 . . . . 71.010000000000005 112.827 -178.077 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 63' ' ' MET . . . . . . . . . . . . . 58.7 mtm -74.48 -41.82 60.08 Favored 'General case' 0 N--CA 1.485 1.317 0 CA-C-N 117.568 0.167 . . . . 74.439999999999998 110.938 179.673 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 64' ' ' VAL . . . . . 0.492 ' O ' HG13 ' A' ' 68' ' ' ILE . 56.1 t -64.0 -54.14 35.21 Favored 'Isoleucine or valine' 0 C--N 1.352 0.71 0 C-N-CA 123.492 0.717 . . . . 74.329999999999998 109.616 176.253 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -62.04 -32.7 73.24 Favored 'General case' 0 N--CA 1.477 0.923 0 O-C-N 123.639 0.587 . . . . 75.310000000000002 111.129 178.306 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -63.26 -40.2 98.75 Favored Glycine 0 C--N 1.348 1.205 0 N-CA-C 111.689 -0.564 . . . . 53.32 111.689 174.627 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 16.8 m-30 -75.21 -32.3 61.13 Favored 'General case' 0 C--N 1.352 0.685 0 C-N-CA 123.573 0.749 . . . . 73.340000000000003 111.722 178.702 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 68' ' ' ILE . . . . . 0.497 ' O ' ' HG ' ' A' ' 72' ' ' LEU . 62.1 mt -63.17 -56.15 19.05 Favored 'Isoleucine or valine' 0 C--N 1.357 0.903 0 N-CA-C 107.979 -1.119 . . . . 75.049999999999997 107.979 175.345 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 51.7 tptt -53.11 -43.51 66.94 Favored 'General case' 0 N--CA 1.477 0.896 0 C-N-CA 124.622 1.169 . . . . 75.209999999999994 111.527 177.481 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 61.5 tt0 -59.9 -52.39 65.63 Favored 'General case' 0 N--CA 1.472 0.629 0 CA-C-N 115.731 -0.668 . . . . 75.329999999999998 111.249 179.982 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 71' ' ' THR . . . . . 0.602 ' HB ' ' HA ' ' A' ' 15' ' ' ALA . 11.4 t -74.95 -27.07 60.03 Favored 'General case' 0 C--N 1.35 0.619 0 O-C-N 123.285 0.366 . . . . 73.340000000000003 110.275 -173.703 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 72' ' ' LEU . . . . . 0.497 ' HG ' ' O ' ' A' ' 68' ' ' ILE . 19.4 mt -61.78 -55.41 30.39 Favored 'General case' 0 C--N 1.358 0.949 0 N-CA-C 108.872 -0.788 . . . . 75.150000000000006 108.872 175.19 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -67.83 -41.95 82.24 Favored 'General case' 0 N--CA 1.479 0.982 0 N-CA-C 113.937 1.088 . . . . 74.209999999999994 113.937 -175.916 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 94.7 m-20 -60.88 -55.41 33.32 Favored 'General case' 0 N--CA 1.493 1.714 0 CA-C-O 121.869 0.842 . . . . 74.209999999999994 110.121 177.299 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . 0.507 ' O ' ' HG2' ' A' ' 79' ' ' LYS . 62.5 tt0 -70.08 -19.9 63.24 Favored 'General case' 0 CA--C 1.549 0.936 0 CA-C-N 114.516 -1.22 . . . . 64.010000000000005 110.801 -178.876 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 76' ' ' GLN . . . . . 0.408 ' HB2' ' O ' ' A' ' 72' ' ' LEU . 10.0 tt0 -72.92 -41.12 64.89 Favored 'General case' 0 N--CA 1.489 1.512 0 C-N-CA 123.127 0.571 . . . . 64.030000000000001 109.879 176.602 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 93.3 mt -59.58 -41.4 90.15 Favored 'General case' 0 N--CA 1.474 0.77 0 O-C-N 123.938 0.774 . . . . 73.420000000000002 109.467 172.926 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . 0.682 HD21 ' HA ' ' A' ' 22' ' ' LEU . 70.1 mt -58.16 -51.25 70.49 Favored 'General case' 0 N--CA 1.478 0.947 0 CA-C-N 115.611 -0.722 . . . . 74.340000000000003 111.972 170.87 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 79' ' ' LYS . . . . . 0.507 ' HG2' ' O ' ' A' ' 75' ' ' GLU . 41.3 mmtm -57.1 -42.58 81.03 Favored 'General case' 0 N--CA 1.481 1.105 0 C-N-CA 123.495 0.718 . . . . 74.450000000000003 110.827 -176.662 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -67.26 -40.63 92.17 Favored Glycine 0 C--N 1.344 1.004 0 O-C-N 124.583 1.177 . . . . 53.130000000000003 113.001 179.259 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 3.1 tt -64.49 -48.3 75.69 Favored 'General case' 0 N--CA 1.475 0.805 0 C-N-CA 123.895 0.878 . . . . 74.549999999999997 109.375 179.301 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 85.7 mt . . . . . 0 CA--C 1.543 0.685 0 C-N-CA 124.391 1.076 . . . . 74.340000000000003 111.708 -171.885 . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 85.1 mt . . . . . 0 N--CA 1.474 0.764 0 N-CA-C 108.364 -0.976 . . . . 73.299999999999997 108.364 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 49.8 mt -120.71 13.34 6.35 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.605 0 CA-C-O 122.003 0.906 . . . . 75.340000000000003 109.186 176.865 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 87.37 -11.91 64.33 Favored Glycine 0 N--CA 1.475 1.285 0 CA-C-N 116.042 -0.526 . . . . 64.420000000000002 113.967 -178.567 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 33.7 tt0 -132.77 174.1 10.67 Favored 'General case' 0 N--CA 1.477 0.894 0 N-CA-C 108.395 -0.965 . . . . 73.030000000000001 108.395 -178.398 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 45.6 m -62.6 81.74 0.02 OUTLIER 'General case' 0 N--CA 1.477 0.893 0 C-N-CA 123.936 0.894 . . . . 72.150000000000006 111.62 177.247 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 35.4 m -72.27 -43.33 64.43 Favored 'General case' 0 C--O 1.224 -0.289 0 CA-C-N 115.143 -0.935 . . . . 64.310000000000002 109.615 175.748 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 98' ' ' ARG . . . . . 0.494 ' NH1' ' HB3' ' A' ' 75' ' ' GLU . 6.9 ttp180 -59.92 -48.53 81.34 Favored 'General case' 0 CA--C 1.536 0.431 0 O-C-N 124.215 0.947 . . . . 70.420000000000002 112.705 -169.417 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 1.5 tm0? -62.96 -55.41 26.1 Favored 'General case' 0 N--CA 1.472 0.651 0 N-CA-C 109.595 -0.52 . . . . 65.140000000000001 109.595 -175.071 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 65.4 tttp -56.5 -54.2 48.59 Favored 'General case' 0 CA--C 1.543 0.7 0 O-C-N 123.963 0.789 . . . . 74.439999999999998 111.105 -179.868 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 46.8 t -67.53 -55.58 12.94 Favored 'General case' 0 CA--C 1.538 0.516 0 C-N-CA 123.686 0.794 . . . . 64.450000000000003 112.022 -171.775 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 8.0 mp -76.83 -30.54 56.4 Favored 'General case' 0 N--CA 1.485 1.282 0 N-CA-C 112.518 0.562 . . . . 75.049999999999997 112.518 -172.142 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 8.2 t30 -75.64 -41.87 53.03 Favored 'General case' 0 N--CA 1.485 1.316 0 CA-C-N 118.34 0.518 . . . . 75.349999999999994 110.257 177.46 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 104' ' ' ASN . . . . . 0.474 ' O ' ' HG2' ' A' ' 108' ' ' ARG . 28.0 t-20 -62.8 -44.28 96.57 Favored 'General case' 0 N--CA 1.481 1.084 0 N-CA-C 109.165 -0.68 . . . . 64.140000000000001 109.165 173.725 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -59.62 -38.27 80.88 Favored 'General case' 0 C--N 1.353 0.745 0 C-N-CA 123.843 0.857 . . . . 72.340000000000003 111.436 178.561 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 106' ' ' TYR . . . . . . . . . . . . . 4.3 t80 -61.0 -48.64 80.89 Favored 'General case' 0 CA--C 1.54 0.583 0 N-CA-C 108.738 -0.838 . . . . 75.310000000000002 108.738 175.104 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -61.93 -36.86 93.46 Favored Glycine 0 C--N 1.353 1.474 0 O-C-N 123.845 0.716 . . . . 74.430000000000007 112.786 -179.813 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 108' ' ' ARG . . . . . 0.474 ' HG2' ' O ' ' A' ' 104' ' ' ASN . 34.1 mmt180 -70.59 -40.38 73.28 Favored 'General case' 0 N--CA 1.473 0.679 0 C-N-CA 123.177 0.591 . . . . 71.510000000000005 110.035 -179.79 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 109' ' ' LEU . . . . . 0.425 ' HA ' ' N ' ' A' ' 114' ' ' LEU . 59.7 tp -66.75 -39.66 87.99 Favored 'General case' 0 N--CA 1.48 1.064 0 C-N-CA 123.741 0.816 . . . . 72.530000000000001 110.271 178.924 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 23.3 t -76.03 -27.76 57.44 Favored 'General case' 0 CA--C 1.543 0.696 0 CA-C-N 114.888 -1.051 . . . . 73.120000000000005 110.397 -179.802 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . -90.03 -67.04 1.21 Allowed Glycine 0 C--N 1.361 1.941 0 CA-C-O 119.194 -0.781 . . . . 64.450000000000003 113.698 -177.665 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 112' ' ' MET . . . . . . . . . . . . . 3.1 tmm? -97.15 -66.14 0.92 Allowed 'General case' 0 N--CA 1.481 1.088 0 CA-C-N 118.369 1.085 . . . . 75.209999999999994 110.605 179.289 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 113' ' ' LEU . . . . . 0.711 HD11 HG21 ' A' ' 56' ' ' ILE . 19.7 tp 160.21 54.35 0.0 OUTLIER 'General case' 0 N--CA 1.489 1.498 0 C-N-CA 126.378 1.871 . . . . 74.239999999999995 108.501 -178.501 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 114' ' ' LEU . . . . . 0.425 ' N ' ' HA ' ' A' ' 109' ' ' LEU . 22.3 tp . . . . . 0 CA--C 1.543 0.702 0 C-N-CA 125.764 1.626 . . . . 72.530000000000001 111.911 176.271 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 25.3 ttt . . . . . 0 CA--C 1.553 1.078 0 CA-C-O 119.495 -0.288 . . . . 73.409999999999997 110.856 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 37.1 p -56.03 -49.08 74.68 Favored 'General case' 0 N--CA 1.487 1.405 0 N-CA-C 112.704 0.631 . . . . 74.519999999999996 112.704 -172.142 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 55.2 m -68.41 -26.67 65.65 Favored 'General case' 0 N--CA 1.483 1.183 0 C-N-CA 122.459 0.304 . . . . 73.420000000000002 111.774 -178.597 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 4' ' ' THR . . . . . 0.495 HG23 HD11 ' A' ' 60' ' ' ILE . 28.2 m -75.02 -41.3 59.56 Favored 'General case' 0 C--N 1.349 0.566 0 C-N-CA 123.191 0.596 . . . . 73.420000000000002 110.755 177.37 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 87.9 t -68.32 -36.36 74.7 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.817 0 C-N-CA 123.381 0.673 . . . . 65.109999999999999 109.438 177.361 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 42.2 mm-40 -62.37 -46.62 87.82 Favored 'General case' 0 N--CA 1.478 0.931 0 C-N-CA 123.761 0.824 . . . . 74.340000000000003 110.566 173.252 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 31.0 t80 -64.93 -47.91 76.0 Favored 'General case' 0 N--CA 1.475 0.821 0 O-C-N 123.989 0.805 . . . . 74.319999999999993 110.603 -175.878 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 8' ' ' ILE . . . . . 0.48 HD13 HG23 ' A' ' 60' ' ' ILE . 77.4 mt -65.75 -36.96 78.81 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.856 0 C-N-CA 123.607 0.763 . . . . 75.310000000000002 110.439 178.577 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 26.0 t-20 -73.29 -27.8 61.75 Favored 'General case' 0 N--CA 1.489 1.489 0 C-N-CA 123.201 0.6 . . . . 73.439999999999998 111.195 -179.681 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . 0.578 ' HB3' HG22 ' A' ' 47' ' ' VAL . 62.7 mtt85 -72.11 -37.43 69.51 Favored 'General case' 0 CA--C 1.54 0.595 0 C-N-CA 123.054 0.542 . . . . 75.209999999999994 109.754 173.038 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 11' ' ' TRP . . . . . . . . . . . . . 86.5 m95 -76.14 -20.92 57.17 Favored 'General case' 0 N--CA 1.475 0.824 0 CA-C-N 116.043 -0.526 . . . . 74.519999999999996 111.549 172.012 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 53.5 mt-30 -68.15 -46.38 70.93 Favored 'General case' 0 C--N 1.359 0.982 0 N-CA-C 107.553 -1.276 . . . . 73.319999999999993 107.553 168.839 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . 0.621 ' HE ' HD13 ' A' ' 17' ' ' LEU . 16.2 tpt180 -59.02 -46.66 87.64 Favored 'General case' 0 CA--C 1.548 0.868 0 O-C-N 123.8 0.688 . . . . 74.540000000000006 110.927 -177.622 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 56.8 mt -66.21 -52.81 43.5 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.095 0 O-C-N 123.201 0.313 . . . . 72.439999999999998 110.607 177.8 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . 0.587 ' HA ' ' HB ' ' A' ' 71' ' ' THR . . . -56.56 -45.15 81.43 Favored 'General case' 0 N--CA 1.488 1.436 0 C-N-CA 123.828 0.851 . . . . 73.310000000000002 111.794 -177.032 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 97.0 mt -78.58 -40.6 34.23 Favored 'General case' 0 N--CA 1.481 1.119 0 CA-C-N 114.923 -1.035 . . . . 74.209999999999994 111.39 -171.904 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . 0.621 HD13 ' HE ' ' A' ' 13' ' ' ARG . 30.3 mt -64.0 -51.3 64.89 Favored 'General case' 0 C--N 1.36 1.05 0 CA-C-O 119.166 -0.445 . . . . 75.209999999999994 110.478 177.536 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 80.5 p -62.31 -36.47 82.25 Favored 'General case' 0 N--CA 1.478 0.945 0 O-C-N 123.789 0.681 . . . . 75.040000000000006 111.123 -179.94 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 19' ' ' GLN . . . . . 0.441 HE21 ' NE2' ' A' ' 70' ' ' GLN . 6.7 tp-100 -62.19 -44.39 96.68 Favored 'General case' 0 C--N 1.358 0.976 0 C-N-CA 123.288 0.635 . . . . 72.540000000000006 110.305 175.105 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 63.4 m -62.04 -43.84 97.97 Favored 'General case' 0 C--O 1.214 -0.782 0 O-C-N 123.918 0.761 . . . . 63.43 109.663 176.975 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . 0.681 HD21 ' HA ' ' A' ' 33' ' ' LEU . 52.4 mt -64.15 -31.92 73.3 Favored 'General case' 0 C--N 1.351 0.638 0 C-N-CA 123.268 0.627 . . . . 75.409999999999997 110.54 -178.009 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . 0.723 ' HA ' HD23 ' A' ' 78' ' ' LEU . 50.7 tp -66.85 -54.64 20.38 Favored 'General case' 0 N--CA 1.48 1.039 0 C-N-CA 123.096 0.558 . . . . 55.109999999999999 110.082 176.173 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . 0.411 ' HB3' ' NH1' ' A' ' 27' ' ' ARG . 11.6 mm-40 -52.69 -52.48 55.81 Favored 'General case' 0 CA--C 1.547 0.858 0 C-N-CA 124.593 1.157 . . . . 74.310000000000002 111.414 177.935 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . 0.472 HD23 HD11 ' A' ' 32' ' ' LEU . 77.8 mt -63.45 -43.78 96.39 Favored 'General case' 0 CA--C 1.538 0.516 0 CA-C-N 114.485 -1.234 . . . . 74.230000000000004 110.941 -176.752 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . 0.459 ' HB1' HD23 ' A' ' 33' ' ' LEU . . . -58.28 -48.35 80.75 Favored 'General case' 0 N--CA 1.483 1.214 0 C-N-CA 123.264 0.625 . . . . 73.010000000000005 110.884 -179.838 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 96.3 mt-30 -63.77 -37.46 87.46 Favored 'General case' 0 CA--C 1.545 0.777 0 CA-C-N 114.815 -1.084 . . . . 74.299999999999997 110.904 179.716 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 27' ' ' ARG . . . . . 0.411 ' NH1' ' HB3' ' A' ' 23' ' ' GLU . 78.2 mtt180 -87.97 3.78 47.41 Favored 'General case' 0 N--CA 1.482 1.152 0 C-N-CA 123.793 0.837 . . . . 74.200000000000003 112.793 -178.222 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 83.97 12.12 77.57 Favored Glycine 0 C--N 1.351 1.405 0 N-CA-C 115.06 0.784 . . . . 75.420000000000002 115.06 171.876 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 29' ' ' GLU . . . . . 0.409 ' HB2' ' HB3' ' A' ' 24' ' ' LEU . 14.3 mm-40 -91.02 50.71 1.82 Allowed 'General case' 0 CA--C 1.55 0.977 0 C-N-CA 124.649 1.18 . . . . 72.5 110.464 176.053 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 30' ' ' TRP . . . . . 0.582 ' HA ' HD13 ' A' ' 33' ' ' LEU . 75.3 m95 -64.55 -26.67 68.52 Favored 'General case' 0 N--CA 1.485 1.295 0 C-N-CA 123.204 0.601 . . . . 75.129999999999995 111.005 -178.257 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 8.8 m-20 -57.03 -42.81 81.13 Favored 'General case' 0 N--CA 1.478 0.927 0 C-N-CA 123.274 0.63 . . . . 63.219999999999999 110.393 172.98 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . 0.472 HD11 HD23 ' A' ' 24' ' ' LEU . 76.1 mt -72.08 -18.93 61.89 Favored 'General case' 0 CA--C 1.547 0.839 0 CA-C-N 116.237 -0.438 . . . . 75.239999999999995 111.354 -178.882 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . 0.681 ' HA ' HD21 ' A' ' 21' ' ' LEU . 10.2 mp -69.37 -46.95 65.73 Favored 'General case' 0 N--CA 1.485 1.307 0 N-CA-C 109.254 -0.647 . . . . 65.530000000000001 109.254 167.317 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 59.8 mt -61.41 -38.68 87.97 Favored 'General case' 0 N--CA 1.483 1.212 0 O-C-N 123.99 0.807 . . . . 74.209999999999994 111.306 179.291 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -69.05 -45.27 70.83 Favored 'General case' 0 N--CA 1.481 1.116 0 C-N-CA 123.955 0.902 . . . . 75.319999999999993 111.34 -179.996 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 36' ' ' GLN . . . . . 0.474 ' HB2' HD22 ' A' ' 21' ' ' LEU . 87.1 mm-40 -81.42 -15.35 55.4 Favored 'General case' 0 N--CA 1.487 1.423 0 C-N-CA 122.791 0.436 . . . . 63.140000000000001 111.634 -178.282 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . 0.405 ' O ' ' HG ' ' A' ' 41' ' ' LEU . 24.1 tt0 -45.81 -65.97 0.47 Allowed 'General case' 0 N--CA 1.48 1.048 0 C-N-CA 124.849 1.259 . . . . 72.25 113.282 -176.559 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 48.9 t -61.62 -35.44 67.22 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.087 0 C-N-CA 123.682 0.793 . . . . 75.310000000000002 111.104 -170.472 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 49.1 m -65.57 -49.29 69.38 Favored 'General case' 0 CA--C 1.54 0.563 0 C-N-CA 123.788 0.835 . . . . 75.040000000000006 110.729 176.573 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 38.0 t80 -60.99 -40.51 93.74 Favored 'General case' 0 N--CA 1.48 1.032 0 C-N-CA 124.203 1.001 . . . . 74.140000000000001 110.982 -178.862 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . 0.657 ' HB3' HD21 ' A' ' 92' ' ' LEU . 69.7 mt -70.14 -48.31 57.96 Favored 'General case' 0 C--O 1.252 1.185 0 O-C-N 124.613 1.195 . . . . 75.400000000000006 111.761 -175.292 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 46.6 tt0 -63.27 -39.48 94.7 Favored 'General case' 0 CA--C 1.551 1.015 0 CA-C-N 115.592 -0.731 . . . . 72.450000000000003 109.831 177.644 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 43' ' ' SER . . . . . 0.548 ' O ' HG21 ' A' ' 47' ' ' VAL . 67.2 m -61.96 -56.39 19.61 Favored 'General case' 0 C--N 1.356 0.862 0 C-N-CA 123.28 0.632 . . . . 55.130000000000003 111.022 178.27 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 11.5 tt -58.04 -42.16 82.18 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.36 0 C-N-CA 123.729 0.812 . . . . 73.439999999999998 110.977 -173.756 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 72.1 mm-40 -60.81 -48.45 81.75 Favored 'General case' 0 C--N 1.362 1.151 0 O-C-N 123.492 0.495 . . . . 54.329999999999998 111.272 175.174 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 66.9 m -57.06 -39.12 74.29 Favored 'General case' 0 N--CA 1.489 1.515 0 C-N-CA 122.991 0.516 . . . . 75.340000000000003 111.895 178.971 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 47' ' ' VAL . . . . . 0.578 HG22 ' HB3' ' A' ' 10' ' ' ARG . 43.3 t -65.98 -44.75 92.16 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.173 0 C-N-CA 123.302 0.641 . . . . 61.140000000000001 110.377 -178.479 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 48' ' ' MET . . . . . 0.543 ' SD ' ' HB2' ' A' ' 101' ' ' SER . 75.2 mtm -69.75 -27.23 64.77 Favored 'General case' 0 N--CA 1.485 1.276 0 CA-C-N 116.093 -0.503 . . . . 73.5 111.8 179.221 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 38.5 mt-10 -71.22 -24.47 62.21 Favored 'General case' 0 N--CA 1.481 1.107 0 C-N-CA 123.037 0.535 . . . . 74.200000000000003 111.319 173.868 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -87.04 142.5 27.89 Favored 'General case' 0 N--CA 1.478 0.974 0 C-N-CA 123.203 0.601 . . . . 75.510000000000005 110.28 -178.944 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 8.8 tt0 -85.56 158.52 20.11 Favored 'General case' 0 N--CA 1.474 0.755 0 C-N-CA 123.761 0.824 . . . . 72.310000000000002 110.017 -178.921 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 52' ' ' THR . . . . . 0.436 ' OG1' ' HB3' ' A' ' 114' ' ' LEU . 22.0 m -78.36 129.87 73.52 Favored Pre-proline 0 CA--C 1.546 0.823 0 C-N-CA 123.119 0.567 . . . . 73.120000000000005 110.263 175.514 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 53' ' ' PRO . . . . . 0.486 ' HG3' ' HA ' ' A' ' 4' ' ' THR . 56.8 Cg_endo -67.01 157.88 59.56 Favored 'Trans proline' 0 C--N 1.376 2.022 0 C-N-CA 123.2 2.6 . . . . 74.349999999999994 112.652 177.754 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 38.8 Cg_endo -65.49 -45.54 6.83 Favored 'Trans proline' 0 C--N 1.375 1.948 0 C-N-CA 122.843 2.362 . . . . 72.200000000000003 112.75 176.397 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . -69.2 78.8 0.3 Allowed Glycine 0 C--N 1.359 1.843 0 O-C-N 123.765 0.666 . . . . 63.509999999999998 114.054 -175.488 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 23.8 mm -117.91 136.39 55.26 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.575 0 C-N-CA 124.752 1.221 . . . . 71.439999999999998 108.337 178.444 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 72.2 p -106.66 179.12 4.36 Favored 'General case' 0 N--CA 1.473 0.717 0 N-CA-C 108.537 -0.912 . . . . 53.200000000000003 108.537 168.121 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 29.8 tpt180 -65.96 -43.36 88.16 Favored 'General case' 0 CA--C 1.54 0.588 0 N-CA-C 109.819 -0.437 . . . . 72.239999999999995 109.819 174.549 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 71.4 p -62.64 -42.45 99.61 Favored 'General case' 0 CA--C 1.545 0.762 0 C-N-CA 123.5 0.72 . . . . 71.400000000000006 110.934 -179.544 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 60' ' ' ILE . . . . . 0.495 HD11 HG23 ' A' ' 4' ' ' THR . 93.9 mt -59.81 -45.65 94.56 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.019 0 C-N-CA 123.806 0.842 . . . . 73.400000000000006 110.513 173.762 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 64.5 tt0 -59.91 -37.39 79.28 Favored 'General case' 0 N--CA 1.478 0.932 0 C-N-CA 123.875 0.87 . . . . 74.530000000000001 111.104 179.657 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 70.5 m-20 -71.21 -39.44 71.74 Favored 'General case' 0 N--CA 1.481 1.112 0 C-N-CA 123.383 0.673 . . . . 62.100000000000001 111.02 179.085 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 63' ' ' MET . . . . . . . . . . . . . 71.0 mtm -71.31 -41.58 69.72 Favored 'General case' 0 N--CA 1.481 1.099 0 C-N-CA 122.923 0.489 . . . . 70.430000000000007 111.649 -178.997 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 64' ' ' VAL . . . . . 0.46 ' O ' HG13 ' A' ' 68' ' ' ILE . 85.8 t -67.9 -55.69 15.8 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.755 0 N-CA-C 109.531 -0.544 . . . . 62.43 109.531 179.497 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . 0.559 ' HB3' HD22 ' A' ' 109' ' ' LEU . . . -63.07 -28.38 70.04 Favored 'General case' 0 N--CA 1.488 1.472 0 O-C-N 123.351 0.407 . . . . 73.219999999999999 110.849 178.594 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -67.02 -40.79 93.32 Favored Glycine 0 C--N 1.35 1.345 0 O-C-N 123.562 0.539 . . . . 53.219999999999999 112.519 175.531 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 16.6 m-30 -72.54 -38.82 67.91 Favored 'General case' 0 N--CA 1.48 1.074 0 C-N-CA 123.328 0.651 . . . . 75.439999999999998 110.988 178.189 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 68' ' ' ILE . . . . . 0.545 ' O ' ' HG ' ' A' ' 72' ' ' LEU . 78.3 mt -57.96 -50.43 77.93 Favored 'Isoleucine or valine' 0 C--N 1.353 0.736 0 O-C-N 124.575 1.172 . . . . 75.430000000000007 108.361 173.783 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 69' ' ' LYS . . . . . 0.59 ' HB2' ' HE2' ' A' ' 106' ' ' TYR . 0.7 OUTLIER -57.83 -49.07 77.92 Favored 'General case' 0 C--N 1.353 0.757 0 C-N-CA 123.886 0.874 . . . . 73.140000000000001 110.673 -178.847 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 70' ' ' GLN . . . . . 0.441 ' NE2' HE21 ' A' ' 19' ' ' GLN . 58.9 tt0 -58.25 -44.88 88.53 Favored 'General case' 0 N--CA 1.471 0.593 0 O-C-N 124.705 1.253 . . . . 75.510000000000005 110.784 -176.984 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 71' ' ' THR . . . . . 0.587 ' HB ' ' HA ' ' A' ' 15' ' ' ALA . 12.8 t -76.93 -22.43 53.31 Favored 'General case' 0 C--O 1.21 -0.999 0 CA-C-O 118.846 -0.597 . . . . 74.030000000000001 110.344 -177.965 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 72' ' ' LEU . . . . . 0.696 HD22 ' HB3' ' A' ' 102' ' ' LEU . 40.5 mt -72.23 -32.98 67.21 Favored 'General case' 0 N--CA 1.49 1.57 0 CA-C-N 118.136 0.426 . . . . 75.540000000000006 110.789 173.5 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 38.8 m-20 -64.13 -49.87 70.47 Favored 'General case' 0 N--CA 1.477 0.91 0 N-CA-C 108.542 -0.91 . . . . 62.25 108.542 172.071 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 70.5 m-20 -62.28 -37.08 84.12 Favored 'General case' 0 N--CA 1.478 0.964 0 CA-C-N 115.037 -0.983 . . . . 75.129999999999995 111.566 179.96 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . 0.43 ' HG2' ' O ' ' A' ' 71' ' ' THR . 17.2 mm-40 -66.47 -51.62 54.89 Favored 'General case' 0 N--CA 1.481 1.094 0 C-N-CA 123.316 0.646 . . . . 72.450000000000003 110.275 178.667 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 9.1 tt0 -58.09 -48.85 78.9 Favored 'General case' 0 N--CA 1.475 0.818 0 O-C-N 123.492 0.495 . . . . 75.299999999999997 110.807 -177.778 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 96.8 mt -63.63 -57.13 11.03 Favored 'General case' 0 N--CA 1.471 0.625 0 O-C-N 123.975 0.797 . . . . 75.0 111.043 -176.959 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . 0.723 HD23 ' HA ' ' A' ' 22' ' ' LEU . 82.4 mt -63.54 -66.47 0.54 Allowed 'General case' 0 N--CA 1.481 1.107 0 O-C-N 123.553 0.533 . . . . 73.409999999999997 111.785 -178.514 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 33.0 mmtp -59.54 -35.15 73.66 Favored 'General case' 0 N--CA 1.475 0.793 0 O-C-N 124.219 0.95 . . . . 73.140000000000001 110.928 -173.808 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -66.69 -40.26 93.91 Favored Glycine 0 C--N 1.355 1.606 0 O-C-N 123.526 0.516 . . . . 71.409999999999997 113.019 175.069 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 8.2 tt -66.21 -36.96 84.42 Favored 'General case' 0 N--CA 1.485 1.322 0 C-N-CA 123.465 0.706 . . . . 75.510000000000005 109.737 177.092 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 95.1 mt . . . . . 0 N--CA 1.473 0.71 0 C-N-CA 123.955 0.902 . . . . 75.209999999999994 111.328 -175.516 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 92' ' ' LEU . . . . . 0.657 HD21 ' HB3' ' A' ' 41' ' ' LEU . 94.7 mt . . . . . 0 CA--C 1.537 0.463 0 CA-C-O 120.6 0.238 . . . . 63.520000000000003 110.607 . . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 42.6 mt -124.46 65.87 0.3 Allowed 'Isoleucine or valine' 0 CA--C 1.546 0.811 0 N-CA-C 107.537 -1.282 . . . . 74.120000000000005 107.537 172.621 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 48.39 -87.53 0.01 OUTLIER Glycine 0 C--N 1.363 2.081 0 CA-C-N 114.219 -1.355 . . . . 65.239999999999995 115.157 172.322 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 5.8 pm0 -66.49 -173.52 0.22 Allowed 'General case' 0 N--CA 1.477 0.878 0 C-N-CA 124.564 1.145 . . . . 75.120000000000005 111.461 178.628 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 44.5 m -80.42 38.57 0.43 Allowed 'General case' 0 CA--C 1.545 0.78 0 N-CA-C 113.289 0.848 . . . . 60.310000000000002 113.289 -173.037 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 39.1 m -49.48 -61.12 2.28 Favored 'General case' 0 N--CA 1.48 1.026 0 C-N-CA 124.014 0.926 . . . . 75.450000000000003 110.828 173.028 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 98' ' ' ARG . . . . . 0.629 ' HD2' ' HB2' ' A' ' 92' ' ' LEU . 0.0 OUTLIER -47.62 -56.07 7.99 Favored 'General case' 0 CA--C 1.552 1.036 0 C-N-CA 125.955 1.702 . . . . 75.439999999999998 113.533 178.306 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 31.0 mm-40 -66.28 -43.65 85.78 Favored 'General case' 0 N--CA 1.482 1.157 0 C-N-CA 122.968 0.507 . . . . 74.519999999999996 111.068 -175.375 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 13.8 tmtt? -63.36 -38.13 89.97 Favored 'General case' 0 C--O 1.217 -0.629 0 CA-C-N 114.897 -1.047 . . . . 74.019999999999996 110.638 178.579 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 101' ' ' SER . . . . . 0.543 ' HB2' ' SD ' ' A' ' 48' ' ' MET . 73.1 m -78.33 -32.15 49.06 Favored 'General case' 0 N--CA 1.479 0.981 0 C-N-CA 123.08 0.552 . . . . 74.109999999999999 112.076 -172.9 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 102' ' ' LEU . . . . . 0.696 ' HB3' HD22 ' A' ' 72' ' ' LEU . 10.0 mp -71.29 -43.3 67.41 Favored 'General case' 0 N--CA 1.483 1.184 0 N-CA-C 110.074 -0.343 . . . . 72.109999999999999 110.074 172.561 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 8.9 t30 -64.08 -41.01 97.47 Favored 'General case' 0 N--CA 1.481 1.079 0 CA-C-O 121.159 0.504 . . . . 75.230000000000004 110.507 176.625 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 7.2 t30 -64.05 -39.3 93.77 Favored 'General case' 0 N--CA 1.478 0.958 0 C-N-CA 124.397 1.079 . . . . 75.219999999999999 109.469 176.54 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -59.41 -48.39 81.82 Favored 'General case' 0 C--N 1.347 0.467 0 O-C-N 124.049 0.843 . . . . 74.319999999999993 110.444 178.598 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 106' ' ' TYR . . . . . 0.59 ' HE2' ' HB2' ' A' ' 69' ' ' LYS . 20.0 t80 -59.47 -56.32 23.44 Favored 'General case' 0 CA--C 1.55 0.957 0 O-C-N 123.867 0.73 . . . . 73.099999999999994 111.074 179.8 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -69.0 -41.01 83.62 Favored Glycine 0 C--N 1.347 1.194 0 O-C-N 123.989 0.805 . . . . 73.0 113.302 -171.272 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 5.5 mmp_? -68.91 -33.91 74.53 Favored 'General case' 0 C--N 1.349 0.578 0 CA-C-O 119.258 -0.401 . . . . 65.200000000000003 110.455 177.42 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 109' ' ' LEU . . . . . 0.559 HD22 ' HB3' ' A' ' 65' ' ' ALA . 47.3 tp -61.56 -44.8 96.37 Favored 'General case' 0 N--CA 1.482 1.162 0 CA-C-O 120.888 0.375 . . . . 73.310000000000002 110.301 175.388 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 10.9 t -69.58 -34.28 73.91 Favored 'General case' 0 CA--C 1.554 1.127 0 CA-C-N 114.749 -1.114 . . . . 72.430000000000007 110.938 -179.043 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . -91.2 -63.27 1.19 Allowed Glycine 0 C--N 1.357 1.735 0 N-CA-C 114.454 0.542 . . . . 63.240000000000002 114.454 -177.649 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 112' ' ' MET . . . . . . . . . . . . . 3.8 mmm -93.13 -68.92 0.77 Allowed 'General case' 0 N--CA 1.489 1.481 0 CA-C-N 117.454 0.627 . . . . 72.310000000000002 112.021 -178.578 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 23.8 tp 174.01 13.41 0.0 OUTLIER 'General case' 0 N--CA 1.492 1.635 0 C-N-CA 125.172 1.389 . . . . 74.450000000000003 110.018 178.28 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 114' ' ' LEU . . . . . 0.449 ' N ' ' HA ' ' A' ' 109' ' ' LEU . 2.5 tt . . . . . 0 N--CA 1.5 2.063 0 C-N-CA 126.683 1.993 . . . . 74.230000000000004 109.842 -170.321 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 1' ' ' MET . . . . . 0.454 ' HG3' HG22 ' A' ' 5' ' ' VAL . 16.7 ptt? . . . . . 0 N--CA 1.486 1.329 0 CA-C-O 120.683 0.278 . . . . 72.120000000000005 110.65 . . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 9.2 t -54.6 -40.32 68.74 Favored 'General case' 0 N--CA 1.483 1.216 0 C-N-CA 123.353 0.661 . . . . 74.219999999999999 112.725 -172.766 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 17.2 m -72.46 -32.42 66.23 Favored 'General case' 0 N--CA 1.479 1.019 0 C-N-CA 123.247 0.619 . . . . 73.030000000000001 111.4 -178.758 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 52.5 m -74.57 -39.11 62.45 Favored 'General case' 0 C--O 1.217 -0.64 0 C-N-CA 123.07 0.548 . . . . 61.32 110.295 178.233 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 5' ' ' VAL . . . . . 0.454 HG22 ' HG3' ' A' ' 1' ' ' MET . 90.2 t -63.77 -40.48 89.2 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.905 0 C-N-CA 123.309 0.644 . . . . 73.230000000000004 109.297 176.581 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 33.9 mm-40 -57.1 -51.98 67.11 Favored 'General case' 0 N--CA 1.473 0.685 0 O-C-N 123.939 0.774 . . . . 71.129999999999995 110.625 171.228 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 42.6 t80 -61.88 -43.86 97.99 Favored 'General case' 0 CA--C 1.552 1.027 0 C-N-CA 124.106 0.962 . . . . 74.219999999999999 111.337 -173.464 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 8' ' ' ILE . . . . . 0.433 HD13 HG21 ' A' ' 60' ' ' ILE . 77.5 mt -63.84 -45.19 97.76 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.873 0 C-N-CA 123.772 0.829 . . . . 75.430000000000007 109.357 176.473 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 28.5 t-20 -67.09 -27.41 67.33 Favored 'General case' 0 N--CA 1.479 0.991 0 C-N-CA 123.834 0.854 . . . . 75.349999999999994 111.54 -177.25 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . 0.55 ' HB3' HG22 ' A' ' 47' ' ' VAL . 50.8 mtt180 -81.46 -28.02 34.34 Favored 'General case' 0 CA--C 1.543 0.684 0 C-N-CA 123.394 0.678 . . . . 75.310000000000002 110.191 176.477 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 11' ' ' TRP . . . . . . . . . . . . . 61.2 m95 -74.53 -28.21 60.87 Favored 'General case' 0 N--CA 1.474 0.774 0 CA-C-O 119.313 -0.375 . . . . 73.25 110.828 167.663 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . 0.47 ' HG2' ' CE2' ' A' ' 67' ' ' TYR . 41.1 mt-30 -67.52 -38.79 84.76 Favored 'General case' 0 C--N 1.358 0.956 0 N-CA-C 108.064 -1.087 . . . . 64.329999999999998 108.064 170.165 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 32.2 tpt180 -57.1 -55.54 33.38 Favored 'General case' 0 CA--C 1.542 0.643 0 CA-C-N 115.328 -0.851 . . . . 74.299999999999997 109.984 179.753 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 14' ' ' ILE . . . . . 0.413 HG23 ' OG1' ' A' ' 71' ' ' THR . 19.1 mt -64.81 -45.97 93.41 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.357 0 O-C-N 122.938 0.148 . . . . 73.340000000000003 111.001 179.806 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . 0.597 ' HA ' ' HB ' ' A' ' 71' ' ' THR . . . -58.05 -48.52 79.84 Favored 'General case' 0 N--CA 1.487 1.399 0 C-N-CA 124.406 1.082 . . . . 70.530000000000001 112.154 -176.426 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 87.0 mt -78.64 -37.44 42.09 Favored 'General case' 0 N--CA 1.48 1.051 0 CA-C-N 114.902 -1.045 . . . . 73.530000000000001 110.903 -173.085 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . 0.495 ' O ' ' HG ' ' A' ' 21' ' ' LEU . 59.0 mt -62.46 -48.1 81.12 Favored 'General case' 0 N--CA 1.479 0.976 0 O-C-N 123.344 0.403 . . . . 73.140000000000001 110.461 176.816 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 78.5 p -64.63 -38.34 90.68 Favored 'General case' 0 N--CA 1.475 0.808 0 C-N-CA 123.01 0.524 . . . . 62.549999999999997 111.125 -179.804 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 7.0 tp-100 -60.83 -42.33 97.52 Favored 'General case' 0 C--N 1.354 0.782 0 O-C-N 123.704 0.628 . . . . 71.420000000000002 110.625 175.207 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 48.6 m -60.89 -48.77 80.31 Favored 'General case' 0 C--N 1.346 0.441 0 O-C-N 123.391 0.432 . . . . 65.329999999999998 110.071 175.611 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . 0.538 HD22 ' HA ' ' A' ' 33' ' ' LEU . 59.2 mt -64.8 -26.91 68.55 Favored 'General case' 0 N--CA 1.471 0.624 0 C-N-CA 123.62 0.768 . . . . 74.129999999999995 110.836 -178.114 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . 0.609 ' HA ' HD23 ' A' ' 78' ' ' LEU . 46.0 tp -68.07 -58.35 4.64 Favored 'General case' 0 C--N 1.35 0.599 0 C-N-CA 123.376 0.67 . . . . 73.319999999999993 109.564 176.767 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 41.0 mt-10 -53.91 -46.03 71.34 Favored 'General case' 0 N--CA 1.48 1.031 0 C-N-CA 124.147 0.979 . . . . 75.239999999999995 111.073 -179.955 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . 0.492 ' HB3' ' HB2' ' A' ' 29' ' ' GLU . 96.0 mt -67.08 -46.89 72.9 Favored 'General case' 0 CA--C 1.538 0.511 0 CA-C-N 114.661 -1.154 . . . . 72.310000000000002 111.455 -176.623 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . 0.402 ' HB1' HD23 ' A' ' 33' ' ' LEU . . . -64.16 -34.25 77.65 Favored 'General case' 0 N--CA 1.484 1.25 0 CA-C-N 117.971 0.351 . . . . 64.329999999999998 111.501 -179.555 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 98.0 mt-30 -63.65 -38.43 91.09 Favored 'General case' 0 N--CA 1.482 1.143 0 C-N-CA 123.333 0.653 . . . . 64.5 110.61 173.681 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 97.2 mtt180 -75.78 -17.39 59.89 Favored 'General case' 0 N--CA 1.483 1.197 0 C-N-CA 123.161 0.584 . . . . 70.209999999999994 111.868 174.775 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 92.3 20.79 34.31 Favored Glycine 0 C--N 1.346 1.127 0 N-CA-C 112.727 -0.149 . . . . 71.129999999999995 112.727 179.078 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 29' ' ' GLU . . . . . 0.492 ' HB2' ' HB3' ' A' ' 24' ' ' LEU . 49.3 mm-40 -84.54 68.77 10.44 Favored 'General case' 0 C--O 1.238 0.452 0 C-N-CA 124.312 1.045 . . . . 74.420000000000002 110.871 -179.775 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 30' ' ' TRP . . . . . . . . . . . . . 24.8 m95 -63.68 -42.18 98.07 Favored 'General case' 0 N--CA 1.475 0.788 0 CA-C-N 115.114 -0.948 . . . . 74.209999999999994 111.097 -176.134 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 9.8 m-20 -60.62 -41.68 95.33 Favored 'General case' 0 N--CA 1.478 0.971 0 C-N-CA 123.48 0.712 . . . . 74.219999999999999 110.893 -178.813 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . 0.494 HD22 ' NE2' ' A' ' 35' ' ' GLN . 72.6 mt -64.47 -37.03 86.11 Favored 'General case' 0 N--CA 1.478 0.941 0 O-C-N 123.61 0.569 . . . . 74.439999999999998 111.211 -178.907 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . 0.538 ' HA ' HD22 ' A' ' 21' ' ' LEU . 10.7 mp -61.74 -46.92 87.54 Favored 'General case' 0 N--CA 1.486 1.325 0 CA-C-O 120.719 0.295 . . . . 74.120000000000005 110.24 172.365 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 91.2 mt -67.66 -26.97 66.47 Favored 'General case' 0 CA--C 1.549 0.915 0 C-N-CA 123.482 0.713 . . . . 74.109999999999999 112.18 -177.227 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 35' ' ' GLN . . . . . 0.494 ' NE2' HD22 ' A' ' 32' ' ' LEU . 48.5 mt-30 -77.96 -36.78 48.72 Favored 'General case' 0 N--CA 1.48 1.035 0 C-N-CA 123.304 0.642 . . . . 74.129999999999995 110.619 176.705 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 30.9 mm-40 -82.79 -15.24 52.47 Favored 'General case' 0 N--CA 1.483 1.188 0 C-N-CA 123.09 0.556 . . . . 74.109999999999999 111.532 177.931 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . 0.41 ' O ' ' HG ' ' A' ' 41' ' ' LEU . 31.8 tt0 -45.49 -57.47 4.1 Favored 'General case' 0 N--CA 1.481 1.086 0 C-N-CA 124.681 1.192 . . . . 73.510000000000005 112.972 -174.823 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 46.1 t -58.04 -39.88 74.31 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.143 0 C-N-CA 123.344 0.658 . . . . 74.549999999999997 111.378 -175.514 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 74.3 m -68.38 -43.7 76.78 Favored 'General case' 0 N--CA 1.474 0.739 0 C-N-CA 123.097 0.559 . . . . 72.129999999999995 111.272 179.189 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 34.9 t80 -64.96 -47.51 77.36 Favored 'General case' 0 N--CA 1.471 0.61 0 O-C-N 123.824 0.703 . . . . 71.099999999999994 110.059 -177.128 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . 0.41 ' HG ' ' O ' ' A' ' 37' ' ' GLU . 57.8 mt -59.81 -50.53 73.46 Favored 'General case' 0 C--N 1.351 0.667 0 O-C-N 124.636 1.21 . . . . 74.349999999999994 110.082 178.952 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 53.4 tt0 -60.22 -41.72 93.69 Favored 'General case' 0 N--CA 1.476 0.87 0 O-C-N 123.637 0.585 . . . . 72.340000000000003 111.497 -178.442 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 43' ' ' SER . . . . . 0.467 ' O ' HG21 ' A' ' 47' ' ' VAL . 70.2 m -60.85 -60.38 3.88 Favored 'General case' 0 N--CA 1.471 0.591 0 C-N-CA 123.169 0.588 . . . . 75.310000000000002 110.641 -179.102 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 44' ' ' ILE . . . . . 0.46 HG12 ' HE2' ' A' ' 48' ' ' MET . 16.3 tt -63.37 -30.33 49.5 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.977 0 O-C-N 123.808 0.692 . . . . 72.420000000000002 111.321 -175.57 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 9.6 mm-40 -59.38 -55.12 38.7 Favored 'General case' 0 N--CA 1.481 1.103 0 C-N-CA 123.301 0.64 . . . . 74.420000000000002 110.796 171.226 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 19.9 m -67.18 -23.8 65.8 Favored 'General case' 0 CA--C 1.55 0.967 0 CA-C-N 115.656 -0.702 . . . . 75.209999999999994 111.652 -174.369 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 47' ' ' VAL . . . . . 0.55 HG22 ' HB3' ' A' ' 10' ' ' ARG . 40.4 t -83.28 -35.82 12.2 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.086 0 C-N-CA 122.618 0.367 . . . . 72.329999999999998 111.143 176.532 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 48' ' ' MET . . . . . 0.46 ' HE2' HG12 ' A' ' 44' ' ' ILE . 74.6 mtm -70.13 -34.93 73.69 Favored 'General case' 0 N--CA 1.49 1.567 0 C-N-CA 122.504 0.321 . . . . 72.310000000000002 111.476 179.398 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 10.9 pt-20 -78.01 -22.53 49.16 Favored 'General case' 0 N--CA 1.478 0.964 0 C-N-CA 122.347 0.259 . . . . 75.099999999999994 110.443 175.776 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 15.0 tppt? -69.21 133.77 48.39 Favored 'General case' 0 N--CA 1.473 0.686 0 C-N-CA 123.61 0.764 . . . . 74.040000000000006 111.117 -174.207 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 8.3 tt0 -83.72 128.41 34.51 Favored 'General case' 0 C--O 1.239 0.535 0 N-CA-C 108.886 -0.783 . . . . 73.409999999999997 108.886 174.757 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 17.1 m -70.36 134.29 86.95 Favored Pre-proline 0 CA--C 1.551 0.99 0 C-N-CA 124.058 0.943 . . . . 62.450000000000003 110.658 178.995 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 24.2 Cg_exo -66.5 152.52 80.65 Favored 'Trans proline' 0 C--N 1.378 2.089 0 C-N-CA 121.908 1.739 . . . . 74.549999999999997 111.961 171.954 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 21.3 Cg_exo -67.36 -46.78 2.61 Favored 'Trans proline' 0 C--N 1.372 1.809 0 C-N-CA 122.998 2.465 . . . . 64.109999999999999 111.685 173.354 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . -66.22 81.28 0.1 Allowed Glycine 0 C--N 1.351 1.396 0 O-C-N 124.112 0.882 . . . . 74.209999999999994 113.455 -178.651 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 56' ' ' ILE . . . . . 0.541 ' HB ' HD11 ' A' ' 113' ' ' LEU . 6.9 mt -137.87 117.6 15.37 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.515 0 C-N-CA 125.54 1.536 . . . . 75.120000000000005 107.702 178.325 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 57' ' ' THR . . . . . 0.454 ' H ' HD12 ' A' ' 60' ' ' ILE . 47.4 p -78.01 -178.26 5.44 Favored 'General case' 0 N--CA 1.473 0.682 0 C-N-CA 123.863 0.865 . . . . 71.450000000000003 110.482 -179.271 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 28.4 tpt180 -65.19 -45.17 85.88 Favored 'General case' 0 CA--C 1.542 0.644 0 CA-C-N 116.248 -0.433 . . . . 75.109999999999999 110.019 174.881 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 40.3 m -58.53 -42.46 87.82 Favored 'General case' 0 N--CA 1.485 1.276 0 CA-C-O 121.405 0.621 . . . . 71.519999999999996 111.096 179.732 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 60' ' ' ILE . . . . . 0.454 HD12 ' H ' ' A' ' 57' ' ' THR . 83.7 mt -66.68 -41.19 87.73 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.522 0 CA-C-N 115.073 -0.967 . . . . 75.319999999999993 110.104 178.25 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 58.9 tt0 -62.17 -36.22 81.19 Favored 'General case' 0 CA--C 1.547 0.844 0 C-N-CA 123.393 0.677 . . . . 73.439999999999998 110.43 177.332 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 65.9 m-20 -66.05 -46.55 77.39 Favored 'General case' 0 N--CA 1.48 1.057 0 C-N-CA 123.288 0.635 . . . . 72.120000000000005 110.764 178.518 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 63' ' ' MET . . . . . . . . . . . . . 71.1 mtm -65.74 -51.9 55.5 Favored 'General case' 0 N--CA 1.482 1.175 0 O-C-N 123.557 0.536 . . . . 43.409999999999997 111.16 -179.007 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 64' ' ' VAL . . . . . 0.505 ' O ' HG13 ' A' ' 68' ' ' ILE . 77.1 t -57.98 -56.17 17.41 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.725 0 C-N-CA 123.955 0.902 . . . . 74.549999999999997 110.809 179.997 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . 0.426 ' HB1' HD23 ' A' ' 109' ' ' LEU . . . -59.14 -42.2 90.13 Favored 'General case' 0 N--CA 1.487 1.41 0 C-N-CA 123.05 0.54 . . . . 64.0 110.767 179.837 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -56.34 -42.69 89.36 Favored Glycine 0 C--N 1.344 1.026 0 O-C-N 124.153 0.908 . . . . 63.240000000000002 112.12 176.814 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 67' ' ' TYR . . . . . 0.47 ' CE2' ' HG2' ' A' ' 12' ' ' GLN . 16.7 m-30 -70.7 -37.79 73.6 Favored 'General case' 0 N--CA 1.478 0.945 0 C-N-CA 123.847 0.859 . . . . 75.030000000000001 111.946 179.09 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 68' ' ' ILE . . . . . 0.505 HG13 ' O ' ' A' ' 64' ' ' VAL . 64.7 mt -58.44 -58.88 4.69 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.027 0 O-C-N 124.169 0.918 . . . . 75.340000000000003 108.851 179.185 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 69' ' ' LYS . . . . . 0.461 ' HB2' ' HE2' ' A' ' 106' ' ' TYR . 20.1 ttpp -60.63 -41.12 94.23 Favored 'General case' 0 C--N 1.347 0.462 0 O-C-N 124.151 0.907 . . . . 75.040000000000006 110.243 -179.143 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 62.3 tt0 -57.02 -47.98 79.59 Favored 'General case' 0 N--CA 1.478 0.95 0 C-N-CA 123.538 0.735 . . . . 71.209999999999994 111.406 -178.788 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 71' ' ' THR . . . . . 0.597 ' HB ' ' HA ' ' A' ' 15' ' ' ALA . 9.1 t -77.64 -25.47 49.7 Favored 'General case' 0 C--N 1.351 0.647 0 N-CA-C 110.07 -0.345 . . . . 73.530000000000001 110.07 -175.469 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 72' ' ' LEU . . . . . 0.462 ' HG ' ' O ' ' A' ' 68' ' ' ILE . 37.5 mt -67.75 -38.8 83.95 Favored 'General case' 0 C--O 1.209 -1.07 0 O-C-N 123.507 0.504 . . . . 74.329999999999998 110.107 171.026 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 75.2 m-20 -73.62 -41.22 63.08 Favored 'General case' 0 N--CA 1.484 1.234 0 C-N-CA 123.53 0.732 . . . . 75.299999999999997 110.995 -178.544 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 74' ' ' ASN . . . . . 0.422 ' HA ' HD21 ' A' ' 22' ' ' LEU . 86.4 m-20 -61.79 -52.11 65.55 Favored 'General case' 0 N--CA 1.475 0.804 0 O-C-N 123.911 0.757 . . . . 71.510000000000005 109.558 178.491 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . 0.416 ' O ' ' HG2' ' A' ' 79' ' ' LYS . 17.3 tt0 -76.58 -19.22 58.11 Favored 'General case' 0 CA--C 1.552 1.042 0 CA-C-N 115.642 -0.708 . . . . 73.219999999999999 111.688 -178.101 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 9.8 tt0 -68.65 -46.74 68.37 Favored 'General case' 0 N--CA 1.488 1.448 0 N-CA-C 109.547 -0.538 . . . . 75.049999999999997 109.547 173.6 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 92.3 mt -61.26 -38.87 88.26 Favored 'General case' 0 C--N 1.346 0.449 0 CA-C-N 115.661 -0.699 . . . . 62.340000000000003 109.623 174.449 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . 0.609 HD23 ' HA ' ' A' ' 22' ' ' LEU . 50.3 mt -59.07 -42.64 90.87 Favored 'General case' 0 C--N 1.358 0.962 0 O-C-N 123.92 0.762 . . . . 75.120000000000005 111.833 172.805 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 79' ' ' LYS . . . . . 0.416 ' HG2' ' O ' ' A' ' 75' ' ' GLU . 28.9 mmtm -57.08 -47.15 81.71 Favored 'General case' 0 N--CA 1.482 1.135 0 N-CA-C 109.735 -0.469 . . . . 74.450000000000003 109.735 176.608 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -67.6 -28.75 73.56 Favored Glycine 0 C--N 1.344 0.998 0 O-C-N 124.518 1.136 . . . . 54.340000000000003 114.17 178.754 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 5.8 tt -85.43 -39.56 17.4 Favored 'General case' 0 N--CA 1.478 0.925 0 C-N-CA 124.309 1.044 . . . . 73.439999999999998 110.528 -173.279 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 67.5 mt . . . . . 0 CA--C 1.548 0.885 0 C-N-CA 123.704 0.801 . . . . 74.409999999999997 111.265 -169.847 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 92' ' ' LEU . . . . . 0.488 HD11 ' HG2' ' A' ' 98' ' ' ARG . 80.7 mt . . . . . 0 N--CA 1.476 0.861 0 N-CA-C 108.492 -0.929 . . . . 61.420000000000002 108.492 . . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 28.3 mt -45.84 -43.83 4.55 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.819 0 C-N-CA 123.87 0.868 . . . . 75.239999999999995 110.535 171.629 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -171.09 158.96 30.74 Favored Glycine 0 C--O 1.252 1.225 0 CA-C-N 114.227 -1.352 . . . . 72.120000000000005 111.167 175.162 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 4.9 pm0 -55.56 127.34 29.3 Favored 'General case' 0 CA--C 1.552 1.056 0 C-N-CA 124.248 1.019 . . . . 72.219999999999999 110.126 172.224 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 20.1 t 76.52 -46.29 0.52 Allowed 'General case' 0 N--CA 1.487 1.397 0 C-N-CA 125.618 1.567 . . . . 73.430000000000007 113.824 178.126 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 6.5 t -52.4 -32.32 38.4 Favored 'General case' 0 N--CA 1.491 1.583 0 C-N-CA 123.947 0.899 . . . . 73.409999999999997 112.624 -169.163 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 98' ' ' ARG . . . . . 0.488 ' HG2' HD11 ' A' ' 92' ' ' LEU . 0.0 OUTLIER -68.12 -33.84 75.26 Favored 'General case' 0 CA--C 1.55 0.961 0 O-C-N 123.875 0.734 . . . . 75.200000000000003 112.852 -175.076 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 27.4 mt-30 -66.51 -39.65 88.79 Favored 'General case' 0 N--CA 1.481 1.118 0 N-CA-C 109.176 -0.675 . . . . 75.010000000000005 109.176 175.649 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 100' ' ' LYS . . . . . 0.505 ' HZ2' ' HA ' ' A' ' 100' ' ' LYS . 0.0 OUTLIER -66.29 -35.69 81.04 Favored 'General case' 0 C--O 1.214 -0.779 0 CA-C-N 115.153 -0.93 . . . . 73.109999999999999 110.497 172.697 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 62.4 m -63.53 -45.12 92.06 Favored 'General case' 0 N--CA 1.479 0.987 0 C-N-CA 123.152 0.581 . . . . 75.049999999999997 111.292 -177.226 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 9.1 mp -76.17 -38.79 56.18 Favored 'General case' 0 N--CA 1.485 1.323 0 O-C-N 123.186 0.304 . . . . 75.140000000000001 111.494 179.103 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 4.4 t-20 -63.52 -40.32 96.72 Favored 'General case' 0 N--CA 1.486 1.342 0 CA-C-O 121.244 0.545 . . . . 50.520000000000003 110.684 177.374 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 26.1 t-20 -72.27 -38.77 68.76 Favored 'General case' 0 N--CA 1.471 0.584 0 CA-C-N 115.271 -0.877 . . . . 72.519999999999996 109.492 178.876 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -62.59 -31.36 72.18 Favored 'General case' 0 N--CA 1.476 0.848 0 C-N-CA 123.408 0.683 . . . . 70.150000000000006 111.079 175.863 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 106' ' ' TYR . . . . . 0.461 ' HE2' ' HB2' ' A' ' 69' ' ' LYS . 2.9 t80 -67.71 -50.56 56.85 Favored 'General case' 0 C--N 1.35 0.628 0 N-CA-C 108.921 -0.77 . . . . 72.319999999999993 108.921 175.808 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -62.86 -30.3 76.75 Favored Glycine 0 C--N 1.351 1.381 0 O-C-N 123.608 0.568 . . . . 74.510000000000005 113.107 177.377 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 1.2 mpt_? -77.14 -29.43 54.65 Favored 'General case' 0 N--CA 1.468 0.461 0 C-N-CA 123.985 0.914 . . . . 75.409999999999997 110.185 176.67 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 109' ' ' LEU . . . . . 0.486 HD12 ' HB2' ' A' ' 114' ' ' LEU . 34.6 tp -71.7 -34.92 70.03 Favored 'General case' 0 N--CA 1.479 1.018 0 N-CA-C 109.393 -0.595 . . . . 74.540000000000006 109.393 175.08 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 47.9 t -66.04 -42.93 88.93 Favored 'General case' 0 CA--C 1.54 0.578 0 CA-C-N 114.912 -1.04 . . . . 74.409999999999997 109.819 173.52 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . -90.27 -68.07 1.21 Allowed Glycine 0 C--N 1.364 2.138 0 CA-C-O 119.027 -0.874 . . . . 62.530000000000001 114.8 -175.816 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 112' ' ' MET . . . . . . . . . . . . . 2.8 tmm? -97.85 -66.33 0.91 Allowed 'General case' 0 N--CA 1.488 1.447 0 CA-C-N 118.647 1.224 . . . . 74.299999999999997 113.049 -174.078 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 113' ' ' LEU . . . . . 0.541 HD11 ' HB ' ' A' ' 56' ' ' ILE . 0.2 OUTLIER 171.39 50.29 0.0 OUTLIER 'General case' 0 N--CA 1.495 1.786 0 C-N-CA 124.324 1.049 . . . . 74.420000000000002 109.866 178.164 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 114' ' ' LEU . . . . . 0.486 ' HB2' HD12 ' A' ' 109' ' ' LEU . 6.0 tt . . . . . 0 N--CA 1.501 2.088 0 C-N-CA 126.136 1.774 . . . . 71.430000000000007 112.17 175.608 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 1' ' ' MET . . . . . 0.461 ' HG2' HG23 ' A' ' 5' ' ' VAL . 25.1 ttt . . . . . 0 CA--C 1.554 1.106 0 CA-C-O 119.738 -0.173 . . . . 72.420000000000002 110.938 . . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 39.8 p -51.29 -40.39 58.87 Favored 'General case' 0 N--CA 1.486 1.357 0 C-N-CA 123.802 0.841 . . . . 75.319999999999993 112.638 -174.643 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 79.6 p -64.88 -41.98 95.19 Favored 'General case' 0 C--N 1.357 0.895 0 O-C-N 123.456 0.472 . . . . 73.239999999999995 110.436 -178.268 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 4' ' ' THR . . . . . 0.467 ' HA ' ' HG2' ' A' ' 53' ' ' PRO . 33.5 m -67.57 -47.08 70.83 Favored 'General case' 0 C--N 1.356 0.878 0 O-C-N 123.632 0.582 . . . . 74.120000000000005 111.278 178.968 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 5' ' ' VAL . . . . . 0.461 HG23 ' HG2' ' A' ' 1' ' ' MET . 64.1 t -60.39 -43.27 93.55 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.411 0 C-N-CA 123.546 0.738 . . . . 71.200000000000003 110.708 -178.606 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 6' ' ' GLU . . . . . 0.46 ' O ' ' HG3' ' A' ' 10' ' ' ARG . 3.2 tm-20 -71.87 -34.2 69.02 Favored 'General case' 0 CA--C 1.54 0.594 0 CA-C-N 114.727 -1.124 . . . . 75.099999999999994 109.822 -178.014 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 59.4 t80 -67.72 -39.22 84.31 Favored 'General case' 0 CA--C 1.553 1.064 0 C-N-CA 123.578 0.751 . . . . 74.329999999999998 110.807 176.545 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 8' ' ' ILE . . . . . 0.418 HG13 ' O ' ' A' ' 4' ' ' THR . 87.8 mt -64.07 -39.94 87.28 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.965 0 N-CA-C 109.058 -0.719 . . . . 75.209999999999994 109.058 174.054 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 3.8 t-20 -66.63 -30.74 71.08 Favored 'General case' 0 C--N 1.354 0.779 0 O-C-N 123.919 0.762 . . . . 71.150000000000006 110.57 179.434 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . 0.46 ' HG3' ' O ' ' A' ' 6' ' ' GLU . 85.4 mtt180 -64.58 -46.08 84.27 Favored 'General case' 0 N--CA 1.477 0.91 0 C-N-CA 123.211 0.605 . . . . 71.510000000000005 109.745 173.349 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 11' ' ' TRP . . . . . 0.426 ' CD1' HG11 ' A' ' 64' ' ' VAL . 81.5 m95 -65.65 -31.73 72.92 Favored 'General case' 0 N--CA 1.48 1.033 0 O-C-N 123.618 0.574 . . . . 74.049999999999997 111.962 176.629 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . 0.414 ' HG2' ' CE2' ' A' ' 67' ' ' TYR . 55.3 mt-30 -61.6 -45.86 92.3 Favored 'General case' 0 C--N 1.354 0.776 0 N-CA-C 108.685 -0.857 . . . . 73.439999999999998 108.685 172.718 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . 0.439 ' NH2' ' HB3' ' A' ' 39' ' ' SER . 14.0 tpt180 -61.41 -49.41 76.97 Favored 'General case' 0 CA--C 1.545 0.788 0 O-C-N 123.832 0.708 . . . . 73.209999999999994 110.907 -178.221 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 14' ' ' ILE . . . . . 0.432 HD12 HG23 ' A' ' 47' ' ' VAL . 54.3 mt -62.75 -47.99 90.25 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.409 0 C-N-CA 122.658 0.383 . . . . 74.519999999999996 110.57 -178.785 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . 0.551 ' HA ' ' HB ' ' A' ' 71' ' ' THR . . . -59.07 -45.72 90.11 Favored 'General case' 0 N--CA 1.477 0.924 0 C-N-CA 124.148 0.979 . . . . 73.439999999999998 111.388 -178.249 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 94.5 mt -76.34 -34.13 58.98 Favored 'General case' 0 N--CA 1.482 1.17 0 O-C-N 124.344 1.028 . . . . 72.439999999999998 111.499 -175.885 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . 0.461 ' O ' ' HG ' ' A' ' 21' ' ' LEU . 34.2 mt -64.09 -56.83 12.13 Favored 'General case' 0 N--CA 1.476 0.864 0 N-CA-C 109.242 -0.651 . . . . 72.040000000000006 109.242 176.868 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 69.0 p -63.03 -32.01 73.28 Favored 'General case' 0 N--CA 1.475 0.777 0 O-C-N 124.223 0.952 . . . . 72.109999999999999 111.582 -178.78 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 6.7 tp-100 -59.63 -51.95 67.62 Favored 'General case' 0 N--CA 1.478 0.971 0 C-N-CA 123.662 0.785 . . . . 75.319999999999993 109.861 172.716 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 51.3 m -60.15 -41.97 93.88 Favored 'General case' 0 C--O 1.215 -0.759 0 O-C-N 124.163 0.914 . . . . 74.430000000000007 110.314 177.045 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . 0.564 HD21 ' HA ' ' A' ' 33' ' ' LEU . 35.2 mt -67.65 -33.34 74.76 Favored 'General case' 0 C--N 1.348 0.527 0 C-N-CA 123.035 0.534 . . . . 75.230000000000004 110.849 -176.459 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . 0.545 ' HA ' HD22 ' A' ' 78' ' ' LEU . 47.8 tp -69.83 -49.95 47.54 Favored 'General case' 0 C--O 1.244 0.771 0 O-C-N 123.74 0.65 . . . . 74.219999999999999 109.939 179.041 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . 0.52 ' HB3' ' HE ' ' A' ' 27' ' ' ARG . 42.5 mt-10 -55.21 -60.48 3.33 Favored 'General case' 0 C--N 1.352 0.678 0 O-C-N 124.219 0.949 . . . . 72.129999999999995 110.37 176.941 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . 0.475 HD21 ' HD2' ' A' ' 27' ' ' ARG . 79.1 mt -61.36 -32.19 72.09 Favored 'General case' 0 CA--C 1.542 0.639 0 C-N-CA 124.652 1.181 . . . . 74.239999999999995 111.847 -176.543 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . 0.436 ' HB1' HD22 ' A' ' 33' ' ' LEU . . . -61.22 -49.07 78.62 Favored 'General case' 0 N--CA 1.482 1.131 0 CA-C-O 120.873 0.368 . . . . 71.140000000000001 110.191 174.912 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 95.2 mt-30 -72.11 -22.99 61.25 Favored 'General case' 0 CA--C 1.549 0.924 0 CA-C-N 115.017 -0.992 . . . . 75.239999999999995 111.759 -179.216 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 27' ' ' ARG . . . . . 0.52 ' HE ' ' HB3' ' A' ' 23' ' ' GLU . 47.2 mtt-85 -80.52 -10.03 59.75 Favored 'General case' 0 N--CA 1.485 1.324 0 C-N-CA 123.638 0.775 . . . . 74.310000000000002 110.95 174.179 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 83.39 9.0 84.28 Favored Glycine 0 C--N 1.348 1.228 0 C-N-CA 122.673 0.178 . . . . 72.239999999999995 113.316 -178.8 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 20.9 mm-40 -86.56 55.08 3.4 Favored 'General case' 0 CA--C 1.547 0.846 0 C-N-CA 125.306 1.442 . . . . 74.200000000000003 110.777 178.836 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 30' ' ' TRP . . . . . 0.431 ' O ' ' HG ' ' A' ' 34' ' ' LEU . 86.4 m95 -63.13 -29.03 70.47 Favored 'General case' 0 N--CA 1.481 1.089 0 C-N-CA 123.681 0.792 . . . . 75.120000000000005 111.313 -177.654 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 20.1 m-20 -53.6 -48.93 68.8 Favored 'General case' 0 N--CA 1.48 1.069 0 C-N-CA 123.608 0.763 . . . . 73.340000000000003 110.131 175.43 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . 0.463 HD13 HD22 ' A' ' 24' ' ' LEU . 34.7 mt -63.97 -30.67 71.73 Favored 'General case' 0 CA--C 1.542 0.654 0 CA-C-N 115.094 -0.957 . . . . 71.519999999999996 111.063 -176.242 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . 0.564 ' HA ' HD21 ' A' ' 21' ' ' LEU . 9.8 mp -63.96 -46.3 85.26 Favored 'General case' 0 N--CA 1.477 0.91 0 O-C-N 123.585 0.553 . . . . 75.030000000000001 110.159 171.327 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . 0.431 ' HG ' ' O ' ' A' ' 30' ' ' TRP . 64.6 mt -63.37 -30.78 71.86 Favored 'General case' 0 N--CA 1.484 1.269 0 C-N-CA 123.367 0.667 . . . . 72.040000000000006 112.21 -177.862 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 1.3 mp0 -74.24 -49.06 24.87 Favored 'General case' 0 N--CA 1.485 1.284 0 C-N-CA 122.526 0.33 . . . . 74.129999999999995 111.009 173.798 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 36' ' ' GLN . . . . . 0.485 ' HB2' HD22 ' A' ' 21' ' ' LEU . 84.5 mm-40 -69.42 -14.44 62.9 Favored 'General case' 0 N--CA 1.48 1.034 0 C-N-CA 123.41 0.684 . . . . 74.230000000000004 111.966 179.617 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . 0.469 ' O ' ' HG ' ' A' ' 41' ' ' LEU . 28.2 tt0 -48.04 -54.62 12.43 Favored 'General case' 0 N--CA 1.481 1.086 0 C-N-CA 124.903 1.281 . . . . 70.519999999999996 111.876 178.536 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 59.6 t -57.4 -45.38 85.5 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.998 0 C-N-CA 123.973 0.909 . . . . 74.030000000000001 110.726 -176.494 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 39' ' ' SER . . . . . 0.439 ' HB3' ' NH2' ' A' ' 13' ' ' ARG . 41.5 m -67.08 -36.88 82.95 Favored 'General case' 0 CA--C 1.542 0.643 0 CA-C-N 114.792 -1.095 . . . . 70.430000000000007 111.401 179.056 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 76.5 t80 -69.2 -46.94 66.22 Favored 'General case' 0 N--CA 1.477 0.896 0 C-N-CA 123.745 0.818 . . . . 74.150000000000006 110.291 -176.255 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . 0.469 ' HG ' ' O ' ' A' ' 37' ' ' GLU . 73.9 mt -58.31 -52.18 66.69 Favored 'General case' 0 C--N 1.355 0.807 0 O-C-N 124.672 1.233 . . . . 74.120000000000005 109.13 176.773 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 50.3 tt0 -54.76 -48.22 72.92 Favored 'General case' 0 C--N 1.354 0.779 0 O-C-N 124.003 0.814 . . . . 75.109999999999999 111.498 -178.232 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 43' ' ' SER . . . . . 0.457 ' O ' HG21 ' A' ' 47' ' ' VAL . 68.1 m -61.41 -59.7 4.85 Favored 'General case' 0 CA--C 1.545 0.767 0 C-N-CA 123.069 0.548 . . . . 72.010000000000005 111.259 -178.263 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 44' ' ' ILE . . . . . 0.529 HG12 ' HE2' ' A' ' 48' ' ' MET . 12.6 tt -59.95 -39.37 79.96 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.145 0 O-C-N 123.821 0.701 . . . . 74.349999999999994 111.319 -172.914 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 18.3 mm-40 -65.25 -54.34 30.82 Favored 'General case' 0 N--CA 1.475 0.796 0 C-N-CA 123.554 0.741 . . . . 73.120000000000005 110.892 177.673 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 46' ' ' THR . . . . . 0.442 ' O ' ' HD3' ' A' ' 50' ' ' LYS . 87.9 m -56.47 -31.46 64.04 Favored 'General case' 0 N--CA 1.489 1.502 0 C-N-CA 123.469 0.708 . . . . 75.400000000000006 111.925 -177.831 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 47' ' ' VAL . . . . . 0.457 HG21 ' O ' ' A' ' 43' ' ' SER . 60.9 t -76.21 -46.33 33.63 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.821 0 CA-C-N 116.848 -0.16 . . . . 74.349999999999994 111.212 177.332 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 48' ' ' MET . . . . . 0.529 ' HE2' HG12 ' A' ' 44' ' ' ILE . 70.6 mtm -74.6 -21.07 59.66 Favored 'General case' 0 N--CA 1.487 1.392 0 N-CA-C 112.811 0.671 . . . . 75.239999999999995 112.811 -175.842 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 50.7 mt-10 -83.14 -37.3 23.9 Favored 'General case' 0 N--CA 1.488 1.455 0 C-N-CA 122.699 0.4 . . . . 75.230000000000004 111.07 177.681 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . 0.442 ' HD3' ' O ' ' A' ' 46' ' ' THR . 13.6 mptt -91.45 147.02 23.33 Favored 'General case' 0 N--CA 1.475 0.8 0 CA-C-N 115.67 -0.696 . . . . 75.140000000000001 110.036 -170.485 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 7.6 tt0 -71.83 136.52 47.04 Favored 'General case' 0 CA--C 1.539 0.539 0 CA-C-N 115.013 -0.994 . . . . 74.109999999999999 110.757 -173.655 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 52' ' ' THR . . . . . 0.758 HG22 ' HB3' ' A' ' 114' ' ' LEU . 59.9 m -70.44 133.16 87.22 Favored Pre-proline 0 CA--C 1.555 1.168 0 CA-C-N 115.263 -0.88 . . . . 74.140000000000001 110.109 173.313 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 53' ' ' PRO . . . . . 0.467 ' HG2' ' HA ' ' A' ' 4' ' ' THR . 45.4 Cg_exo -58.62 151.98 59.08 Favored 'Trans proline' 0 C--N 1.383 2.356 0 C-N-CA 122.379 2.053 . . . . 73.120000000000005 113.162 177.63 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 18.5 Cg_exo -68.68 -46.96 1.52 Allowed 'Trans proline' 0 C--N 1.375 1.972 0 C-N-CA 122.963 2.442 . . . . 71.239999999999995 110.994 172.827 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . -68.99 87.18 0.22 Allowed Glycine 0 C--N 1.349 1.268 0 CA-C-N 114.928 -1.033 . . . . 70.319999999999993 113.134 -179.164 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 80.3 mt -128.15 123.99 61.54 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.639 0 C-N-CA 124.574 1.15 . . . . 53.210000000000001 108.005 173.891 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 57' ' ' THR . . . . . 0.407 ' H ' HD12 ' A' ' 60' ' ' ILE . 31.9 p -85.2 179.23 7.27 Favored 'General case' 0 N--CA 1.473 0.703 0 N-CA-C 109.31 -0.626 . . . . 64.340000000000003 109.31 176.249 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 39.1 tpt85 -64.43 -47.04 80.63 Favored 'General case' 0 CA--C 1.541 0.606 0 C-N-CA 122.917 0.487 . . . . 74.219999999999999 109.772 176.176 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 17.7 m -60.84 -41.61 96.17 Favored 'General case' 0 N--CA 1.475 0.811 0 C-N-CA 123.683 0.793 . . . . 61.210000000000001 111.35 179.517 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 60' ' ' ILE . . . . . 0.407 HD12 ' H ' ' A' ' 57' ' ' THR . 98.1 mt -64.28 -42.04 94.22 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.95 0 C-N-CA 123.242 0.617 . . . . 72.209999999999994 110.43 177.826 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 49.0 tt0 -58.08 -42.23 85.11 Favored 'General case' 0 CA--C 1.544 0.72 0 O-C-N 123.801 0.688 . . . . 74.140000000000001 110.548 176.359 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 35.4 m-20 -68.82 -39.31 80.08 Favored 'General case' 0 N--CA 1.48 1.026 0 C-N-CA 123.214 0.606 . . . . 74.420000000000002 112.078 -179.608 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 63' ' ' MET . . . . . . . . . . . . . 71.6 mtm -68.68 -46.17 69.77 Favored 'General case' 0 N--CA 1.482 1.175 0 O-C-N 123.322 0.389 . . . . 63.450000000000003 110.691 -179.821 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 64' ' ' VAL . . . . . 0.518 ' O ' HG13 ' A' ' 68' ' ' ILE . 70.6 t -63.91 -60.05 3.34 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.558 0 CA-C-N 115.175 -0.92 . . . . 55.549999999999997 109.916 178.827 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . 0.485 ' HB1' HD21 ' A' ' 109' ' ' LEU . . . -60.92 -29.55 69.67 Favored 'General case' 0 N--CA 1.493 1.689 0 C-N-CA 123.298 0.639 . . . . 62.219999999999999 112.018 -179.054 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -67.0 -42.1 92.78 Favored Glycine 0 C--N 1.345 1.073 0 O-C-N 123.66 0.6 . . . . 65.420000000000002 111.928 176.018 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 67' ' ' TYR . . . . . 0.414 ' CE2' ' HG2' ' A' ' 12' ' ' GLN . 9.8 m-30 -75.89 -29.34 58.42 Favored 'General case' 0 N--CA 1.473 0.701 0 C-N-CA 123.046 0.539 . . . . 74.219999999999999 112.276 177.289 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 68' ' ' ILE . . . . . 0.522 ' O ' ' HG ' ' A' ' 72' ' ' LEU . 47.3 mt -64.03 -50.01 79.04 Favored 'Isoleucine or valine' 0 C--N 1.355 0.845 0 N-CA-C 107.251 -1.388 . . . . 73.349999999999994 107.251 172.306 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 69' ' ' LYS . . . . . 0.555 ' HB2' ' HE2' ' A' ' 106' ' ' TYR . 48.0 tttp -52.11 -48.46 64.77 Favored 'General case' 0 N--CA 1.481 1.098 0 C-N-CA 123.967 0.907 . . . . 73.310000000000002 111.149 176.432 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 60.7 tt0 -59.53 -46.38 89.04 Favored 'General case' 0 C--N 1.348 0.505 0 O-C-N 124.534 1.146 . . . . 72.549999999999997 110.41 -176.398 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 71' ' ' THR . . . . . 0.551 ' HB ' ' HA ' ' A' ' 15' ' ' ALA . 12.3 t -78.8 -18.74 53.63 Favored 'General case' 0 C--O 1.215 -0.752 0 CA-C-O 118.525 -0.75 . . . . 74.340000000000003 110.906 -177.91 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 72' ' ' LEU . . . . . 0.522 ' HG ' ' O ' ' A' ' 68' ' ' ILE . 37.6 mt -76.63 -33.42 58.35 Favored 'General case' 0 N--CA 1.491 1.611 0 CA-C-N 118.447 0.567 . . . . 64.439999999999998 110.791 173.596 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 50.8 m-20 -69.71 -49.01 57.43 Favored 'General case' 0 N--CA 1.476 0.855 0 N-CA-C 109.114 -0.698 . . . . 74.120000000000005 109.114 175.025 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 78.6 m-20 -57.86 -41.72 82.99 Favored 'General case' 0 N--CA 1.48 1.031 0 O-C-N 124.12 0.888 . . . . 73.129999999999995 110.714 175.522 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . 0.456 ' O ' ' HG2' ' A' ' 79' ' ' LYS . 11.2 tp10 -53.91 -61.64 2.17 Favored 'General case' 0 N--CA 1.485 1.284 0 C-N-CA 125.389 1.476 . . . . 54.450000000000003 110.697 176.234 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 9.1 tt0 -58.13 -46.77 85.03 Favored 'General case' 0 CA--C 1.543 0.702 0 O-C-N 124.056 0.848 . . . . 73.230000000000004 111.107 -174.094 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 95.2 mt -67.18 -40.25 86.55 Favored 'General case' 0 CA--C 1.545 0.751 0 CA-C-N 115.535 -0.757 . . . . 74.439999999999998 111.607 -176.538 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . 0.545 HD22 ' HA ' ' A' ' 22' ' ' LEU . 15.9 mt -65.79 -46.23 79.47 Favored 'General case' 0 N--CA 1.478 0.944 0 O-C-N 123.442 0.464 . . . . 75.209999999999994 111.807 -179.031 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 79' ' ' LYS . . . . . 0.456 ' HG2' ' O ' ' A' ' 75' ' ' GLU . 22.8 mmtp -70.57 -32.92 70.51 Favored 'General case' 0 N--CA 1.481 1.1 0 CA-C-O 121.002 0.429 . . . . 75.439999999999998 109.947 -178.438 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -64.67 -28.8 73.77 Favored Glycine 0 C--N 1.345 1.076 0 CA-C-N 114.594 -1.185 . . . . 75.109999999999999 112.983 172.354 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -83.79 -38.99 20.57 Favored 'General case' 0 CA--C 1.558 1.256 0 C-N-CA 123.46 0.704 . . . . 72.420000000000002 110.527 176.813 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 78.9 mt . . . . . 0 N--CA 1.483 1.21 0 C-N-CA 123.546 0.738 . . . . 71.310000000000002 111.634 -172.624 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 92' ' ' LEU . . . . . 0.481 ' HB2' ' HA ' ' A' ' 96' ' ' SER . 90.8 mt . . . . . 0 CA--C 1.549 0.908 0 CA-C-O 120.362 0.125 . . . . 71.239999999999995 111.248 . . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 5.9 mt -99.34 35.06 0.22 Allowed 'Isoleucine or valine' 0 N--CA 1.484 1.247 0 N-CA-C 108.34 -0.985 . . . . 64.430000000000007 108.34 -179.69 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 74.21 -70.87 1.53 Allowed Glycine 0 C--N 1.349 1.298 0 N-CA-C 109.255 -1.538 . . . . 74.310000000000002 109.255 -163.928 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 50.5 mt-30 -69.76 97.13 1.04 Allowed 'General case' 0 C--N 1.349 0.587 0 N-CA-C 108.038 -1.097 . . . . 74.120000000000005 108.038 161.782 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 96' ' ' SER . . . . . 0.481 ' HA ' ' HB2' ' A' ' 92' ' ' LEU . 17.3 m -71.69 90.29 1.05 Allowed 'General case' 0 CA--C 1.535 0.376 0 N-CA-C 109.176 -0.676 . . . . 75.230000000000004 109.176 178.707 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 11.3 t -85.96 44.34 1.12 Allowed 'General case' 0 CA--C 1.557 1.25 0 C-N-CA 123.825 0.85 . . . . 74.340000000000003 110.111 -179.182 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 98' ' ' ARG . . . . . 0.403 ' H ' ' HD2' ' A' ' 98' ' ' ARG . 0.2 OUTLIER -58.98 -53.35 59.37 Favored 'General case' 0 CA--C 1.548 0.891 0 C-N-CA 123.974 0.91 . . . . 74.120000000000005 110.86 -174.161 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 33.9 tt0 -72.61 -50.15 27.26 Favored 'General case' 0 C--N 1.346 0.441 0 C-N-CA 123.836 0.854 . . . . 75.209999999999994 109.508 -175.399 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 71.0 mmtt -60.44 -55.47 33.14 Favored 'General case' 0 N--CA 1.472 0.674 0 O-C-N 123.971 0.795 . . . . 75.310000000000002 110.501 -173.245 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 39.0 t -72.28 -44.25 63.05 Favored 'General case' 0 CA--C 1.546 0.825 0 O-C-N 124.062 0.851 . . . . 70.549999999999997 112.344 -174.526 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 6.4 tp -72.38 -38.24 68.53 Favored 'General case' 0 N--CA 1.49 1.563 0 CA-C-N 118.532 0.605 . . . . 72.230000000000004 110.617 -174.505 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 66.5 t30 -77.59 -24.89 49.61 Favored 'General case' 0 N--CA 1.478 0.949 0 CA-C-N 116.435 -0.348 . . . . 74.140000000000001 110.682 177.237 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 47.9 t30 -66.74 -38.29 86.36 Favored 'General case' 0 N--CA 1.488 1.445 0 C-N-CA 122.864 0.465 . . . . 73.120000000000005 109.818 171.201 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -61.34 -47.81 84.18 Favored 'General case' 0 C--N 1.352 0.7 0 O-C-N 123.896 0.748 . . . . 74.049999999999997 109.96 174.621 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 106' ' ' TYR . . . . . 0.555 ' HE2' ' HB2' ' A' ' 69' ' ' LYS . 4.6 t80 -55.93 -53.42 57.09 Favored 'General case' 0 CA--C 1.55 0.956 0 O-C-N 124.248 0.968 . . . . 73.5 111.06 176.354 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -68.5 -37.97 86.05 Favored Glycine 0 C--N 1.349 1.266 0 O-C-N 123.781 0.676 . . . . 63.450000000000003 113.268 -172.043 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 38.3 ttp-105 -71.01 -32.59 69.43 Favored 'General case' 0 CA--C 1.543 0.707 0 C-N-CA 123.665 0.786 . . . . 72.340000000000003 109.779 177.395 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 109' ' ' LEU . . . . . 0.566 ' HA ' ' N ' ' A' ' 114' ' ' LEU . 47.9 tp -66.99 -46.14 75.5 Favored 'General case' 0 N--CA 1.481 1.103 0 C-N-CA 123.297 0.639 . . . . 73.109999999999999 110.778 175.129 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 23.0 t -67.83 -35.43 78.58 Favored 'General case' 0 CA--C 1.543 0.681 0 O-C-N 124.147 0.904 . . . . 74.430000000000007 110.229 -178.643 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . -84.26 -63.93 1.62 Allowed Glycine 0 C--N 1.36 1.874 0 CA-C-O 119.274 -0.737 . . . . 65.129999999999995 113.28 -176.363 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 112' ' ' MET . . . . . 0.448 ' O ' ' HB2' ' A' ' 113' ' ' LEU . 2.0 tmm? -95.24 -66.24 0.92 Allowed 'General case' 0 N--CA 1.487 1.393 0 CA-C-N 118.496 1.148 . . . . 72.030000000000001 110.351 179.586 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 113' ' ' LEU . . . . . 0.448 ' HB2' ' O ' ' A' ' 112' ' ' MET . 14.8 tp 164.4 28.17 0.0 OUTLIER 'General case' 0 N--CA 1.505 2.309 0 C-N-CA 125.445 1.498 . . . . 74.329999999999998 110.472 179.269 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 114' ' ' LEU . . . . . 0.758 ' HB3' HG22 ' A' ' 52' ' ' THR . 0.5 OUTLIER . . . . . 0 N--CA 1.501 2.12 0 C-N-CA 125.553 1.541 . . . . 72.420000000000002 111.215 -178.569 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 12.4 tpt . . . . . 0 N--CA 1.478 0.971 0 CA-C-O 119.045 -0.502 . . . . 73.140000000000001 111.548 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 46.7 p -55.46 -41.35 72.8 Favored 'General case' 0 N--CA 1.484 1.228 0 C-N-CA 122.754 0.422 . . . . 74.439999999999998 112.075 -175.94 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 14.7 m -58.35 -42.32 86.66 Favored 'General case' 0 N--CA 1.48 1.03 0 C-N-CA 123.299 0.64 . . . . 73.239999999999995 111.121 177.629 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 56.9 m -68.77 -40.62 79.6 Favored 'General case' 0 CA--C 1.544 0.744 0 C-N-CA 123.552 0.741 . . . . 65.349999999999994 111.38 177.908 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 88.4 t -63.46 -40.78 90.31 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.021 0 C-N-CA 123.06 0.544 . . . . 75.299999999999997 110.127 179.943 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 6' ' ' GLU . . . . . 0.431 ' O ' ' HG3' ' A' ' 10' ' ' ARG . 50.3 mm-40 -71.68 -35.07 70.18 Favored 'General case' 0 N--CA 1.469 0.502 0 O-C-N 123.718 0.636 . . . . 70.329999999999998 111.031 178.599 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 55.4 t80 -67.62 -45.06 76.49 Favored 'General case' 0 CA--C 1.551 1.0 0 C-N-CA 123.031 0.533 . . . . 74.430000000000007 110.529 179.62 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 8' ' ' ILE . . . . . 0.496 HD13 HG21 ' A' ' 60' ' ' ILE . 90.2 mt -62.97 -40.24 88.25 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.811 0 C-N-CA 123.621 0.768 . . . . 74.400000000000006 109.381 173.677 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 20.9 t-20 -61.79 -33.35 73.95 Favored 'General case' 0 N--CA 1.481 1.117 0 C-N-CA 124.063 0.945 . . . . 73.129999999999995 111.239 177.227 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . 0.609 ' HB3' HG22 ' A' ' 47' ' ' VAL . 64.0 mtt85 -68.59 -40.48 80.48 Favored 'General case' 0 CA--C 1.536 0.442 0 C-N-CA 123.124 0.569 . . . . 73.329999999999998 110.377 175.565 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 11' ' ' TRP . . . . . 0.411 ' CD1' HG13 ' A' ' 64' ' ' VAL . 74.8 m95 -69.84 -32.12 70.35 Favored 'General case' 0 N--CA 1.479 1.011 0 N-CA-C 112.14 0.422 . . . . 75.430000000000007 112.14 174.931 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . 0.409 ' HG3' ' O ' ' A' ' 8' ' ' ILE . 52.9 mt-30 -63.23 -42.02 99.18 Favored 'General case' 0 N--CA 1.472 0.637 0 N-CA-C 108.701 -0.851 . . . . 73.329999999999998 108.701 172.302 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 15.5 tpt180 -63.31 -50.69 69.05 Favored 'General case' 0 CA--C 1.541 0.605 0 CA-C-N 115.174 -0.921 . . . . 63.140000000000001 110.587 -177.091 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 14' ' ' ILE . . . . . 0.421 HD12 HG23 ' A' ' 47' ' ' VAL . 70.2 mt -63.11 -44.06 99.27 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.062 0 C-N-CA 123.456 0.702 . . . . 74.230000000000004 110.653 -179.041 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . 0.583 ' HA ' ' HB ' ' A' ' 71' ' ' THR . . . -61.21 -50.79 71.69 Favored 'General case' 0 N--CA 1.479 0.991 0 C-N-CA 124.073 0.949 . . . . 73.409999999999997 111.964 -179.672 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 97.9 mt -76.61 -35.17 58.25 Favored 'General case' 0 N--CA 1.48 1.057 0 CA-C-N 114.795 -1.093 . . . . 75.310000000000002 111.516 -172.655 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . 0.485 ' O ' ' HG ' ' A' ' 21' ' ' LEU . 45.7 mt -66.43 -47.8 72.06 Favored 'General case' 0 N--CA 1.473 0.707 0 CA-C-O 118.971 -0.537 . . . . 75.010000000000005 109.947 175.9 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 98.2 p -65.67 -30.73 71.47 Favored 'General case' 0 N--CA 1.487 1.421 0 C-N-CA 122.611 0.364 . . . . 75.120000000000005 111.246 179.151 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 19' ' ' GLN . . . . . 0.599 ' HA ' HD21 ' A' ' 74' ' ' ASN . 6.3 tp-100 -59.31 -49.63 77.08 Favored 'General case' 0 C--N 1.354 0.799 0 O-C-N 123.737 0.648 . . . . 74.409999999999997 109.303 171.134 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 44.6 m -62.65 -41.73 99.21 Favored 'General case' 0 CA--C 1.542 0.644 0 CA-C-N 115.233 -0.894 . . . . 75.049999999999997 111.163 178.179 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . 0.485 ' HG ' ' O ' ' A' ' 17' ' ' LEU . 80.2 mt -63.26 -39.83 95.72 Favored 'General case' 0 N--CA 1.478 0.967 0 C-N-CA 123.64 0.776 . . . . 75.0 110.087 -177.421 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . 0.565 ' HA ' HD22 ' A' ' 78' ' ' LEU . 55.6 tp -64.29 -54.77 28.01 Favored 'General case' 0 CA--C 1.539 0.546 0 CA-C-N 115.628 -0.715 . . . . 73.310000000000002 110.224 178.058 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 47.3 mt-10 -54.17 -50.82 66.12 Favored 'General case' 0 N--CA 1.483 1.186 0 C-N-CA 123.862 0.865 . . . . 74.409999999999997 111.279 -178.954 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . 0.428 ' HB3' ' HB2' ' A' ' 29' ' ' GLU . 91.7 mt -63.47 -40.28 96.69 Favored 'General case' 0 N--CA 1.47 0.554 0 CA-C-N 115.012 -0.995 . . . . 74.120000000000005 111.067 -177.363 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -59.91 -40.6 89.37 Favored 'General case' 0 N--CA 1.482 1.161 0 C-N-CA 123.137 0.575 . . . . 74.349999999999994 111.352 176.813 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 86.7 mt-30 -64.42 -35.8 82.08 Favored 'General case' 0 N--CA 1.48 1.067 0 C-N-CA 123.899 0.88 . . . . 73.200000000000003 110.975 175.776 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 57.7 mtt180 -82.35 -6.79 59.49 Favored 'General case' 0 N--CA 1.482 1.134 0 C-N-CA 123.914 0.886 . . . . 74.109999999999999 112.021 179.36 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 84.09 9.77 81.73 Favored Glycine 0 C--N 1.352 1.441 0 N-CA-C 113.587 0.195 . . . . 74.140000000000001 113.587 -179.916 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 29' ' ' GLU . . . . . 0.428 ' HB2' ' HB3' ' A' ' 24' ' ' LEU . 40.4 mm-40 -85.5 54.28 3.06 Favored 'General case' 0 CA--C 1.546 0.793 0 C-N-CA 124.626 1.17 . . . . 64.129999999999995 111.168 179.629 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 30' ' ' TRP . . . . . 0.477 ' O ' ' HG ' ' A' ' 34' ' ' LEU . 96.0 m95 -64.79 -28.8 69.82 Favored 'General case' 0 N--CA 1.475 0.781 0 C-N-CA 123.402 0.681 . . . . 74.319999999999993 111.797 -176.869 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 11.1 m-20 -59.54 -39.46 84.04 Favored 'General case' 0 N--CA 1.486 1.352 0 C-N-CA 123.23 0.612 . . . . 74.439999999999998 110.439 178.456 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 88.0 mt -67.82 -31.45 71.3 Favored 'General case' 0 CA--C 1.543 0.679 0 CA-C-N 115.255 -0.884 . . . . 74.109999999999999 110.963 179.135 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . 0.437 ' HA ' HD21 ' A' ' 21' ' ' LEU . 9.2 mp -65.44 -43.7 89.62 Favored 'General case' 0 N--CA 1.488 1.45 0 N-CA-C 110.051 -0.351 . . . . 73.420000000000002 110.051 171.627 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . 0.477 ' HG ' ' O ' ' A' ' 30' ' ' TRP . 49.0 mt -66.3 -33.19 75.19 Favored 'General case' 0 N--CA 1.477 0.914 0 O-C-N 123.989 0.806 . . . . 72.109999999999999 111.442 -176.844 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 98.1 mt-30 -74.07 -53.88 9.02 Favored 'General case' 0 N--CA 1.477 0.903 0 C-N-CA 123.414 0.686 . . . . 54.5 110.294 177.04 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 83.5 mm-40 -63.86 -18.1 63.82 Favored 'General case' 0 N--CA 1.484 1.225 0 O-C-N 123.773 0.67 . . . . 73.230000000000004 111.637 178.848 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . 0.545 ' O ' ' HG ' ' A' ' 41' ' ' LEU . 30.3 tt0 -48.97 -60.97 2.32 Favored 'General case' 0 C--N 1.361 1.094 0 C-N-CA 124.523 1.129 . . . . 72.349999999999994 111.523 178.995 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 58.1 t -60.76 -40.59 85.48 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.291 0 O-C-N 123.787 0.679 . . . . 70.230000000000004 111.45 -173.973 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 50.8 m -62.22 -39.75 93.82 Favored 'General case' 0 CA--C 1.545 0.784 0 C-N-CA 123.382 0.673 . . . . 63.43 110.794 175.478 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 37.9 t80 -70.94 -40.15 72.22 Favored 'General case' 0 C--N 1.35 0.598 0 C-N-CA 124.274 1.029 . . . . 71.120000000000005 110.357 -176.976 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . 0.545 ' HG ' ' O ' ' A' ' 37' ' ' GLU . 67.3 mt -61.11 -51.07 70.68 Favored 'General case' 0 C--N 1.355 0.845 0 O-C-N 124.291 0.995 . . . . 73.120000000000005 108.623 178.773 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 50.8 tt0 -56.51 -42.03 77.69 Favored 'General case' 0 CA--C 1.544 0.735 0 CA-C-N 114.659 -1.155 . . . . 74.540000000000006 110.65 178.303 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 43' ' ' SER . . . . . 0.535 ' O ' HG21 ' A' ' 47' ' ' VAL . 68.8 m -61.54 -62.82 1.55 Allowed 'General case' 0 C--N 1.357 0.898 0 C-N-CA 122.959 0.504 . . . . 72.530000000000001 110.968 179.345 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 44' ' ' ILE . . . . . 0.497 HG12 ' HE1' ' A' ' 48' ' ' MET . 13.7 tt -64.02 -35.35 73.26 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.914 0 C-N-CA 123.836 0.854 . . . . 75.310000000000002 111.477 -169.882 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 10.7 mm-40 -65.86 -49.25 68.82 Favored 'General case' 0 C--N 1.348 0.528 0 CA-C-N 115.873 -0.603 . . . . 74.349999999999994 110.317 175.332 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 60.9 m -53.64 -39.94 65.43 Favored 'General case' 0 N--CA 1.484 1.239 0 O-C-N 123.864 0.727 . . . . 74.540000000000006 111.163 177.784 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 47' ' ' VAL . . . . . 0.609 HG22 ' HB3' ' A' ' 10' ' ' ARG . 20.9 t -68.56 -49.09 68.4 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.004 0 C-N-CA 123.104 0.562 . . . . 75.230000000000004 111.575 -178.228 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 48' ' ' MET . . . . . 0.497 ' HE1' HG12 ' A' ' 44' ' ' ILE . 70.3 mtm -75.62 -14.38 60.37 Favored 'General case' 0 N--CA 1.483 1.187 0 C-N-CA 122.507 0.323 . . . . 75.209999999999994 111.761 -177.784 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 47.0 mt-10 -95.98 -11.98 25.71 Favored 'General case' 0 N--CA 1.481 1.089 0 C-N-CA 123.724 0.81 . . . . 75.129999999999995 110.555 171.82 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 14.9 tppt? -87.2 132.94 33.72 Favored 'General case' 0 N--CA 1.472 0.628 0 N-CA-C 108.883 -0.784 . . . . 75.519999999999996 108.883 177.331 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 3.4 tt0 -66.83 131.22 45.45 Favored 'General case' 0 C--O 1.242 0.683 0 N-CA-C 108.961 -0.755 . . . . 74.150000000000006 108.961 174.634 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 22.1 m -69.25 127.09 93.08 Favored Pre-proline 0 CA--C 1.551 0.995 0 O-C-N 123.579 0.55 . . . . 72.420000000000002 109.555 175.905 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_endo -66.32 155.02 71.98 Favored 'Trans proline' 0 C--N 1.377 2.079 0 C-N-CA 122.258 1.972 . . . . 71.129999999999995 112.031 178.97 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 17.4 Cg_exo -67.85 -47.74 1.75 Allowed 'Trans proline' 0 C--N 1.372 1.798 0 C-N-CA 122.941 2.427 . . . . 75.099999999999994 111.653 177.406 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . -63.2 85.0 0.05 OUTLIER Glycine 0 C--N 1.353 1.48 0 O-C-N 124.411 1.07 . . . . 62.350000000000001 113.593 -177.413 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 59.2 mt -133.69 102.12 4.4 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.683 0 C-N-CA 124.764 1.226 . . . . 75.420000000000002 108.399 178.081 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 40.8 p -82.42 -173.62 4.69 Favored 'General case' 0 N--CA 1.471 0.601 0 C-N-CA 123.652 0.781 . . . . 74.209999999999994 110.31 175.192 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 22.0 tpt180 -63.01 -48.82 77.14 Favored 'General case' 0 CA--C 1.54 0.596 0 C-N-CA 123.608 0.763 . . . . 75.219999999999999 110.665 179.711 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 20.3 m -56.89 -43.98 81.86 Favored 'General case' 0 N--CA 1.479 1.017 0 C-N-CA 123.43 0.692 . . . . 74.439999999999998 111.375 179.389 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 60' ' ' ILE . . . . . 0.496 HG21 HD13 ' A' ' 8' ' ' ILE . 69.6 mt -64.08 -42.27 95.09 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.808 0 CA-C-N 115.114 -0.948 . . . . 74.109999999999999 110.328 178.728 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 60.4 tt0 -61.23 -41.27 96.58 Favored 'General case' 0 CA--C 1.546 0.79 0 C-N-CA 124.09 0.956 . . . . 74.540000000000006 111.087 179.729 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 14.1 m-20 -68.27 -43.3 78.11 Favored 'General case' 0 N--CA 1.479 0.986 0 C-N-CA 123.235 0.614 . . . . 73.549999999999997 111.632 179.503 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 63' ' ' MET . . . . . . . . . . . . . 73.3 mtm -65.88 -51.3 59.92 Favored 'General case' 0 N--CA 1.482 1.129 0 O-C-N 123.206 0.316 . . . . 74.140000000000001 111.109 179.864 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 64' ' ' VAL . . . . . 0.491 ' O ' HG13 ' A' ' 68' ' ' ILE . 53.1 t -59.98 -61.12 1.63 Allowed 'Isoleucine or valine' 0 CA--C 1.543 0.703 0 C-N-CA 123.707 0.803 . . . . 73.209999999999994 110.692 -179.522 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -64.67 -32.33 73.94 Favored 'General case' 0 N--CA 1.483 1.181 0 C-N-CA 122.697 0.399 . . . . 60.310000000000002 111.706 -176.708 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -65.94 -38.78 94.51 Favored Glycine 0 C--N 1.349 1.271 0 O-C-N 123.412 0.445 . . . . 74.519999999999996 112.049 177.798 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 67' ' ' TYR . . . . . 0.42 ' HB3' ' HB3' ' A' ' 15' ' ' ALA . 8.1 m-85 -74.9 -34.39 62.16 Favored 'General case' 0 N--CA 1.469 0.524 0 C-N-CA 123.439 0.696 . . . . 75.420000000000002 111.971 177.973 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 68' ' ' ILE . . . . . 0.534 ' O ' ' HG ' ' A' ' 72' ' ' LEU . 48.1 mt -61.93 -52.69 57.54 Favored 'Isoleucine or valine' 0 C--N 1.36 1.061 0 N-CA-C 108.353 -0.98 . . . . 72.340000000000003 108.353 174.369 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 69' ' ' LYS . . . . . 0.581 ' HB2' ' HE2' ' A' ' 106' ' ' TYR . 12.1 tmtt? -53.83 -47.76 70.58 Favored 'General case' 0 N--CA 1.479 1.017 0 C-N-CA 124.542 1.137 . . . . 75.129999999999995 109.772 -179.408 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 58.0 tt0 -55.49 -54.39 44.43 Favored 'General case' 0 C--N 1.347 0.485 0 CA-C-N 114.951 -1.022 . . . . 62.340000000000003 111.974 179.626 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 71' ' ' THR . . . . . 0.583 ' HB ' ' HA ' ' A' ' 15' ' ' ALA . 10.1 t -71.48 -27.09 62.99 Favored 'General case' 0 C--O 1.251 1.169 0 CA-C-N 116.22 -0.445 . . . . 74.209999999999994 110.891 -171.816 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 72' ' ' LEU . . . . . 0.534 ' HG ' ' O ' ' A' ' 68' ' ' ILE . 43.0 mt -62.07 -55.66 26.75 Favored 'General case' 0 C--N 1.358 0.955 0 O-C-N 123.789 0.681 . . . . 74.239999999999995 109.876 173.622 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -56.29 -52.56 64.06 Favored 'General case' 0 N--CA 1.489 1.487 0 O-C-N 124.253 0.971 . . . . 74.319999999999993 111.982 -179.787 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 74' ' ' ASN . . . . . 0.599 HD21 ' HA ' ' A' ' 19' ' ' GLN . 2.7 m-20 -58.74 -55.23 37.72 Favored 'General case' 0 C--O 1.248 0.992 0 O-C-N 124.036 0.835 . . . . 74.219999999999999 111.528 -174.786 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . 0.547 ' O ' ' HG2' ' A' ' 79' ' ' LYS . 14.5 tt0 -76.85 -15.4 59.72 Favored 'General case' 0 CA--C 1.545 0.763 0 CA-C-O 118.778 -0.63 . . . . 75.010000000000005 111.047 -177.107 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 76' ' ' GLN . . . . . 0.405 ' HA ' ' HG2' ' A' ' 79' ' ' LYS . 9.9 tt0 -69.46 -38.57 77.83 Favored 'General case' 0 N--CA 1.487 1.424 0 CA-C-N 118.464 0.575 . . . . 71.319999999999993 110.243 171.43 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 96.4 mt -60.62 -40.57 92.39 Favored 'General case' 0 N--CA 1.472 0.67 0 CA-C-N 115.592 -0.731 . . . . 73.299999999999997 109.087 171.031 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . 0.565 HD22 ' HA ' ' A' ' 22' ' ' LEU . 88.3 mt -63.76 -36.03 82.55 Favored 'General case' 0 CA--C 1.55 0.95 0 CA-C-O 118.44 -0.79 . . . . 71.120000000000005 112.262 171.634 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 79' ' ' LYS . . . . . 0.626 ' HE2' ' HB2' ' A' ' 99' ' ' GLN . 48.5 mmtm -59.34 -42.01 90.52 Favored 'General case' 0 N--CA 1.5 2.029 0 CA-C-N 119.032 0.833 . . . . 75.019999999999996 110.093 178.191 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -69.0 -43.08 74.84 Favored Glycine 0 C--N 1.349 1.297 0 CA-C-N 114.596 -1.184 . . . . 60.140000000000001 112.995 177.566 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -72.29 -33.04 67.12 Favored 'General case' 0 CA--C 1.555 1.169 0 C-N-CA 123.345 0.658 . . . . 73.510000000000005 110.436 -174.927 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 80.3 mt . . . . . 0 N--CA 1.477 0.894 0 C-N-CA 123.35 0.66 . . . . 72.340000000000003 111.053 -178.516 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 92' ' ' LEU . . . . . 0.513 ' HB2' ' HB ' ' A' ' 97' ' ' THR . 92.5 mt . . . . . 0 CA--C 1.543 0.697 0 CA-C-O 120.38 0.133 . . . . 75.25 111.294 . . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 39.0 mt -117.4 76.67 0.49 Allowed 'Isoleucine or valine' 0 CA--C 1.547 0.848 0 N-CA-C 109.042 -0.725 . . . . 74.329999999999998 109.042 -178.07 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 76.5 -77.03 1.45 Allowed Glycine 0 C--N 1.35 1.359 0 CA-C-N 115.388 -0.824 . . . . 74.049999999999997 113.604 174.272 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 2.9 mp0 -89.7 -173.13 3.82 Favored 'General case' 0 N--CA 1.478 0.952 0 C-N-CA 124.186 0.994 . . . . 75.040000000000006 110.364 178.71 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 58.8 m -63.27 95.8 0.1 Allowed 'General case' 0 CA--C 1.544 0.714 0 CA-C-N 115.063 -0.971 . . . . 61.140000000000001 110.367 174.618 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 97' ' ' THR . . . . . 0.513 ' HB ' ' HB2' ' A' ' 92' ' ' LEU . 87.3 m -100.37 -45.12 5.69 Favored 'General case' 0 C--O 1.215 -0.736 0 CA-C-N 114.796 -1.093 . . . . 73.239999999999995 111.272 -173.282 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 2.4 tmt_? -48.78 -58.24 5.11 Favored 'General case' 0 N--CA 1.482 1.165 0 C-N-CA 124.651 1.18 . . . . 73.430000000000007 112.077 -167.703 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 99' ' ' GLN . . . . . 0.626 ' HB2' ' HE2' ' A' ' 79' ' ' LYS . 48.3 tt0 -71.97 -43.81 64.57 Favored 'General case' 0 N--CA 1.472 0.659 0 N-CA-C 110.063 -0.347 . . . . 73.140000000000001 110.063 -169.729 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 29.4 ttpp -68.14 -47.38 68.25 Favored 'General case' 0 CA--C 1.546 0.802 0 C-N-CA 124.314 1.046 . . . . 73.129999999999995 111.192 -175.075 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 38.6 t -68.06 -42.6 80.22 Favored 'General case' 0 N--CA 1.472 0.671 0 C-N-CA 124.186 0.994 . . . . 71.230000000000004 110.729 -177.538 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 7.1 tp -74.56 -31.45 62.09 Favored 'General case' 0 CA--C 1.549 0.922 0 O-C-N 123.329 0.393 . . . . 75.140000000000001 111.187 -176.718 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 9.8 t30 -66.93 -41.89 86.25 Favored 'General case' 0 N--CA 1.48 1.059 0 C-N-CA 123.55 0.74 . . . . 61.109999999999999 109.696 173.938 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 27.7 t-20 -71.58 -28.88 64.13 Favored 'General case' 0 CA--C 1.54 0.568 0 CA-C-N 115.374 -0.83 . . . . 72.150000000000006 110.434 177.353 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -67.25 -38.79 85.74 Favored 'General case' 0 N--CA 1.48 1.037 0 C-N-CA 123.233 0.613 . . . . 74.540000000000006 110.454 176.627 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 106' ' ' TYR . . . . . 0.581 ' HE2' ' HB2' ' A' ' 69' ' ' LYS . 1.0 OUTLIER -61.21 -47.49 85.88 Favored 'General case' 0 C--N 1.355 0.814 0 N-CA-C 108.816 -0.809 . . . . 74.409999999999997 108.816 171.216 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -57.87 -40.69 93.47 Favored Glycine 0 C--N 1.351 1.386 0 O-C-N 123.732 0.645 . . . . 63.520000000000003 112.781 179.446 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 2.5 mmp_? -68.14 -34.17 75.84 Favored 'General case' 0 C--N 1.345 0.377 0 C-N-CA 123.508 0.723 . . . . 73.310000000000002 110.036 177.063 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 109' ' ' LEU . . . . . 0.456 ' HA ' ' N ' ' A' ' 114' ' ' LEU . 53.1 tp -68.37 -32.64 72.87 Favored 'General case' 0 N--CA 1.482 1.167 0 C-N-CA 123.174 0.589 . . . . 70.120000000000005 111.114 177.659 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 33.5 t -72.45 -42.49 64.95 Favored 'General case' 0 CA--C 1.541 0.598 0 CA-C-N 115.66 -0.7 . . . . 73.230000000000004 109.803 177.747 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . -88.71 -61.73 1.42 Allowed Glycine 0 C--N 1.355 1.611 0 C-N-CA 121.144 -0.551 . . . . 72.519999999999996 114.127 -175.773 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 112' ' ' MET . . . . . . . . . . . . . 2.2 mmm -93.72 -66.65 0.91 Allowed 'General case' 0 N--CA 1.486 1.338 0 CA-C-N 117.927 0.863 . . . . 74.530000000000001 112.904 -176.245 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 6.6 mt 157.27 44.77 0.0 OUTLIER 'General case' 0 N--CA 1.503 2.183 0 C-N-CA 126.364 1.866 . . . . 75.230000000000004 108.6 -174.191 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 114' ' ' LEU . . . . . 0.456 ' N ' ' HA ' ' A' ' 109' ' ' LEU . 1.0 OUTLIER . . . . . 0 N--CA 1.503 2.194 0 C-N-CA 125.387 1.475 . . . . 74.099999999999994 111.788 174.703 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 1' ' ' MET . . . . . 0.503 ' HG3' HG23 ' A' ' 5' ' ' VAL . 21.0 ptt? . . . . . 0 N--CA 1.486 1.339 0 CA-C-O 120.963 0.411 . . . . 71.400000000000006 110.5 . . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 43.8 m -54.98 -61.32 2.39 Favored 'General case' 0 N--CA 1.482 1.141 0 C-N-CA 123.571 0.748 . . . . 72.219999999999999 112.344 -172.107 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 17.0 m -63.78 -28.66 70.02 Favored 'General case' 0 N--CA 1.478 0.962 0 C-N-CA 123.529 0.732 . . . . 74.040000000000006 112.341 -174.726 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 23.6 m -77.96 -36.56 48.98 Favored 'General case' 0 CA--C 1.549 0.934 0 C-N-CA 123.421 0.688 . . . . 74.109999999999999 111.569 -179.665 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 5' ' ' VAL . . . . . 0.503 HG23 ' HG3' ' A' ' 1' ' ' MET . 51.5 t -71.08 -38.62 72.22 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.107 0 C-N-CA 122.851 0.46 . . . . 75.219999999999999 110.143 175.76 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 6' ' ' GLU . . . . . 0.537 ' HB3' ' NH1' ' A' ' 10' ' ' ARG . 45.6 mm-40 -60.83 -45.38 94.68 Favored 'General case' 0 N--CA 1.478 0.931 0 O-C-N 123.639 0.587 . . . . 74.400000000000006 110.128 173.48 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 81.8 t80 -53.09 -58.75 5.94 Favored 'General case' 0 CA--C 1.549 0.934 0 C-N-CA 125.242 1.417 . . . . 73.200000000000003 111.534 176.646 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 8' ' ' ILE . . . . . 0.445 ' O ' ' HG3' ' A' ' 12' ' ' GLN . 70.6 mt -61.1 -45.78 97.91 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.015 0 O-C-N 123.766 0.666 . . . . 75.349999999999994 110.559 -178.78 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 4.3 t-20 -64.89 -29.54 70.5 Favored 'General case' 0 N--CA 1.482 1.132 0 C-N-CA 123.539 0.736 . . . . 74.010000000000005 111.379 -175.814 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . 0.6 ' HB3' HG21 ' A' ' 47' ' ' VAL . 68.3 mtt85 -78.55 -32.17 47.74 Favored 'General case' 0 CA--C 1.541 0.627 0 C-N-CA 122.986 0.514 . . . . 73.120000000000005 111.214 176.571 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 11' ' ' TRP . . . . . . . . . . . . . 85.5 m95 -71.01 -29.92 66.0 Favored 'General case' 0 N--CA 1.487 1.399 0 CA-C-N 117.53 0.15 . . . . 75.299999999999997 111.007 169.987 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . 0.562 ' HG2' ' CE2' ' A' ' 67' ' ' TYR . 42.9 mt-30 -63.61 -46.81 84.05 Favored 'General case' 0 C--N 1.357 0.928 0 N-CA-C 108.329 -0.989 . . . . 74.299999999999997 108.329 170.78 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 11.9 tpt180 -55.77 -49.45 73.12 Favored 'General case' 0 CA--C 1.544 0.73 0 O-C-N 124.375 1.047 . . . . 75.329999999999998 111.513 -179.118 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 54.1 mt -63.69 -45.07 98.41 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.292 0 O-C-N 123.271 0.357 . . . . 73.409999999999997 110.301 179.25 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . 0.617 ' HA ' ' HB ' ' A' ' 71' ' ' THR . . . -56.46 -45.45 80.87 Favored 'General case' 0 N--CA 1.485 1.321 0 C-N-CA 123.959 0.904 . . . . 64.329999999999998 111.664 178.572 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 95.9 mt -79.38 -35.75 40.28 Favored 'General case' 0 N--CA 1.478 0.933 0 CA-C-N 114.562 -1.199 . . . . 72.340000000000003 111.233 -172.352 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . 0.464 ' O ' ' HG ' ' A' ' 21' ' ' LEU . 45.6 mt -66.21 -51.84 53.74 Favored 'General case' 0 N--CA 1.476 0.849 0 O-C-N 123.655 0.597 . . . . 74.519999999999996 109.774 178.518 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 88.4 p -62.21 -38.47 89.3 Favored 'General case' 0 N--CA 1.479 0.981 0 C-N-CA 123.229 0.612 . . . . 72.120000000000005 111.031 179.457 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 6.7 tp-100 -58.61 -48.97 79.2 Favored 'General case' 0 C--N 1.356 0.867 0 O-C-N 123.873 0.733 . . . . 74.420000000000002 110.858 174.311 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 20' ' ' SER . . . . . 0.405 ' O ' ' HG ' ' A' ' 24' ' ' LEU . 69.2 m -61.09 -46.6 89.98 Favored 'General case' 0 C--O 1.213 -0.851 0 O-C-N 124.053 0.846 . . . . 61.439999999999998 110.159 178.609 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . 0.464 ' HG ' ' O ' ' A' ' 17' ' ' LEU . 68.5 mt -68.44 -27.53 66.26 Favored 'General case' 0 CA--C 1.537 0.471 0 C-N-CA 123.328 0.651 . . . . 73.040000000000006 111.125 -175.469 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . 0.675 ' HA ' HD23 ' A' ' 78' ' ' LEU . 46.4 tp -71.67 -48.36 48.07 Favored 'General case' 0 N--CA 1.477 0.875 0 N-CA-C 109.372 -0.603 . . . . 74.200000000000003 109.372 176.639 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . 0.428 ' HB3' ' NH1' ' A' ' 27' ' ' ARG . 45.1 mt-10 -54.51 -55.14 32.19 Favored 'General case' 0 N--CA 1.479 0.984 0 O-C-N 124.3 1.0 . . . . 65.120000000000005 110.365 175.656 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . 0.405 ' HG ' ' O ' ' A' ' 20' ' ' SER . 92.5 mt -61.13 -45.7 93.58 Favored 'General case' 0 CA--C 1.541 0.632 0 CA-C-N 114.683 -1.144 . . . . 74.150000000000006 111.356 -176.445 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . 0.471 ' HB1' HD21 ' A' ' 33' ' ' LEU . . . -59.62 -46.65 88.36 Favored 'General case' 0 N--CA 1.482 1.142 0 C-N-CA 122.969 0.507 . . . . 53.229999999999997 111.609 -178.94 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 95.1 mt-30 -72.4 -23.04 61.04 Favored 'General case' 0 CA--C 1.549 0.905 0 CA-C-N 115.589 -0.732 . . . . 72.329999999999998 111.551 -179.174 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 27' ' ' ARG . . . . . 0.428 ' NH1' ' HB3' ' A' ' 23' ' ' GLU . 88.9 mtt180 -88.63 4.85 45.59 Favored 'General case' 0 N--CA 1.487 1.387 0 C-N-CA 123.537 0.735 . . . . 74.209999999999994 111.776 174.304 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 77.76 9.18 87.07 Favored Glycine 0 C--N 1.352 1.466 0 N-CA-C 114.122 0.409 . . . . 63.109999999999999 114.122 177.117 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 29' ' ' GLU . . . . . 0.429 ' HB3' HD13 ' A' ' 32' ' ' LEU . 18.1 mm-40 -86.04 49.65 1.82 Allowed 'General case' 0 CA--C 1.556 1.18 0 C-N-CA 124.296 1.038 . . . . 74.120000000000005 110.259 178.287 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 30' ' ' TRP . . . . . 0.467 ' HA ' HD13 ' A' ' 33' ' ' LEU . 74.8 m95 -62.5 -30.47 71.3 Favored 'General case' 0 N--CA 1.485 1.297 0 C-N-CA 123.376 0.67 . . . . 75.120000000000005 111.027 -176.406 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 17.2 m-20 -56.27 -44.72 80.01 Favored 'General case' 0 N--CA 1.472 0.657 0 C-N-CA 123.781 0.833 . . . . 71.329999999999998 111.019 176.225 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . 0.429 HD13 ' HB3' ' A' ' 29' ' ' GLU . 96.2 mt -64.21 -30.1 71.17 Favored 'General case' 0 CA--C 1.552 1.033 0 CA-C-N 115.755 -0.657 . . . . 72.109999999999999 110.927 -179.912 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . 0.471 HD21 ' HB1' ' A' ' 25' ' ' ALA . 8.4 mp -66.75 -41.93 86.99 Favored 'General case' 0 N--CA 1.491 1.584 0 C-N-CA 122.536 0.335 . . . . 74.25 110.574 171.389 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 71.8 mt -59.61 -45.43 91.97 Favored 'General case' 0 N--CA 1.484 1.241 0 C-N-CA 123.106 0.563 . . . . 74.400000000000006 111.456 -179.217 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 10.4 mp0 -71.22 -28.16 64.0 Favored 'General case' 0 N--CA 1.483 1.213 0 C-N-CA 123.188 0.595 . . . . 71.329999999999998 111.875 177.466 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 86.3 mm-40 -88.88 -11.72 43.81 Favored 'General case' 0 N--CA 1.485 1.311 0 N-CA-C 112.907 0.706 . . . . 71.140000000000001 112.907 179.027 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . 0.44 ' O ' ' HG ' ' A' ' 41' ' ' LEU . 38.5 tt0 -47.52 -59.66 3.08 Favored 'General case' 0 N--CA 1.481 1.118 0 C-N-CA 124.109 0.964 . . . . 72.439999999999998 112.394 -178.696 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 73.9 t -57.52 -41.06 78.1 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.28 0 C-N-CA 123.255 0.622 . . . . 74.540000000000006 111.375 -179.365 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 42.9 m -61.98 -43.74 98.19 Favored 'General case' 0 CA--C 1.543 0.71 0 C-N-CA 123.36 0.664 . . . . 71.030000000000001 111.431 179.351 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 47.6 t80 -69.34 -48.5 61.2 Favored 'General case' 0 N--CA 1.468 0.469 0 CA-C-N 115.567 -0.742 . . . . 72.129999999999995 110.471 -176.476 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . 0.455 HD23 HD22 ' A' ' 92' ' ' LEU . 46.5 mt -66.08 -44.51 84.25 Favored 'General case' 0 CA--C 1.538 0.502 0 O-C-N 124.485 1.116 . . . . 65.010000000000005 110.408 -176.371 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 48.3 tt0 -58.95 -49.95 75.89 Favored 'General case' 0 N--CA 1.473 0.681 0 O-C-N 123.695 0.622 . . . . 73.310000000000002 110.132 178.576 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 43' ' ' SER . . . . . 0.54 ' O ' HG23 ' A' ' 47' ' ' VAL . 69.5 m -58.93 -55.29 37.02 Favored 'General case' 0 C--N 1.354 0.761 0 O-C-N 123.803 0.689 . . . . 64.310000000000002 111.808 -178.989 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 44' ' ' ILE . . . . . 0.645 HG12 ' HE2' ' A' ' 48' ' ' MET . 10.1 tt -60.38 -42.44 90.9 Favored 'Isoleucine or valine' 0 CA--C 1.557 1.236 0 C-N-CA 122.854 0.461 . . . . 74.329999999999998 111.395 -173.994 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . 0.429 ' O ' ' HG3' ' A' ' 49' ' ' GLU . 8.6 mm-40 -61.57 -49.25 77.42 Favored 'General case' 0 N--CA 1.48 1.066 0 C-N-CA 123.056 0.542 . . . . 72.209999999999994 111.035 176.224 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 46' ' ' THR . . . . . 0.535 ' O ' ' HD3' ' A' ' 50' ' ' LYS . 95.9 m -57.53 -43.12 84.08 Favored 'General case' 0 N--CA 1.479 1.003 0 C-N-CA 123.802 0.841 . . . . 65.129999999999995 111.825 -177.141 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 47' ' ' VAL . . . . . 0.6 HG21 ' HB3' ' A' ' 10' ' ' ARG . 30.5 t -67.82 -42.56 86.07 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.717 0 C-N-CA 122.868 0.467 . . . . 73.340000000000003 110.163 -179.543 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 48' ' ' MET . . . . . 0.645 ' HE2' HG12 ' A' ' 44' ' ' ILE . 79.1 mtm -70.58 -15.57 62.77 Favored 'General case' 0 N--CA 1.48 1.074 0 N-CA-C 112.286 0.476 . . . . 75.140000000000001 112.286 177.809 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . 0.429 ' HG3' ' O ' ' A' ' 45' ' ' GLU . 62.5 mt-10 -73.29 -35.99 66.22 Favored 'General case' 0 N--CA 1.488 1.463 0 CA-C-N 118.152 0.433 . . . . 63.299999999999997 111.436 171.664 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . 0.535 ' HD3' ' O ' ' A' ' 46' ' ' THR . 10.8 mptt -78.32 135.86 37.59 Favored 'General case' 0 N--CA 1.483 1.2 0 C-N-CA 123.162 0.585 . . . . 74.310000000000002 111.192 -170.552 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 8.0 tt0 -69.15 148.29 50.13 Favored 'General case' 0 N--CA 1.474 0.747 0 C-N-CA 124.276 1.03 . . . . 75.430000000000007 110.791 177.632 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 25.1 m -65.7 127.03 92.75 Favored Pre-proline 0 CA--C 1.555 1.137 0 C-N-CA 123.893 0.877 . . . . 73.430000000000007 110.643 178.296 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 15.3 Cg_exo -69.84 151.32 68.56 Favored 'Trans proline' 0 C--N 1.38 2.235 0 C-N-CA 121.912 1.741 . . . . 74.319999999999993 111.372 173.01 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 41.7 Cg_endo -67.81 -44.12 4.5 Favored 'Trans proline' 0 C--N 1.372 1.774 0 C-N-CA 122.999 2.466 . . . . 74.5 112.035 173.832 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . -76.68 66.86 2.68 Favored Glycine 0 C--N 1.352 1.427 0 CA-C-N 116.029 -0.532 . . . . 75.219999999999999 113.645 -178.349 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 56' ' ' ILE . . . . . 0.413 HG21 HG23 ' A' ' 60' ' ' ILE . 58.2 mt -110.0 106.45 20.75 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.653 0 N-CA-C 107.41 -1.329 . . . . 73.219999999999999 107.41 170.107 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 31.2 p -75.08 178.8 5.41 Favored 'General case' 0 N--CA 1.473 0.723 0 C-N-CA 122.911 0.484 . . . . 73.349999999999994 110.244 -179.314 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 40.8 tpt85 -64.08 -46.53 83.88 Favored 'General case' 0 N--CA 1.471 0.606 0 C-N-CA 123.273 0.629 . . . . 73.030000000000001 109.961 -179.964 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 31.8 m -63.01 -40.57 98.17 Favored 'General case' 0 CA--C 1.547 0.827 0 CA-C-N 115.596 -0.729 . . . . 71.040000000000006 111.34 178.264 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 60' ' ' ILE . . . . . 0.413 HG23 HG21 ' A' ' 56' ' ' ILE . 74.8 mt -63.16 -41.41 92.72 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.163 0 C-N-CA 122.962 0.505 . . . . 61.240000000000002 110.608 176.064 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 61.1 tt0 -59.82 -42.65 93.99 Favored 'General case' 0 N--CA 1.476 0.859 0 C-N-CA 123.641 0.776 . . . . 73.299999999999997 110.429 179.493 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 50.0 m-20 -68.23 -45.65 72.7 Favored 'General case' 0 N--CA 1.48 1.025 0 O-C-N 123.563 0.54 . . . . 75.019999999999996 112.227 178.374 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 63' ' ' MET . . . . . . . . . . . . . 65.4 mtm -64.24 -49.93 69.99 Favored 'General case' 0 N--CA 1.486 1.337 0 C-N-CA 122.331 0.253 . . . . 74.519999999999996 110.876 -177.281 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 64' ' ' VAL . . . . . 0.492 ' O ' HG13 ' A' ' 68' ' ' ILE . 82.1 t -60.46 -54.99 27.5 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.815 0 O-C-N 124.171 0.919 . . . . 70.239999999999995 110.945 178.238 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -65.99 -28.8 69.15 Favored 'General case' 0 N--CA 1.494 1.765 0 CA-C-N 118.492 0.587 . . . . 74.5 112.083 -178.817 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -69.23 -38.86 82.63 Favored Glycine 0 C--N 1.343 0.966 0 N-CA-C 111.386 -0.685 . . . . 72.450000000000003 111.386 176.407 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 67' ' ' TYR . . . . . 0.562 ' CE2' ' HG2' ' A' ' 12' ' ' GLN . 10.8 m-85 -71.0 -36.01 72.29 Favored 'General case' 0 N--CA 1.467 0.413 0 C-N-CA 123.605 0.762 . . . . 65.439999999999998 111.134 175.059 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 68' ' ' ILE . . . . . 0.544 ' O ' ' HG ' ' A' ' 72' ' ' LEU . 60.8 mt -63.18 -48.54 87.14 Favored 'Isoleucine or valine' 0 C--N 1.36 1.042 0 N-CA-C 108.649 -0.871 . . . . 73.200000000000003 108.649 176.22 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 69' ' ' LYS . . . . . 0.609 ' HB2' ' HE2' ' A' ' 106' ' ' TYR . 0.7 OUTLIER -57.67 -48.22 80.12 Favored 'General case' 0 C--N 1.356 0.861 0 C-N-CA 123.58 0.752 . . . . 75.349999999999994 110.297 -179.06 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 59.7 tt0 -60.22 -45.7 92.32 Favored 'General case' 0 C--N 1.347 0.489 0 O-C-N 124.491 1.119 . . . . 70.120000000000005 110.979 -179.026 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 71' ' ' THR . . . . . 0.617 ' HB ' ' HA ' ' A' ' 15' ' ' ALA . 15.1 t -77.9 -22.97 48.87 Favored 'General case' 0 C--N 1.354 0.779 0 CA-C-O 119.329 -0.367 . . . . 74.120000000000005 110.257 -175.554 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 72' ' ' LEU . . . . . 0.544 ' HG ' ' O ' ' A' ' 68' ' ' ILE . 28.6 mt -63.81 -50.94 66.97 Favored 'General case' 0 C--N 1.359 0.986 0 N-CA-C 108.524 -0.917 . . . . 74.340000000000003 108.524 171.831 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 73' ' ' ASP . . . . . 0.463 ' O ' ' HG ' ' A' ' 77' ' ' LEU . 60.6 m-20 -62.4 -53.75 50.42 Favored 'General case' 0 N--CA 1.476 0.842 0 O-C-N 124.363 1.039 . . . . 72.319999999999993 111.264 -178.349 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 74' ' ' ASN . . . . . 0.467 ' HA ' HD21 ' A' ' 22' ' ' LEU . 74.7 m-20 -54.32 -53.93 47.25 Favored 'General case' 0 N--CA 1.487 1.403 0 C-N-CA 123.647 0.779 . . . . 74.349999999999994 110.825 -178.904 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . 0.554 ' HG3' ' HZ3' ' A' ' 79' ' ' LYS . 43.1 tt0 -66.47 -31.03 71.51 Favored 'General case' 0 CA--C 1.549 0.942 0 C-N-CA 123.802 0.841 . . . . 70.150000000000006 111.548 -178.46 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 76' ' ' GLN . . . . . 0.468 ' HB2' ' O ' ' A' ' 72' ' ' LEU . 8.1 tt0 -74.86 -36.36 62.32 Favored 'General case' 0 N--CA 1.482 1.155 0 N-CA-C 109.906 -0.405 . . . . 75.230000000000004 109.906 -178.597 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . 0.463 ' HG ' ' O ' ' A' ' 73' ' ' ASP . 89.5 mt -67.38 -40.7 85.7 Favored 'General case' 0 C--N 1.351 0.654 0 O-C-N 123.84 0.712 . . . . 73.400000000000006 109.347 176.602 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . 0.675 HD23 ' HA ' ' A' ' 22' ' ' LEU . 73.0 mt -63.82 -62.85 1.38 Allowed 'General case' 0 N--CA 1.482 1.131 0 C-N-CA 123.915 0.886 . . . . 72.129999999999995 112.242 177.739 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 79' ' ' LYS . . . . . 0.554 ' HZ3' ' HG3' ' A' ' 75' ' ' GLU . 1.0 OUTLIER -66.43 -32.89 74.54 Favored 'General case' 0 N--CA 1.476 0.873 0 C-N-CA 123.558 0.743 . . . . 72.319999999999993 110.479 -174.442 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -65.85 -40.68 95.65 Favored Glycine 0 C--N 1.349 1.262 0 CA-C-N 115.832 -0.622 . . . . 70.129999999999995 112.353 173.843 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 81' ' ' LEU . . . . . 0.419 ' HB2' ' O ' ' A' ' 77' ' ' LEU . 6.0 tt -62.13 -40.22 95.18 Favored 'General case' 0 N--CA 1.487 1.377 0 C-N-CA 124.217 1.007 . . . . 74.409999999999997 109.612 175.743 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 82' ' ' LEU . . . . . 0.413 ' HG ' ' O ' ' A' ' 78' ' ' LEU . 99.1 mt . . . . . 0 C--N 1.358 0.96 0 O-C-N 124.07 0.856 . . . . 72.420000000000002 110.11 -179.391 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 92' ' ' LEU . . . . . 0.455 HD22 HD23 ' A' ' 41' ' ' LEU . 59.5 mt . . . . . 0 N--CA 1.484 1.254 0 N-CA-C 108.317 -0.994 . . . . 74.409999999999997 108.317 . . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 93' ' ' ILE . . . . . 0.522 ' HB ' HG22 ' A' ' 97' ' ' THR . 68.7 mt -51.26 -40.88 23.66 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.61 0 CA-C-O 121.364 0.602 . . . . 71.450000000000003 110.401 167.072 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 179.07 -174.69 46.7 Favored Glycine 0 C--O 1.242 0.63 0 CA-C-N 114.724 -1.125 . . . . 72.230000000000004 110.711 175.211 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 18.3 mm100 -75.82 149.53 37.87 Favored 'General case' 0 CA--C 1.541 0.631 0 N-CA-C 110.172 -0.307 . . . . 73.430000000000007 110.172 174.722 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 29.9 t 75.77 -16.6 0.58 Allowed 'General case' 0 N--CA 1.484 1.247 0 C-N-CA 125.865 1.666 . . . . 60.350000000000001 113.119 -174.554 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 97' ' ' THR . . . . . 0.522 HG22 ' HB ' ' A' ' 93' ' ' ILE . 86.7 m -59.52 -36.86 76.93 Favored 'General case' 0 N--CA 1.477 0.89 0 C-N-CA 123.4 0.68 . . . . 71.219999999999999 112.186 -176.109 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 98' ' ' ARG . . . . . 0.534 ' HG3' ' H ' ' A' ' 99' ' ' GLN . 0.0 OUTLIER -56.42 -57.28 12.98 Favored 'General case' 0 CA--C 1.554 1.119 0 O-C-N 123.434 0.459 . . . . 74.319999999999993 111.665 -178.936 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 99' ' ' GLN . . . . . 0.534 ' H ' ' HG3' ' A' ' 98' ' ' ARG . 23.1 tm0? -78.64 -42.48 28.65 Favored 'General case' 0 C--N 1.349 0.558 0 N-CA-C 109.28 -0.637 . . . . 73.400000000000006 109.28 -170.643 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 4.5 tppp? -62.53 -52.36 63.77 Favored 'General case' 0 CA--C 1.539 0.525 0 O-C-N 123.707 0.629 . . . . 74.549999999999997 110.992 -176.592 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 33.3 t -72.89 -36.87 67.41 Favored 'General case' 0 CA--C 1.543 0.692 0 O-C-N 123.61 0.569 . . . . 74.510000000000005 111.449 -174.973 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 5.0 tp -75.98 -32.81 59.65 Favored 'General case' 0 N--CA 1.487 1.403 0 CA-C-N 118.21 0.459 . . . . 72.430000000000007 111.4 -177.743 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 25.9 t-20 -78.91 -31.03 45.14 Favored 'General case' 0 N--CA 1.489 1.517 0 C-N-CA 123.326 0.65 . . . . 70.319999999999993 110.35 176.87 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 53.1 t30 -66.03 -38.75 89.21 Favored 'General case' 0 N--CA 1.487 1.393 0 C-N-CA 123.604 0.761 . . . . 75.450000000000003 109.384 171.859 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -60.49 -48.57 81.18 Favored 'General case' 0 CA--C 1.54 0.586 0 CA-C-N 115.002 -0.999 . . . . 73.519999999999996 110.522 175.459 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 106' ' ' TYR . . . . . 0.609 ' HE2' ' HB2' ' A' ' 69' ' ' LYS . 6.3 t80 -56.28 -45.07 80.29 Favored 'General case' 0 C--N 1.355 0.84 0 O-C-N 123.62 0.575 . . . . 72.420000000000002 110.18 174.702 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -58.32 -43.56 95.55 Favored Glycine 0 C--N 1.354 1.568 0 O-C-N 123.842 0.714 . . . . 71.329999999999998 112.882 -177.285 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 99.7 mtt180 -68.47 -37.93 80.6 Favored 'General case' 0 CA--C 1.544 0.715 0 C-N-CA 123.196 0.598 . . . . 73.519999999999996 111.116 177.615 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 109' ' ' LEU . . . . . 0.504 ' HA ' ' N ' ' A' ' 114' ' ' LEU . 35.8 tp -72.84 -31.15 64.57 Favored 'General case' 0 N--CA 1.488 1.449 0 C-N-CA 123.06 0.544 . . . . 72.519999999999996 111.554 -178.383 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 33.3 t -79.87 -32.55 40.43 Favored 'General case' 0 CA--C 1.537 0.48 0 C-N-CA 123.789 0.836 . . . . 75.319999999999993 109.337 178.148 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . -87.9 -64.35 1.36 Allowed Glycine 0 C--N 1.36 1.904 0 CA-C-O 119.164 -0.798 . . . . 62.219999999999999 113.606 -178.439 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 112' ' ' MET . . . . . . . . . . . . . 21.7 mmm -96.98 -69.0 0.77 Allowed 'General case' 0 N--CA 1.489 1.518 0 CA-C-N 118.34 1.07 . . . . 74.040000000000006 113.194 178.058 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 13.6 tp 172.03 25.7 0.0 OUTLIER 'General case' 0 N--CA 1.495 1.786 0 O-C-N 123.77 0.669 . . . . 75.25 110.888 -173.3 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 114' ' ' LEU . . . . . 0.504 ' N ' ' HA ' ' A' ' 109' ' ' LEU . 41.5 tp . . . . . 0 N--CA 1.501 2.092 0 C-N-CA 126.571 1.948 . . . . 74.019999999999996 111.9 -177.443 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 1' ' ' MET . . . . . 0.598 ' HG2' ' HB ' ' A' ' 4' ' ' THR . 0.0 OUTLIER . . . . . 0 CA--C 1.55 0.96 0 N-CA-C 109.362 -0.607 . . . . 74.200000000000003 109.362 . . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 42.2 p -57.81 -48.05 80.85 Favored 'General case' 0 N--CA 1.479 1.011 0 C-N-CA 124.411 1.084 . . . . 74.129999999999995 113.555 -166.531 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 36.2 m -66.08 -38.52 88.49 Favored 'General case' 0 N--CA 1.476 0.873 0 O-C-N 123.522 0.514 . . . . 70.540000000000006 111.543 -176.078 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 4' ' ' THR . . . . . 0.598 ' HB ' ' HG2' ' A' ' 1' ' ' MET . 15.0 m -76.24 -38.65 56.07 Favored 'General case' 0 N--CA 1.475 0.822 0 O-C-N 123.576 0.547 . . . . 62.25 112.155 -176.575 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 85.5 t -67.86 -40.52 83.7 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.87 0 N-CA-C 109.612 -0.514 . . . . 74.329999999999998 109.612 177.109 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 6' ' ' GLU . . . . . 0.498 ' O ' ' HG3' ' A' ' 10' ' ' ARG . 2.6 tm-20 -64.67 -36.83 85.53 Favored 'General case' 0 CA--C 1.549 0.922 0 C-N-CA 123.666 0.786 . . . . 74.439999999999998 109.854 175.694 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 7' ' ' PHE . . . . . 0.418 ' O ' ' HB2' ' A' ' 10' ' ' ARG . 81.3 t80 -64.26 -47.21 80.49 Favored 'General case' 0 N--CA 1.481 1.083 0 C-N-CA 124.764 1.225 . . . . 75.349999999999994 111.851 177.342 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 8' ' ' ILE . . . . . 0.434 ' O ' ' HG3' ' A' ' 12' ' ' GLN . 79.1 mt -62.99 -39.71 86.23 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.91 0 N-CA-C 109.042 -0.725 . . . . 72.430000000000007 109.042 175.588 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 2.4 t-20 -61.06 -35.54 77.21 Favored 'General case' 0 N--CA 1.484 1.231 0 C-N-CA 124.695 1.198 . . . . 70.120000000000005 111.151 178.146 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . 0.498 ' HG3' ' O ' ' A' ' 6' ' ' GLU . 42.1 mtt180 -59.15 -56.7 18.86 Favored 'General case' 0 N--CA 1.474 0.757 0 C-N-CA 123.473 0.709 . . . . 72.510000000000005 109.269 172.416 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 11' ' ' TRP . . . . . 0.407 ' CD1' HG11 ' A' ' 64' ' ' VAL . 93.8 m95 -69.68 -23.47 63.46 Favored 'General case' 0 N--CA 1.468 0.468 0 CA-C-N 114.966 -1.015 . . . . 74.519999999999996 112.758 -175.704 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . 0.434 ' HG3' ' O ' ' A' ' 8' ' ' ILE . 59.3 mt-30 -66.84 -50.37 62.77 Favored 'General case' 0 N--CA 1.473 0.724 0 N-CA-C 108.141 -1.059 . . . . 71.120000000000005 108.141 172.436 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . 0.538 ' HE ' HD11 ' A' ' 17' ' ' LEU . 13.2 tpt180 -57.25 -47.9 80.21 Favored 'General case' 0 CA--C 1.549 0.922 0 O-C-N 124.249 0.968 . . . . 74.439999999999998 111.221 -177.758 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 14' ' ' ILE . . . . . 0.528 HD13 HG22 ' A' ' 47' ' ' VAL . 49.0 mt -67.95 -46.17 82.45 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.063 0 CA-C-N 115.744 -0.662 . . . . 72.030000000000001 110.247 -177.309 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . 0.414 ' HB3' ' OE1' ' A' ' 70' ' ' GLN . . . -61.55 -44.79 96.4 Favored 'General case' 0 N--CA 1.484 1.265 0 C-N-CA 123.614 0.766 . . . . 64.109999999999999 112.038 -178.449 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 85.4 mt -71.18 -44.68 64.98 Favored 'General case' 0 N--CA 1.477 0.897 0 CA-C-N 114.838 -1.073 . . . . 73.310000000000002 110.843 -175.541 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . 0.538 HD11 ' HE ' ' A' ' 13' ' ' ARG . 43.0 mt -72.24 -31.94 66.25 Favored 'General case' 0 N--CA 1.477 0.912 0 CA-C-O 118.874 -0.584 . . . . 74.239999999999995 112.025 -178.094 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 83.0 p -70.71 -39.45 73.41 Favored 'General case' 0 N--CA 1.486 1.34 0 CA-C-N 118.406 0.548 . . . . 73.099999999999994 110.284 175.944 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 5.9 tp-100 -57.89 -43.6 86.22 Favored 'General case' 0 C--O 1.25 1.083 0 CA-C-N 115.344 -0.844 . . . . 75.349999999999994 110.079 172.183 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 49.8 m -60.01 -57.88 10.94 Favored 'General case' 0 C--N 1.353 0.753 0 CA-C-N 114.832 -1.076 . . . . 73.010000000000005 109.98 176.772 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . 0.497 HD22 ' HG ' ' A' ' 33' ' ' LEU . 65.1 mt -57.64 -33.77 68.64 Favored 'General case' 0 N--CA 1.479 0.989 0 C-N-CA 123.607 0.763 . . . . 74.340000000000003 111.241 -175.421 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . 0.627 ' HA ' HD22 ' A' ' 78' ' ' LEU . 64.4 tp -63.34 -61.55 2.27 Favored 'General case' 0 C--O 1.251 1.149 0 O-C-N 123.791 0.682 . . . . 74.209999999999994 110.315 177.375 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . 0.468 ' O ' ' HG3' ' A' ' 27' ' ' ARG . 94.6 mt-10 -57.81 -48.0 80.99 Favored 'General case' 0 C--N 1.356 0.88 0 O-C-N 124.178 0.924 . . . . 74.519999999999996 110.58 -177.392 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 95.7 mt -62.02 -39.44 92.27 Favored 'General case' 0 N--CA 1.476 0.861 0 C-N-CA 124.558 1.143 . . . . 71.549999999999997 111.757 -176.605 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . 0.4 ' HB2' HD22 ' A' ' 33' ' ' LEU . . . -61.11 -44.36 97.47 Favored 'General case' 0 N--CA 1.484 1.228 0 CA-C-O 121.138 0.494 . . . . 53.229999999999997 110.904 175.958 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 81.5 mt-30 -68.03 -32.24 72.47 Favored 'General case' 0 CA--C 1.551 0.997 0 CA-C-N 114.937 -1.029 . . . . 71.25 111.471 177.3 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 27' ' ' ARG . . . . . 0.468 ' HG3' ' O ' ' A' ' 23' ' ' GLU . 89.3 mtt-85 -74.67 -20.06 60.02 Favored 'General case' 0 N--CA 1.486 1.366 0 C-N-CA 123.74 0.816 . . . . 74.219999999999999 111.226 178.811 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 94.44 5.68 61.66 Favored Glycine 0 C--N 1.351 1.385 0 O-C-N 123.272 0.358 . . . . 71.219999999999999 112.72 -176.237 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 7.6 mm-40 -83.07 52.79 2.26 Favored 'General case' 0 CA--C 1.549 0.94 0 C-N-CA 124.058 0.943 . . . . 72.329999999999998 110.541 178.989 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 30' ' ' TRP . . . . . 0.457 ' O ' ' HG ' ' A' ' 34' ' ' LEU . 94.6 m95 -66.87 -23.81 66.06 Favored 'General case' 0 N--CA 1.473 0.695 0 C-N-CA 123.56 0.744 . . . . 74.120000000000005 111.454 -178.936 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 15.2 m-20 -54.22 -46.67 72.57 Favored 'General case' 0 N--CA 1.478 0.928 0 C-N-CA 123.754 0.821 . . . . 74.219999999999999 110.078 172.098 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 93.5 mt -63.26 -33.83 76.35 Favored 'General case' 0 C--O 1.215 -0.725 0 CA-C-N 114.905 -1.043 . . . . 75.049999999999997 110.81 178.069 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . 0.497 ' HG ' HD22 ' A' ' 21' ' ' LEU . 8.1 mp -68.36 -39.89 81.66 Favored 'General case' 0 N--CA 1.488 1.457 0 CA-C-N 118.053 0.388 . . . . 73.329999999999998 111.202 174.138 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . 0.457 ' HG ' ' O ' ' A' ' 30' ' ' TRP . 93.8 mt -65.03 -38.37 90.67 Favored 'General case' 0 N--CA 1.487 1.386 0 C-N-CA 123.555 0.742 . . . . 72.109999999999999 111.542 -177.681 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 1.7 mp0 -77.22 -56.86 4.2 Favored 'General case' 0 N--CA 1.475 0.809 0 CA-C-N 116.068 -0.514 . . . . 65.230000000000004 110.643 176.986 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 82.3 mm-40 -66.81 -14.56 62.8 Favored 'General case' 0 N--CA 1.484 1.227 0 CA-C-O 118.726 -0.654 . . . . 75.049999999999997 112.6 -174.956 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 42.9 tt0 -52.79 -57.8 8.99 Favored 'General case' 0 N--CA 1.481 1.115 0 C-N-CA 123.666 0.786 . . . . 74.549999999999997 111.308 175.577 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 61.5 t -56.97 -43.88 81.61 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.163 0 C-N-CA 123.515 0.726 . . . . 70.439999999999998 111.318 -175.078 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 18.5 p -74.88 -45.49 42.59 Favored 'General case' 0 N--CA 1.477 0.91 0 C-N-CA 123.643 0.777 . . . . 64.120000000000005 112.343 -175.255 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 27.0 t80 -62.9 -42.78 99.9 Favored 'General case' 0 N--CA 1.482 1.155 0 C-N-CA 124.02 0.928 . . . . 75.510000000000005 110.821 179.963 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . 0.626 ' HA ' HG22 ' A' ' 44' ' ' ILE . 88.5 mt -78.47 -31.43 47.88 Favored 'General case' 0 C--O 1.222 -0.378 0 CA-C-N 115.556 -0.747 . . . . 73.439999999999998 111.175 -176.444 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 23.4 tm0? -59.59 -43.6 93.63 Favored 'General case' 0 N--CA 1.476 0.864 0 N-CA-C 108.831 -0.803 . . . . 73.349999999999994 108.831 170.005 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 43' ' ' SER . . . . . 0.558 ' O ' HG23 ' A' ' 47' ' ' VAL . 61.6 m -60.59 -55.08 37.68 Favored 'General case' 0 C--N 1.353 0.728 0 O-C-N 123.946 0.779 . . . . 72.329999999999998 111.106 178.478 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 44' ' ' ILE . . . . . 0.626 HG22 ' HA ' ' A' ' 41' ' ' LEU . 17.2 tt -65.42 -34.51 70.92 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.329 0 C-N-CA 123.019 0.528 . . . . 74.0 111.697 -172.961 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 21.6 mm-40 -61.27 -50.35 73.38 Favored 'General case' 0 C--N 1.356 0.882 0 C-N-CA 123.494 0.718 . . . . 65.310000000000002 109.836 172.078 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 46' ' ' THR . . . . . 0.415 ' O ' ' HB2' ' A' ' 50' ' ' LYS . 97.5 m -54.12 -39.02 66.04 Favored 'General case' 0 N--CA 1.481 1.105 0 C-N-CA 124.352 1.061 . . . . 73.340000000000003 111.534 177.419 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 47' ' ' VAL . . . . . 0.558 HG23 ' O ' ' A' ' 43' ' ' SER . 84.5 t -68.57 -45.0 82.41 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.969 0 C-N-CA 124.005 0.922 . . . . 75.400000000000006 111.447 -178.317 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 48' ' ' MET . . . . . . . . . . . . . 77.5 mtm -67.34 -31.49 71.79 Favored 'General case' 0 N--CA 1.482 1.149 0 O-C-N 123.491 0.494 . . . . 73.549999999999997 111.29 178.214 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 48.2 mt-10 -72.2 -31.2 65.67 Favored 'General case' 0 N--CA 1.481 1.086 0 C-N-CA 123.652 0.781 . . . . 73.219999999999999 110.975 174.576 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . 0.415 ' HB2' ' O ' ' A' ' 46' ' ' THR . 4.6 tppt? -79.5 160.44 26.53 Favored 'General case' 0 N--CA 1.474 0.755 0 C-N-CA 123.151 0.58 . . . . 74.219999999999999 111.858 -168.871 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 8.7 tt0 -81.95 124.87 30.13 Favored 'General case' 0 C--O 1.241 0.642 0 CA-C-N 115.165 -0.925 . . . . 64.319999999999993 110.814 -176.968 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 52' ' ' THR . . . . . 0.742 HG22 ' HB3' ' A' ' 114' ' ' LEU . 96.7 m -69.93 122.85 87.35 Favored Pre-proline 0 CA--C 1.551 0.984 0 N-CA-C 109.162 -0.681 . . . . 74.030000000000001 109.162 166.765 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 53' ' ' PRO . . . . . 0.591 ' HG3' ' HA ' ' A' ' 4' ' ' THR . 72.0 Cg_endo -69.28 156.91 63.23 Favored 'Trans proline' 0 C--N 1.369 1.645 0 C-N-CA 123.002 2.468 . . . . 73.409999999999997 112.573 178.458 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 56.7 Cg_endo -70.7 -44.61 1.36 Allowed 'Trans proline' 0 C--N 1.371 1.723 0 C-N-CA 122.526 2.151 . . . . 74.430000000000007 111.471 172.194 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . -75.04 68.93 1.94 Allowed Glycine 0 C--N 1.352 1.419 0 N-CA-C 115.048 0.779 . . . . 60.399999999999999 115.048 -172.087 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 56' ' ' ILE . . . . . 0.497 HG22 HG23 ' A' ' 60' ' ' ILE . 84.5 mt -110.24 108.46 25.48 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.656 0 N-CA-C 107.579 -1.267 . . . . 75.319999999999993 107.579 176.53 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 42.8 p -82.27 -172.45 3.99 Favored 'General case' 0 N--CA 1.483 1.176 0 C-N-CA 123.016 0.526 . . . . 74.109999999999999 110.552 -177.625 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 29.8 tpt85 -63.06 -60.33 3.59 Favored 'General case' 0 N--CA 1.475 0.794 0 C-N-CA 123.275 0.63 . . . . 75.349999999999994 110.639 -178.771 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 21.0 m -62.4 -33.6 75.09 Favored 'General case' 0 N--CA 1.475 0.798 0 C-N-CA 123.595 0.758 . . . . 64.430000000000007 111.731 -178.101 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 60' ' ' ILE . . . . . 0.497 HG23 HG22 ' A' ' 56' ' ' ILE . 74.4 mt -65.07 -43.68 95.85 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.81 0 C-N-CA 122.921 0.488 . . . . 64.420000000000002 110.125 175.087 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 60.3 tt0 -64.55 -36.64 84.89 Favored 'General case' 0 N--CA 1.48 1.072 0 C-N-CA 123.322 0.649 . . . . 73.120000000000005 111.036 179.196 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 26.5 m-20 -65.64 -46.66 78.36 Favored 'General case' 0 N--CA 1.474 0.731 0 C-N-CA 123.001 0.52 . . . . 75.319999999999993 110.853 176.976 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 63' ' ' MET . . . . . . . . . . . . . 73.3 mtm -65.96 -46.67 77.27 Favored 'General case' 0 N--CA 1.476 0.867 0 O-C-N 123.307 0.38 . . . . 73.299999999999997 111.014 -179.692 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 64' ' ' VAL . . . . . 0.486 ' O ' HG13 ' A' ' 68' ' ' ILE . 52.0 t -63.78 -60.55 2.58 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.566 0 C-N-CA 123.474 0.709 . . . . 74.409999999999997 110.615 -178.535 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . 0.497 ' HB1' HD23 ' A' ' 109' ' ' LEU . . . -60.59 -33.11 72.25 Favored 'General case' 0 N--CA 1.487 1.397 0 O-C-N 123.403 0.44 . . . . 70.140000000000001 111.519 -179.896 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -65.03 -38.04 94.95 Favored Glycine 0 C--N 1.347 1.146 0 CA-C-N 116.3 -0.409 . . . . 63.439999999999998 112.316 175.743 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 67' ' ' TYR . . . . . 0.489 ' O ' HG23 ' A' ' 71' ' ' THR . 17.4 m-30 -74.72 -33.55 62.4 Favored 'General case' 0 N--CA 1.473 0.679 0 C-N-CA 123.218 0.607 . . . . 74.010000000000005 111.238 177.563 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 68' ' ' ILE . . . . . 0.486 HG13 ' O ' ' A' ' 64' ' ' VAL . 59.8 mt -63.68 -49.06 83.83 Favored 'Isoleucine or valine' 0 C--N 1.36 1.052 0 N-CA-C 108.663 -0.866 . . . . 71.409999999999997 108.663 175.63 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 69' ' ' LYS . . . . . 0.503 ' HB2' ' HE2' ' A' ' 106' ' ' TYR . 44.0 tptt -56.33 -44.65 80.21 Favored 'General case' 0 C--N 1.349 0.555 0 C-N-CA 123.572 0.749 . . . . 75.219999999999999 110.901 174.64 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 70' ' ' GLN . . . . . 0.414 ' OE1' ' HB3' ' A' ' 15' ' ' ALA . 63.4 tt0 -61.47 -45.72 93.06 Favored 'General case' 0 C--N 1.349 0.549 0 O-C-N 123.679 0.612 . . . . 74.510000000000005 111.077 -177.49 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 71' ' ' THR . . . . . 0.489 HG23 ' O ' ' A' ' 67' ' ' TYR . 3.0 t -74.7 -39.73 61.78 Favored 'General case' 0 C--N 1.355 0.824 0 CA-C-O 119.646 -0.216 . . . . 75.519999999999996 111.12 -175.185 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 72' ' ' LEU . . . . . 0.486 HD21 ' HB2' ' A' ' 102' ' ' LEU . 44.2 mt -64.85 -39.0 92.85 Favored 'General case' 0 N--CA 1.472 0.67 0 C-N-CA 122.11 0.164 . . . . 75.310000000000002 111.069 178.578 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 73' ' ' ASP . . . . . 0.433 ' O ' ' HG ' ' A' ' 77' ' ' LEU . 14.2 t70 -65.71 -59.63 3.72 Favored 'General case' 0 CA--C 1.543 0.686 0 O-C-N 123.994 0.809 . . . . 70.420000000000002 109.677 -178.702 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 84.1 m-20 -59.52 -45.22 92.38 Favored 'General case' 0 N--CA 1.485 1.317 0 C-N-CA 124.036 0.934 . . . . 72.319999999999993 111.778 -176.2 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 3.3 tm-20 -75.05 -29.86 60.85 Favored 'General case' 0 CA--C 1.555 1.166 0 CA-C-N 115.661 -0.7 . . . . 73.239999999999995 110.413 -174.477 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 9.4 tt0 -75.27 -29.62 60.21 Favored 'General case' 0 N--CA 1.488 1.458 0 O-C-N 122.056 -0.403 . . . . 75.329999999999998 110.746 175.076 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . 0.433 ' HG ' ' O ' ' A' ' 73' ' ' ASP . 93.2 mt -65.43 -39.99 92.77 Favored 'General case' 0 N--CA 1.48 1.07 0 N-CA-C 109.428 -0.582 . . . . 73.329999999999998 109.428 172.475 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . 0.627 HD22 ' HA ' ' A' ' 22' ' ' LEU . 72.7 mt -58.23 -47.67 82.81 Favored 'General case' 0 N--CA 1.477 0.889 0 CA-C-N 115.378 -0.828 . . . . 74.319999999999993 111.246 170.476 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 79' ' ' LYS . . . . . 0.44 ' HA ' ' HD3' ' A' ' 79' ' ' LYS . 25.9 mmtp -66.92 -28.56 68.4 Favored 'General case' 0 N--CA 1.475 0.81 0 C-N-CA 123.161 0.584 . . . . 72.150000000000006 112.463 -177.991 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -72.26 -33.99 61.38 Favored Glycine 0 C--N 1.347 1.175 0 N-CA-C 111.572 -0.611 . . . . 54.020000000000003 111.572 171.259 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 7.1 tt -73.61 -36.11 65.45 Favored 'General case' 0 CA--C 1.554 1.125 0 C-N-CA 124.224 1.009 . . . . 63.200000000000003 110.266 177.762 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 95.1 mt . . . . . 0 C--N 1.357 0.929 0 C-N-CA 123.078 0.551 . . . . 73.319999999999993 111.258 -171.973 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 92' ' ' LEU . . . . . 0.467 HD11 HD21 ' A' ' 41' ' ' LEU . 64.4 mt . . . . . 0 N--CA 1.49 1.536 0 N-CA-C 110.324 -0.25 . . . . 74.420000000000002 110.324 . . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 59.0 mt -62.03 92.16 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.482 1.14 0 C-N-CA 124.365 1.066 . . . . 64.329999999999998 111.877 -172.954 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 60.78 30.57 73.05 Favored Glycine 0 C--N 1.353 1.499 0 CA-C-N 115.769 -0.651 . . . . 63.240000000000002 113.506 178.83 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 21.0 pt20 42.18 36.39 0.7 Allowed 'General case' 0 N--CA 1.497 1.918 0 C-N-CA 126.297 1.839 . . . . 73.140000000000001 112.849 -172.392 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 72.7 m -155.0 -168.48 2.89 Favored 'General case' 0 N--CA 1.48 1.051 0 C-N-CA 125.719 1.608 . . . . 73.109999999999999 107.873 178.138 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 54.0 m 76.83 -42.53 0.42 Allowed 'General case' 0 N--CA 1.49 1.564 0 C-N-CA 124.678 1.191 . . . . 73.310000000000002 113.473 170.159 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 1.1 tmm_? -50.81 -51.24 52.77 Favored 'General case' 0 N--CA 1.482 1.135 0 C-N-CA 125.301 1.44 . . . . 75.129999999999995 111.522 -170.291 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 30.8 tt0 -61.61 -45.82 92.44 Favored 'General case' 0 C--N 1.355 0.831 0 O-C-N 123.496 0.497 . . . . 71.209999999999994 109.975 -175.781 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 64.4 tttp -68.29 -29.26 67.99 Favored 'General case' 0 N--CA 1.482 1.162 0 O-C-N 124.098 0.874 . . . . 73.450000000000003 111.737 179.542 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 35.1 t -72.79 -41.29 65.14 Favored 'General case' 0 N--CA 1.478 0.957 0 C-N-CA 123.361 0.665 . . . . 62.109999999999999 110.282 -177.551 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 102' ' ' LEU . . . . . 0.486 ' HB2' HD21 ' A' ' 72' ' ' LEU . 9.2 mp -79.36 -23.73 43.16 Favored 'General case' 0 N--CA 1.476 0.841 0 CA-C-N 116.07 -0.514 . . . . 74.439999999999998 110.934 174.97 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -72.46 -34.15 67.52 Favored 'General case' 0 N--CA 1.482 1.175 0 N-CA-C 108.602 -0.888 . . . . 72.150000000000006 108.602 174.476 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 9.6 t30 -71.65 -37.34 70.83 Favored 'General case' 0 N--CA 1.474 0.753 0 CA-C-N 115.213 -0.903 . . . . 73.109999999999999 109.226 174.037 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 105' ' ' ALA . . . . . 0.46 ' O ' ' HG ' ' A' ' 114' ' ' LEU . . . -61.1 -48.96 79.25 Favored 'General case' 0 CA--C 1.538 0.502 0 O-C-N 123.733 0.646 . . . . 75.239999999999995 110.315 175.504 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 106' ' ' TYR . . . . . 0.503 ' HE2' ' HB2' ' A' ' 69' ' ' LYS . 7.8 t80 -61.14 -51.9 67.14 Favored 'General case' 0 CA--C 1.541 0.611 0 CA-C-N 116.008 -0.542 . . . . 73.340000000000003 109.733 179.564 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -63.37 -44.48 96.78 Favored Glycine 0 C--N 1.354 1.581 0 O-C-N 124.212 0.945 . . . . 74.409999999999997 113.19 -173.815 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 5.8 tpm_? -69.13 -34.29 74.79 Favored 'General case' 0 C--N 1.348 0.522 0 C-N-CA 122.996 0.518 . . . . 73.530000000000001 109.909 179.935 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 109' ' ' LEU . . . . . 0.497 HD23 ' HB1' ' A' ' 65' ' ' ALA . 54.9 tp -65.91 -45.76 80.75 Favored 'General case' 0 N--CA 1.488 1.426 0 C-N-CA 123.055 0.542 . . . . 75.230000000000004 110.616 176.072 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 42.4 t -59.59 -48.58 81.11 Favored 'General case' 0 CA--C 1.531 0.249 0 O-C-N 124.738 1.274 . . . . 74.540000000000006 110.551 -176.471 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . -85.4 -59.32 1.94 Allowed Glycine 0 C--N 1.356 1.646 0 CA-C-O 119.299 -0.723 . . . . 65.519999999999996 112.957 -178.463 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 112' ' ' MET . . . . . . . . . . . . . 8.0 tpt -93.07 -70.4 0.7 Allowed 'General case' 0 N--CA 1.489 1.479 0 CA-C-N 118.216 1.008 . . . . 75.519999999999996 113.143 -178.011 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 113' ' ' LEU . . . . . 0.411 HD12 ' HB ' ' A' ' 56' ' ' ILE . 15.1 tp 168.36 13.9 0.0 OUTLIER 'General case' 0 N--CA 1.507 2.379 0 C-N-CA 123.575 0.75 . . . . 75.120000000000005 112.267 -173.498 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 114' ' ' LEU . . . . . 0.742 ' HB3' HG22 ' A' ' 52' ' ' THR . 0.9 OUTLIER . . . . . 0 N--CA 1.502 2.138 0 C-N-CA 125.089 1.356 . . . . 72.439999999999998 109.98 -176.153 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 1' ' ' MET . . . . . 0.423 ' O ' HG21 ' A' ' 5' ' ' VAL . 16.5 tpt . . . . . 0 N--CA 1.487 1.376 0 CA-C-O 119.325 -0.369 . . . . 70.340000000000003 111.383 . . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 30.5 p -55.63 -51.36 67.45 Favored 'General case' 0 N--CA 1.489 1.488 0 C-N-CA 123.224 0.61 . . . . 70.0 112.229 -176.647 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 35.6 m -64.55 -29.58 70.61 Favored 'General case' 0 CA--C 1.541 0.601 0 CA-C-N 115.551 -0.749 . . . . 72.5 111.14 178.576 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 4' ' ' THR . . . . . 0.486 ' HA ' ' HG3' ' A' ' 53' ' ' PRO . 4.5 m -74.13 -33.3 63.5 Favored 'General case' 0 N--CA 1.473 0.688 0 C-N-CA 123.36 0.664 . . . . 70.129999999999995 110.976 178.845 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 5' ' ' VAL . . . . . 0.423 HG21 ' O ' ' A' ' 1' ' ' MET . 89.5 t -69.39 -45.64 78.33 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.793 0 N-CA-C 109.273 -0.64 . . . . 71.530000000000001 109.273 177.045 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 25.1 mm-40 -55.07 -47.76 74.43 Favored 'General case' 0 N--CA 1.478 0.961 0 O-C-N 123.627 0.579 . . . . 73.310000000000002 110.831 172.789 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 7' ' ' PHE . . . . . 0.638 ' HZ ' HD13 ' A' ' 109' ' ' LEU . 72.8 t80 -55.38 -61.8 2.09 Favored 'General case' 0 CA--C 1.558 1.275 0 C-N-CA 124.621 1.168 . . . . 73.109999999999999 111.922 -178.573 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 8' ' ' ILE . . . . . 0.41 ' O ' ' HG3' ' A' ' 12' ' ' GLN . 65.2 mt -57.77 -48.79 82.8 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.08 0 C-N-CA 123.473 0.709 . . . . 73.5 110.615 -178.905 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 2.7 t-20 -65.32 -37.82 88.28 Favored 'General case' 0 N--CA 1.473 0.679 0 O-C-N 124.067 0.855 . . . . 71.239999999999995 111.818 -171.329 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 56.3 mtt180 -69.67 -38.59 77.11 Favored 'General case' 0 CA--C 1.543 0.677 0 CA-C-N 116.151 -0.477 . . . . 75.120000000000005 110.343 176.674 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 11' ' ' TRP . . . . . . . . . . . . . 80.0 m95 -68.82 -27.92 66.28 Favored 'General case' 0 N--CA 1.488 1.44 0 N-CA-C 112.054 0.39 . . . . 71.030000000000001 112.054 174.419 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . 0.41 ' HG3' ' O ' ' A' ' 8' ' ' ILE . 56.1 mt-30 -64.12 -47.69 79.0 Favored 'General case' 0 N--CA 1.478 0.945 0 N-CA-C 109.083 -0.71 . . . . 74.140000000000001 109.083 172.581 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 15.7 tpt180 -54.24 -49.75 68.77 Favored 'General case' 0 CA--C 1.548 0.875 0 C-N-CA 124.036 0.934 . . . . 73.120000000000005 110.889 177.735 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 14' ' ' ILE . . . . . 0.451 HD11 HG23 ' A' ' 47' ' ' VAL . 96.9 mt -59.95 -52.56 59.7 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.894 0 C-N-CA 124.236 1.015 . . . . 74.140000000000001 111.582 -178.104 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -60.06 -45.2 93.64 Favored 'General case' 0 N--CA 1.474 0.746 0 C-N-CA 123.599 0.759 . . . . 72.049999999999997 112.037 -176.55 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 96.1 mt -69.27 -40.8 77.56 Favored 'General case' 0 N--CA 1.475 0.804 0 CA-C-N 114.956 -1.02 . . . . 72.420000000000002 111.107 -177.517 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . 0.497 ' O ' ' HG ' ' A' ' 21' ' ' LEU . 43.1 mt -62.19 -51.92 65.87 Favored 'General case' 0 N--CA 1.478 0.927 0 C-N-CA 122.798 0.439 . . . . 74.540000000000006 110.485 177.894 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 77.8 p -61.94 -40.41 95.43 Favored 'General case' 0 N--CA 1.475 0.817 0 C-N-CA 123.275 0.63 . . . . 71.010000000000005 111.501 -176.676 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 6.6 tp-100 -63.75 -42.24 97.87 Favored 'General case' 0 C--N 1.36 1.034 0 O-C-N 123.294 0.371 . . . . 75.030000000000001 110.428 176.694 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 65.5 m -60.52 -45.45 93.79 Favored 'General case' 0 CA--C 1.538 0.498 0 O-C-N 123.468 0.48 . . . . 52.039999999999999 110.712 176.248 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . 0.649 HD21 ' HA ' ' A' ' 33' ' ' LEU . 69.6 mt -63.29 -33.54 75.73 Favored 'General case' 0 N--CA 1.476 0.839 0 C-N-CA 123.347 0.659 . . . . 75.200000000000003 110.696 -179.092 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . 0.646 ' HA ' HD22 ' A' ' 78' ' ' LEU . 57.9 tp -67.56 -53.34 29.2 Favored 'General case' 0 CA--C 1.544 0.724 0 C-N-CA 123.183 0.593 . . . . 74.450000000000003 110.677 178.036 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . 0.417 ' O ' ' HG3' ' A' ' 27' ' ' ARG . 37.3 mt-10 -56.23 -47.87 77.62 Favored 'General case' 0 N--CA 1.481 1.093 0 C-N-CA 123.874 0.87 . . . . 54.119999999999997 110.556 179.035 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . 0.482 HD23 HD13 ' A' ' 32' ' ' LEU . 87.6 mt -66.02 -35.34 80.3 Favored 'General case' 0 C--O 1.217 -0.653 0 CA-C-N 114.961 -1.018 . . . . 74.530000000000001 110.996 -177.138 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . 0.482 ' HB3' HD22 ' A' ' 33' ' ' LEU . . . -65.04 -38.97 92.61 Favored 'General case' 0 N--CA 1.482 1.154 0 CA-C-O 121.019 0.438 . . . . 74.340000000000003 111.27 175.397 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 96.7 mt-30 -70.94 -27.72 63.97 Favored 'General case' 0 N--CA 1.48 1.041 0 CA-C-N 115.323 -0.853 . . . . 75.540000000000006 111.333 177.456 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 27' ' ' ARG . . . . . 0.445 ' HD2' HD22 ' A' ' 24' ' ' LEU . 96.9 mtt180 -78.07 -26.85 48.43 Favored 'General case' 0 N--CA 1.478 0.97 0 C-N-CA 123.385 0.674 . . . . 74.140000000000001 110.469 172.469 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 95.54 13.95 49.17 Favored Glycine 0 C--N 1.346 1.121 0 CA-C-N 115.992 -0.549 . . . . 72.549999999999997 113.37 -177.534 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 29' ' ' GLU . . . . . 0.411 ' HG2' ' HB2' ' A' ' 27' ' ' ARG . 8.7 mm-40 -84.88 59.38 5.55 Favored 'General case' 0 CA--C 1.553 1.076 0 C-N-CA 123.961 0.904 . . . . 70.530000000000001 110.326 176.713 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 30' ' ' TRP . . . . . . . . . . . . . 95.2 m95 -65.4 -22.3 66.77 Favored 'General case' 0 N--CA 1.485 1.302 0 C-N-CA 123.875 0.87 . . . . 74.540000000000006 111.714 -177.734 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 31' ' ' ASP . . . . . 0.4 ' O ' ' HG3' ' A' ' 35' ' ' GLN . 11.9 m-20 -53.56 -53.27 54.13 Favored 'General case' 0 C--N 1.35 0.62 0 O-C-N 123.753 0.658 . . . . 62.399999999999999 109.919 171.354 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . 0.482 HD13 HD23 ' A' ' 24' ' ' LEU . 78.5 mt -63.19 -27.25 69.24 Favored 'General case' 0 N--CA 1.475 0.788 0 O-C-N 124.082 0.864 . . . . 73.530000000000001 111.444 -175.198 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . 0.649 ' HA ' HD21 ' A' ' 21' ' ' LEU . 9.0 mp -69.2 -54.92 12.33 Favored 'General case' 0 N--CA 1.479 0.988 0 C-N-CA 122.551 0.34 . . . . 65.239999999999995 110.421 174.253 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 91.0 mt -63.96 -29.03 70.23 Favored 'General case' 0 N--CA 1.484 1.255 0 O-C-N 123.814 0.696 . . . . 74.329999999999998 112.017 -176.344 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 35' ' ' GLN . . . . . 0.4 ' HG3' ' O ' ' A' ' 31' ' ' ASP . 94.1 mt-30 -71.67 -43.32 66.24 Favored 'General case' 0 N--CA 1.476 0.87 0 C-N-CA 123.374 0.669 . . . . 73.430000000000007 110.7 176.889 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 81.9 mm-40 -85.56 -14.47 45.7 Favored 'General case' 0 N--CA 1.481 1.095 0 C-N-CA 123.166 0.586 . . . . 75.340000000000003 112.369 -178.219 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 41.2 tt0 -51.81 -55.79 17.82 Favored 'General case' 0 N--CA 1.479 1.004 0 C-N-CA 125.069 1.348 . . . . 72.340000000000003 112.54 -173.621 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 63.9 t -62.77 -44.61 99.63 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.895 0 C-N-CA 122.754 0.421 . . . . 71.530000000000001 111.101 -175.407 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 65.3 m -65.43 -38.62 90.45 Favored 'General case' 0 N--CA 1.481 1.086 0 C-N-CA 123.021 0.528 . . . . 63.130000000000003 111.029 -178.908 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 46.1 t80 -66.73 -54.46 22.66 Favored 'General case' 0 CA--C 1.539 0.554 0 CA-C-N 115.262 -0.881 . . . . 74.030000000000001 110.761 -178.924 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . 0.475 HD22 HD22 ' A' ' 92' ' ' LEU . 75.3 mt -62.11 -38.71 89.95 Favored 'General case' 0 N--CA 1.477 0.88 0 O-C-N 123.746 0.654 . . . . 73.239999999999995 110.375 -177.641 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 54.0 tt0 -53.53 -57.23 11.44 Favored 'General case' 0 C--O 1.247 0.925 0 C-N-CA 124.253 1.021 . . . . 63.409999999999997 110.329 174.682 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 43' ' ' SER . . . . . 0.524 ' O ' HG21 ' A' ' 47' ' ' VAL . 51.6 m -54.02 -60.65 3.05 Favored 'General case' 0 CA--C 1.544 0.713 0 O-C-N 124.56 1.163 . . . . 73.400000000000006 111.397 179.496 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 44' ' ' ILE . . . . . 0.433 HG13 HD12 ' A' ' 14' ' ' ILE . 19.0 tt -60.15 -40.82 84.6 Favored 'Isoleucine or valine' 0 C--O 1.257 1.493 0 C-N-CA 123.677 0.791 . . . . 73.25 112.974 -168.586 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . 0.436 ' HG2' ' O ' ' A' ' 41' ' ' LEU . 23.1 mm-40 -67.99 -45.55 73.79 Favored 'General case' 0 C--N 1.348 0.538 0 CA-C-N 116.521 -0.309 . . . . 75.219999999999999 110.189 178.036 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 41.4 m -62.25 -26.36 68.34 Favored 'General case' 0 CA--C 1.56 1.349 0 O-C-N 123.38 0.425 . . . . 74.209999999999994 112.031 178.66 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 47' ' ' VAL . . . . . 0.524 HG21 ' O ' ' A' ' 43' ' ' SER . 59.3 t -72.12 -46.57 58.06 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.434 0 C-N-CA 122.718 0.407 . . . . 72.099999999999994 110.502 175.933 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 48' ' ' MET . . . . . . . . . . . . . 71.6 mtm -67.74 -26.43 66.13 Favored 'General case' 0 N--CA 1.488 1.43 0 N-CA-C 111.77 0.285 . . . . 72.030000000000001 111.77 178.822 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 42.8 mt-10 -81.53 -20.6 39.69 Favored 'General case' 0 N--CA 1.479 0.987 0 C-N-CA 123.69 0.796 . . . . 75.140000000000001 111.192 175.451 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . 0.518 ' HZ1' ' HB2' ' A' ' 50' ' ' LYS . 0.2 OUTLIER -75.8 136.44 40.24 Favored 'General case' 0 C--O 1.244 0.781 0 N-CA-C 109.291 -0.633 . . . . 73.019999999999996 109.291 -179.706 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 7.2 tt0 -61.86 113.85 3.01 Favored 'General case' 0 C--O 1.241 0.656 0 O-C-N 123.448 0.467 . . . . 64.150000000000006 110.007 178.73 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 52' ' ' THR . . . . . 0.407 HG23 ' O ' ' A' ' 114' ' ' LEU . 89.3 m -65.26 128.47 93.82 Favored Pre-proline 0 CA--C 1.553 1.064 0 CA-C-N 115.769 -0.65 . . . . 74.219999999999999 109.71 173.883 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 53' ' ' PRO . . . . . 0.486 ' HG3' ' HA ' ' A' ' 4' ' ' THR . 29.3 Cg_endo -60.27 153.52 58.86 Favored 'Trans proline' 0 C--N 1.375 1.948 0 C-N-CA 122.915 2.41 . . . . 72.25 112.608 178.93 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 54' ' ' PRO . . . . . 0.414 ' HD3' ' HA ' ' A' ' 53' ' ' PRO . 5.0 Cg_exo -81.63 -49.16 0.05 OUTLIER 'Trans proline' 0 C--N 1.369 1.627 0 C-N-CA 123.117 2.544 . . . . 71.239999999999995 112.973 179.479 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . -78.53 80.9 1.39 Allowed Glycine 0 C--N 1.348 1.22 0 CA-C-N 116.498 -0.319 . . . . 73.200000000000003 112.509 -175.208 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 56' ' ' ILE . . . . . 0.612 HG21 HD23 ' A' ' 114' ' ' LEU . 74.2 mt -121.83 144.0 32.51 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.786 0 C-N-CA 123.977 0.911 . . . . 73.409999999999997 109.428 -179.039 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 66.0 p -99.88 170.25 8.65 Favored 'General case' 0 N--CA 1.479 1.014 0 C-N-CA 123.554 0.742 . . . . 72.209999999999994 111.005 177.466 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 13.3 tpt180 -64.65 -35.42 80.97 Favored 'General case' 0 C--N 1.357 0.897 0 C-N-CA 123.208 0.603 . . . . 64.209999999999994 111.439 178.164 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 20.4 m -59.9 -41.81 92.48 Favored 'General case' 0 N--CA 1.482 1.138 0 CA-C-O 121.175 0.512 . . . . 74.530000000000001 110.768 178.518 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 83.3 mt -66.93 -39.26 83.1 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.603 0 CA-C-N 114.996 -1.002 . . . . 75.140000000000001 110.03 176.109 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 61' ' ' GLN . . . . . 0.497 HE21 ' HA ' ' A' ' 110' ' ' SER . 52.3 tt0 -60.89 -35.72 77.36 Favored 'General case' 0 N--CA 1.481 1.076 0 C-N-CA 123.727 0.811 . . . . 74.299999999999997 111.16 176.876 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 57.8 m-20 -73.84 -45.42 51.33 Favored 'General case' 0 N--CA 1.478 0.958 0 C-N-CA 123.073 0.549 . . . . 74.209999999999994 111.468 -179.57 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 63' ' ' MET . . . . . . . . . . . . . 67.1 mtm -66.05 -51.36 58.95 Favored 'General case' 0 N--CA 1.481 1.119 0 C-N-CA 122.708 0.403 . . . . 74.349999999999994 110.889 -179.888 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 64' ' ' VAL . . . . . 0.41 ' O ' HG13 ' A' ' 68' ' ' ILE . 77.3 t -63.13 -59.56 4.17 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.538 0 C-N-CA 123.356 0.662 . . . . 74.310000000000002 111.364 -179.871 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . 0.48 ' HB3' HD21 ' A' ' 109' ' ' LEU . . . -69.14 -22.47 63.94 Favored 'General case' 0 N--CA 1.485 1.313 0 CA-C-N 118.491 0.587 . . . . 74.239999999999995 111.326 -176.606 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -67.42 -38.98 91.45 Favored Glycine 0 C--N 1.348 1.195 0 N-CA-C 111.886 -0.485 . . . . 74.239999999999995 111.886 170.752 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 67' ' ' TYR . . . . . 0.407 ' O ' HG21 ' A' ' 71' ' ' THR . 1.8 m-30 -74.92 -32.32 61.75 Favored 'General case' 0 C--O 1.241 0.636 0 C-N-CA 123.405 0.682 . . . . 70.329999999999998 112.034 175.603 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 68' ' ' ILE . . . . . 0.475 ' O ' ' HG ' ' A' ' 72' ' ' LEU . 19.5 mt -68.53 -38.79 79.65 Favored 'Isoleucine or valine' 0 C--N 1.357 0.894 0 N-CA-C 108.495 -0.928 . . . . 75.010000000000005 108.495 175.03 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 12.3 tmtt? -57.73 -48.81 78.55 Favored 'General case' 0 N--CA 1.48 1.034 0 C-N-CA 123.767 0.827 . . . . 73.420000000000002 108.791 175.63 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 70' ' ' GLN . . . . . 0.443 ' HG2' HD22 ' A' ' 74' ' ' ASN . 64.6 tt0 -53.58 -49.91 66.71 Favored 'General case' 0 CA--C 1.544 0.734 0 O-C-N 124.522 1.139 . . . . 72.040000000000006 110.718 178.652 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 71' ' ' THR . . . . . 0.407 HG21 ' O ' ' A' ' 67' ' ' TYR . 2.9 t -75.12 -21.56 58.78 Favored 'General case' 0 C--N 1.358 0.959 0 CA-C-O 119.293 -0.384 . . . . 75.329999999999998 111.925 -178.542 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 72' ' ' LEU . . . . . 0.475 ' HG ' ' O ' ' A' ' 68' ' ' ILE . 25.4 mt -61.36 -52.43 64.67 Favored 'General case' 0 N--CA 1.487 1.406 0 N-CA-C 108.852 -0.796 . . . . 71.439999999999998 108.852 173.064 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 5.3 m-20 -61.66 -57.39 12.19 Favored 'General case' 0 N--CA 1.475 0.785 0 O-C-N 124.064 0.853 . . . . 71.239999999999995 110.846 178.675 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 74' ' ' ASN . . . . . 0.475 ' HA ' HD21 ' A' ' 22' ' ' LEU . 79.9 m-20 -51.87 -54.43 29.27 Favored 'General case' 0 N--CA 1.484 1.247 0 C-N-CA 124.177 0.991 . . . . 74.030000000000001 111.434 -174.403 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . 0.59 ' O ' ' HG2' ' A' ' 79' ' ' LYS . 10.4 mm-40 -60.26 -57.16 13.98 Favored 'General case' 0 C--O 1.221 -0.427 0 CA-C-N 115.268 -0.878 . . . . 65.5 111.295 179.224 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 9.3 tt0 -62.61 -29.64 70.75 Favored 'General case' 0 N--CA 1.484 1.247 0 O-C-N 123.67 0.606 . . . . 65.510000000000005 112.182 -172.014 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 77.2 mt -72.23 -40.89 67.41 Favored 'General case' 0 N--CA 1.473 0.711 0 C-N-CA 123.613 0.765 . . . . 73.230000000000004 110.042 175.604 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . 0.646 HD22 ' HA ' ' A' ' 22' ' ' LEU . 71.9 mt -61.94 -36.9 82.78 Favored 'General case' 0 N--CA 1.488 1.435 0 C-N-CA 123.135 0.574 . . . . 72.219999999999999 111.559 173.158 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 79' ' ' LYS . . . . . 0.59 ' HG2' ' O ' ' A' ' 75' ' ' GLU . 33.7 mmtm -69.21 -47.64 64.26 Favored 'General case' 0 N--CA 1.473 0.723 0 N-CA-C 109.18 -0.674 . . . . 73.140000000000001 109.18 -177.634 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -64.68 -29.09 74.28 Favored Glycine 0 C--N 1.35 1.315 0 CA-C-N 115.283 -0.872 . . . . 61.43 112.731 175.782 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 2.6 tt -69.82 -40.39 75.95 Favored 'General case' 0 CA--C 1.547 0.854 0 C-N-CA 123.724 0.81 . . . . 73.439999999999998 109.321 177.418 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 93.1 mt . . . . . 0 C--N 1.352 0.699 0 N-CA-C 109.468 -0.567 . . . . 74.319999999999993 109.468 179.196 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 92' ' ' LEU . . . . . 0.475 HD22 HD22 ' A' ' 41' ' ' LEU . 81.0 mt . . . . . 0 N--CA 1.481 1.087 0 CA-C-O 121.149 0.499 . . . . 72.25 111.112 . . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 59.5 mt -98.42 -34.23 4.49 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.884 0 C-N-CA 123.52 0.728 . . . . 74.420000000000002 109.444 175.239 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 140.31 -28.0 2.49 Favored Glycine 0 C--N 1.337 0.627 0 N-CA-C 110.281 -1.127 . . . . 74.230000000000004 110.281 -173.309 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 21.6 mp0 -98.74 146.84 25.48 Favored 'General case' 0 C--O 1.245 0.85 0 N-CA-C 107.649 -1.241 . . . . 75.530000000000001 107.649 173.765 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 52.8 p -72.08 83.08 0.98 Allowed 'General case' 0 CA--C 1.545 0.753 0 CA-C-O 121.804 0.811 . . . . 74.129999999999995 110.249 179.516 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 7.1 t -107.17 3.46 25.69 Favored 'General case' 0 CA--C 1.541 0.621 0 CA-C-N 115.058 -0.974 . . . . 72.209999999999994 111.425 -171.078 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 98' ' ' ARG . . . . . 0.462 ' HG2' HD12 ' A' ' 92' ' ' LEU . 0.0 OUTLIER -59.93 -61.97 2.22 Favored 'General case' 0 N--CA 1.482 1.131 0 CA-C-N 117.959 0.345 . . . . 71.420000000000002 110.432 -170.384 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 1.4 tm0? -72.68 -41.12 65.69 Favored 'General case' 0 N--CA 1.467 0.378 0 CA-C-N 115.541 -0.754 . . . . 73.209999999999994 109.799 -174.478 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 40.3 ttmt -63.28 -55.08 27.73 Favored 'General case' 0 C--N 1.348 0.539 0 O-C-N 123.754 0.659 . . . . 73.420000000000002 111.26 -175.1 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 33.7 t -75.14 -28.48 60.17 Favored 'General case' 0 N--CA 1.476 0.845 0 C-N-CA 123.357 0.663 . . . . 65.049999999999997 111.733 -174.939 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 10.5 tp -75.84 -35.57 59.91 Favored 'General case' 0 CA--C 1.549 0.937 0 CA-C-N 118.18 0.445 . . . . 75.129999999999995 110.657 178.526 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 5.0 t-20 -78.86 -26.48 44.04 Favored 'General case' 0 N--CA 1.481 1.089 0 C-N-CA 123.428 0.691 . . . . 74.329999999999998 110.248 176.58 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 104' ' ' ASN . . . . . 0.413 ' ND2' HH11 ' A' ' 108' ' ' ARG . 24.6 t-20 -67.53 -50.42 58.76 Favored 'General case' 0 N--CA 1.476 0.862 0 C-N-CA 123.927 0.891 . . . . 72.310000000000002 109.386 173.543 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 105' ' ' ALA . . . . . 0.447 ' O ' ' HB2' ' A' ' 109' ' ' LEU . . . -56.23 -46.62 79.47 Favored 'General case' 0 C--N 1.35 0.596 0 CA-C-N 115.096 -0.956 . . . . 75.209999999999994 110.244 175.959 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 106' ' ' TYR . . . . . . . . . . . . . 6.4 t80 -57.6 -43.06 84.41 Favored 'General case' 0 N--CA 1.478 0.931 0 C-N-CA 124.539 1.135 . . . . 74.049999999999997 110.705 176.215 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -62.33 -51.55 55.68 Favored Glycine 0 C--N 1.348 1.232 0 O-C-N 123.595 0.56 . . . . 72.409999999999997 113.094 -176.453 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 108' ' ' ARG . . . . . 0.413 HH11 ' ND2' ' A' ' 104' ' ' ASN . 0.0 OUTLIER -67.81 -33.13 74.2 Favored 'General case' 0 C--O 1.251 1.137 0 C-N-CA 122.548 0.339 . . . . 62.520000000000003 110.459 177.717 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 109' ' ' LEU . . . . . 0.738 ' HA ' ' HA ' ' A' ' 114' ' ' LEU . 4.6 tp -61.92 -55.1 33.07 Favored 'General case' 0 C--N 1.354 0.774 0 O-C-N 124.213 0.945 . . . . 73.519999999999996 110.596 -177.733 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 110' ' ' SER . . . . . 0.497 ' HA ' HE21 ' A' ' 61' ' ' GLN . 17.2 m -78.62 -18.05 55.1 Favored 'General case' 0 CA--C 1.542 0.65 0 CA-C-N 114.965 -1.016 . . . . 72.219999999999999 110.526 179.084 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . -73.01 -62.41 3.15 Favored Glycine 0 C--N 1.359 1.836 0 CA-C-O 118.571 -1.127 . . . . 73.439999999999998 114.74 -176.565 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 112' ' ' MET . . . . . . . . . . . . . 2.8 tmm? -94.5 -63.93 1.13 Allowed 'General case' 0 N--CA 1.503 2.213 0 CA-C-N 119.487 1.644 . . . . 74.319999999999993 111.162 -175.139 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 2.5 tm? 170.75 60.8 0.0 OUTLIER 'General case' 0 N--CA 1.48 1.041 0 N-CA-C 105.487 -2.042 . . . . 75.530000000000001 105.487 -177.649 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 114' ' ' LEU . . . . . 0.738 ' HA ' ' HA ' ' A' ' 109' ' ' LEU . 5.4 mp . . . . . 0 N--CA 1.475 0.82 0 CA-C-N 113.02 -1.9 . . . . 74.120000000000005 115.33 171.53 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 20.2 ptt? . . . . . 0 N--CA 1.479 1.005 0 CA-C-O 121.293 0.568 . . . . 75.219999999999999 109.888 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 52.0 p -56.79 -33.12 66.35 Favored 'General case' 0 N--CA 1.482 1.16 0 C-N-CA 123.52 0.728 . . . . 63.450000000000003 111.971 -176.012 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 59.2 p -63.39 -43.41 97.65 Favored 'General case' 0 CA--C 1.549 0.92 0 C-N-CA 123.502 0.721 . . . . 74.219999999999999 110.995 175.098 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 27.6 m -69.63 -37.53 76.85 Favored 'General case' 0 N--CA 1.478 0.934 0 C-N-CA 123.581 0.752 . . . . 63.340000000000003 111.581 179.211 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 89.3 t -64.47 -47.16 90.52 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.819 0 C-N-CA 123.078 0.551 . . . . 72.340000000000003 109.858 179.664 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 16.7 mm-40 -60.26 -42.44 95.34 Favored 'General case' 0 C--O 1.218 -0.595 0 O-C-N 123.897 0.748 . . . . 64.329999999999998 110.563 173.495 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 7' ' ' PHE . . . . . 0.401 ' CZ ' HG21 ' A' ' 52' ' ' THR . 35.7 t80 -59.19 -53.51 57.46 Favored 'General case' 0 CA--C 1.546 0.805 0 C-N-CA 123.626 0.77 . . . . 74.519999999999996 111.181 -176.851 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 52.0 mt -63.04 -45.89 97.62 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.033 0 C-N-CA 123.184 0.594 . . . . 73.409999999999997 110.311 179.226 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 3.4 t-20 -63.49 -32.99 74.6 Favored 'General case' 0 N--CA 1.48 1.028 0 C-N-CA 123.615 0.766 . . . . 75.310000000000002 111.454 -176.398 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . 0.476 ' O ' HG13 ' A' ' 14' ' ' ILE . 94.7 mtt180 -79.59 -29.39 41.16 Favored 'General case' 0 C--O 1.214 -0.775 0 CA-C-N 115.828 -0.624 . . . . 73.340000000000003 110.5 177.202 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 11' ' ' TRP . . . . . . . . . . . . . 79.3 m95 -76.6 -19.71 57.55 Favored 'General case' 0 N--CA 1.479 1.004 0 CA-C-O 119.186 -0.435 . . . . 73.299999999999997 111.053 171.362 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 51.3 mt-30 -68.73 -48.87 62.7 Favored 'General case' 0 N--CA 1.481 1.102 0 N-CA-C 108.196 -1.038 . . . . 75.040000000000006 108.196 168.265 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . 0.473 ' HB3' ' O ' ' A' ' 10' ' ' ARG . 17.6 tpt180 -48.25 -52.33 21.63 Favored 'General case' 0 CA--C 1.554 1.1 0 C-N-CA 124.939 1.296 . . . . 75.430000000000007 110.997 173.771 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 14' ' ' ILE . . . . . 0.476 HG13 ' O ' ' A' ' 10' ' ' ARG . 74.7 mt -69.08 -48.35 69.97 Favored 'Isoleucine or valine' 0 CA--C 1.558 1.267 0 C-N-CA 123.774 0.83 . . . . 71.409999999999997 111.267 -177.053 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -60.66 -48.4 81.93 Favored 'General case' 0 N--CA 1.487 1.424 0 C-N-CA 123.562 0.745 . . . . 72.409999999999997 111.964 -177.328 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 95.4 mt -69.26 -44.29 72.2 Favored 'General case' 0 CA--C 1.539 0.544 0 CA-C-N 115.079 -0.964 . . . . 73.049999999999997 111.046 -177.074 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . 0.417 ' O ' ' HG ' ' A' ' 21' ' ' LEU . 42.3 mt -68.45 -32.41 72.41 Favored 'General case' 0 N--CA 1.482 1.171 0 CA-C-O 119.129 -0.463 . . . . 70.129999999999995 112.091 -179.502 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 78.7 p -68.38 -43.64 76.9 Favored 'General case' 0 N--CA 1.481 1.115 0 CA-C-N 118.181 0.446 . . . . 65.299999999999997 110.129 176.299 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 6.8 tp-100 -63.58 -37.56 87.77 Favored 'General case' 0 C--N 1.355 0.839 0 O-C-N 123.858 0.724 . . . . 74.109999999999999 110.789 176.841 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 52.5 m -62.52 -53.49 54.02 Favored 'General case' 0 C--N 1.348 0.542 0 CA-C-N 115.85 -0.614 . . . . 72.129999999999995 110.075 176.364 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . 0.544 HD22 ' HA ' ' A' ' 33' ' ' LEU . 57.9 mt -58.0 -35.6 71.46 Favored 'General case' 0 N--CA 1.477 0.916 0 O-C-N 123.833 0.708 . . . . 71.319999999999993 111.224 -178.569 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . 0.64 HD23 ' HA ' ' A' ' 74' ' ' ASN . 53.5 tp -65.83 -57.25 8.39 Favored 'General case' 0 N--CA 1.475 0.817 0 O-C-N 123.364 0.415 . . . . 75.329999999999998 111.152 178.914 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . 0.457 ' O ' ' HG3' ' A' ' 27' ' ' ARG . 43.6 mt-10 -57.21 -50.76 71.85 Favored 'General case' 0 N--CA 1.481 1.076 0 O-C-N 123.628 0.58 . . . . 75.400000000000006 110.297 -179.366 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . 0.446 HD23 ' HD2' ' A' ' 27' ' ' ARG . 95.0 mt -61.11 -33.49 73.45 Favored 'General case' 0 N--CA 1.474 0.768 0 C-N-CA 124.469 1.107 . . . . 74.310000000000002 111.735 -178.747 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . 0.484 ' HB3' HD23 ' A' ' 33' ' ' LEU . . . -61.62 -48.52 80.54 Favored 'General case' 0 N--CA 1.477 0.882 0 CA-C-O 120.957 0.408 . . . . 72.030000000000001 110.378 173.869 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 81.3 mt-30 -67.62 -22.43 65.34 Favored 'General case' 0 CA--C 1.551 0.99 0 CA-C-N 115.156 -0.929 . . . . 72.340000000000003 111.607 178.848 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 27' ' ' ARG . . . . . 0.457 ' HG3' ' O ' ' A' ' 23' ' ' GLU . 73.3 mtt180 -85.72 -6.76 59.08 Favored 'General case' 0 N--CA 1.482 1.145 0 C-N-CA 124.062 0.945 . . . . 73.120000000000005 112.012 177.86 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 81.78 8.16 87.13 Favored Glycine 0 C--N 1.352 1.469 0 N-CA-C 113.612 0.205 . . . . 72.439999999999998 113.612 -178.397 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 36.8 mm-40 -82.26 60.98 5.26 Favored 'General case' 0 CA--C 1.545 0.757 0 C-N-CA 124.571 1.148 . . . . 72.340000000000003 111.404 179.912 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 30' ' ' TRP . . . . . 0.469 ' O ' ' HG ' ' A' ' 34' ' ' LEU . 45.9 m95 -65.99 -29.06 69.38 Favored 'General case' 0 N--CA 1.481 1.106 0 C-N-CA 122.992 0.517 . . . . 72.209999999999994 110.819 -177.154 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 -62.02 -46.96 86.9 Favored 'General case' 0 N--CA 1.475 0.791 0 C-N-CA 123.522 0.729 . . . . 73.120000000000005 109.771 177.295 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . 0.414 ' HB3' HD11 ' A' ' 24' ' ' LEU . 61.1 mt -62.14 -28.77 69.88 Favored 'General case' 0 N--CA 1.476 0.873 0 C-N-CA 123.068 0.547 . . . . 74.340000000000003 111.385 176.722 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . 0.544 ' HA ' HD22 ' A' ' 21' ' ' LEU . 10.7 mp -68.86 -42.03 77.61 Favored 'General case' 0 C--N 1.357 0.897 0 CA-C-O 119.047 -0.501 . . . . 74.400000000000006 110.742 171.769 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . 0.469 ' HG ' ' O ' ' A' ' 30' ' ' TRP . 83.8 mt -64.18 -43.54 94.79 Favored 'General case' 0 N--CA 1.487 1.387 0 C-N-CA 123.558 0.743 . . . . 71.409999999999997 111.565 -177.847 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 1.4 mp0 -65.43 -57.78 7.47 Favored 'General case' 0 N--CA 1.478 0.958 0 C-N-CA 123.137 0.575 . . . . 75.329999999999998 110.471 177.777 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 84.6 mm-40 -74.14 -11.31 60.27 Favored 'General case' 0 N--CA 1.479 0.99 0 C-N-CA 123.502 0.721 . . . . 74.430000000000007 112.723 -175.378 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 35.2 tt0 -53.65 -54.74 33.44 Favored 'General case' 0 N--CA 1.487 1.399 0 C-N-CA 123.876 0.87 . . . . 75.329999999999998 110.485 172.742 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 57.4 t -59.99 -47.94 89.77 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.514 0 O-C-N 124.248 0.968 . . . . 75.430000000000007 110.177 -179.344 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 16.3 m -55.6 -57.31 12.48 Favored 'General case' 0 CA--C 1.548 0.884 0 C-N-CA 124.037 0.935 . . . . 75.319999999999993 111.498 -179.265 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 28.5 t80 -63.87 -52.02 61.89 Favored 'General case' 0 CA--C 1.54 0.57 0 C-N-CA 124.97 1.308 . . . . 71.129999999999995 112.069 -173.73 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . 0.453 HD22 HD23 ' A' ' 92' ' ' LEU . 96.3 mt -72.22 -39.37 68.59 Favored 'General case' 0 N--CA 1.468 0.471 0 CA-C-N 115.969 -0.56 . . . . 72.209999999999994 111.659 -172.605 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 29.1 tt0 -60.0 -42.74 94.92 Favored 'General case' 0 CA--C 1.546 0.824 0 N-CA-C 109.68 -0.489 . . . . 73.109999999999999 109.68 173.866 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 43' ' ' SER . . . . . 0.422 ' O ' HG21 ' A' ' 47' ' ' VAL . 69.5 m -58.21 -54.84 42.48 Favored 'General case' 0 N--CA 1.483 1.189 0 C-N-CA 123.169 0.588 . . . . 73.120000000000005 112.151 176.892 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 44' ' ' ILE . . . . . 0.447 HG22 ' HA ' ' A' ' 41' ' ' LEU . 16.3 tt -62.83 -41.84 94.11 Favored 'Isoleucine or valine' 0 C--O 1.25 1.11 0 O-C-N 123.632 0.582 . . . . 73.299999999999997 111.146 -171.947 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . 0.49 ' O ' ' HG3' ' A' ' 49' ' ' GLU . 16.0 mm-40 -58.86 -51.02 71.82 Favored 'General case' 0 C--N 1.356 0.859 0 CA-C-N 115.801 -0.636 . . . . 72.430000000000007 110.166 174.812 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 46' ' ' THR . . . . . 0.503 ' O ' ' HD3' ' A' ' 50' ' ' LYS . 93.8 m -58.0 -36.31 72.48 Favored 'General case' 0 CA--C 1.55 0.976 0 O-C-N 124.319 1.012 . . . . 72.439999999999998 112.403 -178.115 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 47' ' ' VAL . . . . . 0.422 HG21 ' O ' ' A' ' 43' ' ' SER . 87.7 t -68.0 -45.42 83.69 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.063 0 C-N-CA 122.58 0.352 . . . . 64.349999999999994 110.167 177.721 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 48' ' ' MET . . . . . 0.584 ' HE1' ' NH2' ' A' ' 98' ' ' ARG . 65.8 mtm -76.0 -14.41 60.23 Favored 'General case' 0 N--CA 1.486 1.358 0 N-CA-C 112.989 0.737 . . . . 73.219999999999999 112.989 -177.799 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . 0.49 ' HG3' ' O ' ' A' ' 45' ' ' GLU . 69.0 mt-10 -70.53 -35.51 73.21 Favored 'General case' 0 N--CA 1.484 1.259 0 CA-C-O 120.839 0.352 . . . . 72.450000000000003 111.063 172.988 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . 0.503 ' HD3' ' O ' ' A' ' 46' ' ' THR . 13.4 mptt -90.21 166.84 13.13 Favored 'General case' 0 N--CA 1.477 0.915 0 C-N-CA 123.8 0.84 . . . . 63.240000000000002 110.65 -173.801 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 20.4 pt20 -71.92 146.78 47.59 Favored 'General case' 0 C--O 1.243 0.756 0 CA-C-N 115.431 -0.804 . . . . 72.230000000000004 110.635 -179.613 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 52' ' ' THR . . . . . 0.479 HG22 HD11 ' A' ' 56' ' ' ILE . 39.5 m -83.98 122.81 76.13 Favored Pre-proline 0 CA--C 1.546 0.807 0 N-CA-C 108.559 -0.904 . . . . 72.519999999999996 108.559 171.477 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 22.9 Cg_endo -57.38 157.06 23.32 Favored 'Trans proline' 0 C--N 1.379 2.149 0 C-N-CA 123.02 2.48 . . . . 73.430000000000007 113.411 -177.104 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 20.5 Cg_exo -68.22 -48.13 1.38 Allowed 'Trans proline' 0 C--N 1.371 1.755 0 C-N-CA 122.647 2.231 . . . . 71.120000000000005 112.354 174.394 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . -74.71 76.64 1.15 Allowed Glycine 0 C--N 1.351 1.378 0 CA-C-N 115.701 -0.681 . . . . 63.409999999999997 113.549 -175.97 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 56' ' ' ILE . . . . . 0.65 ' O ' ' HB ' ' A' ' 60' ' ' ILE . 26.6 mt -106.15 -14.14 9.26 Favored 'Isoleucine or valine' 0 C--O 1.202 -1.444 0 C-N-CA 123.583 0.753 . . . . 73.510000000000005 110.453 -179.989 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 73.6 p 38.82 -178.18 0.0 OUTLIER 'General case' 0 N--CA 1.506 2.338 0 N-CA-C 114.931 1.456 . . . . 73.129999999999995 114.931 -173.734 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 13.8 tpt85 -73.95 -37.04 64.67 Favored 'General case' 0 N--CA 1.476 0.854 0 O-C-N 120.482 -1.386 . . . . 74.5 108.378 171.194 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 33.4 m -62.51 -55.46 27.28 Favored 'General case' 0 C--O 1.246 0.875 0 C-N-CA 124.282 1.033 . . . . 73.099999999999994 111.93 -178.211 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 60' ' ' ILE . . . . . 0.65 ' HB ' ' O ' ' A' ' 56' ' ' ILE . 66.9 mt -75.03 -27.57 20.07 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.916 0 N-CA-C 109.046 -0.724 . . . . 75.230000000000004 109.046 -176.928 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 60.9 tt0 -57.23 -45.63 83.72 Favored 'General case' 0 C--N 1.376 1.732 0 CA-C-N 118.31 0.505 . . . . 73.040000000000006 110.862 171.915 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 65.9 m-20 -66.65 -41.78 87.7 Favored 'General case' 0 N--CA 1.472 0.666 0 O-C-N 123.591 0.557 . . . . 74.099999999999994 111.325 178.686 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 63' ' ' MET . . . . . . . . . . . . . 63.5 mtm -63.61 -54.78 30.53 Favored 'General case' 0 N--CA 1.486 1.343 0 O-C-N 123.318 0.386 . . . . 73.409999999999997 111.775 -179.455 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 64' ' ' VAL . . . . . 0.423 ' O ' HG13 ' A' ' 68' ' ' ILE . 73.5 t -59.04 -52.39 61.25 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.841 0 C-N-CA 123.719 0.808 . . . . 71.219999999999999 111.38 176.673 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -64.46 -26.87 68.63 Favored 'General case' 0 N--CA 1.487 1.406 0 C-N-CA 122.534 0.333 . . . . 65.200000000000003 111.47 -179.836 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 66' ' ' GLY . . . . . 0.407 ' O ' ' HG3' ' A' ' 70' ' ' GLN . . . -68.1 -40.55 88.22 Favored Glycine 0 C--N 1.342 0.915 0 N-CA-C 111.296 -0.722 . . . . 73.400000000000006 111.296 174.357 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 67' ' ' TYR . . . . . 0.479 ' O ' HG22 ' A' ' 71' ' ' THR . 19.0 m-30 -67.06 -41.05 87.13 Favored 'General case' 0 N--CA 1.468 0.453 0 C-N-CA 123.533 0.733 . . . . 74.540000000000006 110.914 175.425 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 68' ' ' ILE . . . . . 0.566 ' O ' ' HG ' ' A' ' 72' ' ' LEU . 48.5 mt -61.09 -40.89 87.26 Favored 'Isoleucine or valine' 0 C--N 1.358 0.939 0 O-C-N 123.904 0.752 . . . . 65.420000000000002 109.001 174.665 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 69' ' ' LYS . . . . . 0.539 ' HE2' ' HA ' ' A' ' 69' ' ' LYS . 0.6 OUTLIER -58.72 -42.94 89.91 Favored 'General case' 0 N--CA 1.474 0.758 0 C-N-CA 123.305 0.642 . . . . 74.329999999999998 110.128 179.738 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 70' ' ' GLN . . . . . 0.407 ' HG3' ' O ' ' A' ' 66' ' ' GLY . 75.7 mt-30 -58.91 -45.92 89.18 Favored 'General case' 0 N--CA 1.476 0.84 0 O-C-N 124.176 0.922 . . . . 74.420000000000002 111.082 175.01 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 71' ' ' THR . . . . . 0.479 HG22 ' O ' ' A' ' 67' ' ' TYR . 10.0 p -60.59 -39.29 87.55 Favored 'General case' 0 N--CA 1.486 1.367 0 CA-C-O 120.862 0.363 . . . . 75.439999999999998 110.291 -178.63 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 72' ' ' LEU . . . . . 0.566 ' HG ' ' O ' ' A' ' 68' ' ' ILE . 52.7 mt -64.33 -54.59 30.7 Favored 'General case' 0 C--N 1.355 0.828 0 CA-C-N 115.144 -0.935 . . . . 74.430000000000007 109.812 -178.128 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 15.8 m-20 -58.7 -59.37 5.51 Favored 'General case' 0 N--CA 1.487 1.414 0 O-C-N 123.558 0.536 . . . . 74.140000000000001 111.243 178.542 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 74' ' ' ASN . . . . . 0.64 ' HA ' HD23 ' A' ' 22' ' ' LEU . 87.0 m-20 -56.71 -57.88 10.51 Favored 'General case' 0 N--CA 1.479 1.02 0 C-N-CA 124.471 1.108 . . . . 64.310000000000002 112.019 -173.59 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . 0.51 ' O ' ' HG2' ' A' ' 79' ' ' LYS . 61.8 tt0 -73.02 -29.25 62.87 Favored 'General case' 0 CA--C 1.545 0.78 0 CA-C-O 118.696 -0.668 . . . . 74.439999999999998 111.129 -172.694 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 7.0 tt0 -66.97 -38.43 86.07 Favored 'General case' 0 N--CA 1.491 1.578 0 CA-C-N 118.444 0.566 . . . . 70.439999999999998 110.763 173.536 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 92.6 mt -66.19 -30.56 71.05 Favored 'General case' 0 N--CA 1.471 0.583 0 N-CA-C 109.993 -0.373 . . . . 75.200000000000003 109.993 175.571 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . 0.592 HD21 ' HA ' ' A' ' 22' ' ' LEU . 85.3 mt -71.98 -35.01 69.37 Favored 'General case' 0 N--CA 1.479 1.019 0 C-N-CA 123.111 0.564 . . . . 75.409999999999997 111.912 170.437 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 79' ' ' LYS . . . . . 0.51 ' HG2' ' O ' ' A' ' 75' ' ' GLU . 35.5 mmtm -60.7 -43.92 97.17 Favored 'General case' 0 N--CA 1.485 1.28 0 N-CA-C 109.19 -0.67 . . . . 74.430000000000007 109.19 174.997 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -75.23 -33.44 53.88 Favored Glycine 0 C--N 1.346 1.117 0 CA-C-N 114.674 -1.148 . . . . 52.329999999999998 113.643 -179.431 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 5.4 tt -73.24 -60.13 2.39 Favored 'General case' 0 N--CA 1.477 0.91 0 C-N-CA 123.367 0.667 . . . . 74.230000000000004 109.407 -178.247 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 74.3 mt . . . . . 0 CA--C 1.544 0.738 0 CA-C-N 114.909 -1.041 . . . . 73.319999999999993 112.113 -171.018 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 92' ' ' LEU . . . . . 0.478 HD22 HH12 ' A' ' 98' ' ' ARG . 33.0 mt . . . . . 0 N--CA 1.486 1.348 0 N-CA-C 109.222 -0.658 . . . . 73.109999999999999 109.222 . . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 36.7 mt -68.71 145.52 13.38 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.943 0 C-N-CA 123.729 0.812 . . . . 72.219999999999999 109.617 176.473 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -64.64 138.63 40.41 Favored Glycine 0 C--N 1.348 1.2 0 O-C-N 123.551 0.532 . . . . 53.140000000000001 113.996 -175.881 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 6.9 tt0 61.56 88.19 0.09 Allowed 'General case' 0 CA--C 1.554 1.12 0 C-N-CA 125.127 1.371 . . . . 64.099999999999994 113.103 173.007 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 45.2 m 47.03 68.01 0.7 Allowed 'General case' 0 N--CA 1.486 1.337 0 C-N-CA 125.017 1.327 . . . . 71.340000000000003 114.114 163.922 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 12.0 t -96.48 -34.22 11.57 Favored 'General case' 0 N--CA 1.474 0.753 0 C-N-CA 122.49 0.316 . . . . 71.530000000000001 111.399 -177.25 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 98' ' ' ARG . . . . . 0.584 ' NH2' ' HE1' ' A' ' 48' ' ' MET . 0.2 OUTLIER -62.61 -51.16 68.4 Favored 'General case' 0 C--N 1.353 0.752 0 O-C-N 123.584 0.552 . . . . 75.010000000000005 112.488 -161.486 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 22.7 tp60 -55.66 -55.58 30.53 Favored 'General case' 0 CA--C 1.545 0.765 0 O-C-N 124.159 0.912 . . . . 75.420000000000002 111.157 -176.519 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 24.1 tptp -70.88 -51.84 23.82 Favored 'General case' 0 CA--C 1.54 0.58 0 CA-C-N 115.585 -0.734 . . . . 71.319999999999993 111.153 -171.573 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 40.6 t -69.05 -38.36 79.08 Favored 'General case' 0 N--CA 1.474 0.748 0 C-N-CA 123.698 0.799 . . . . 73.219999999999999 112.353 -173.236 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 13.9 tp -83.5 -33.63 25.5 Favored 'General case' 0 N--CA 1.476 0.86 0 C-N-CA 122.485 0.314 . . . . 64.239999999999995 110.866 -174.405 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 27.9 t-20 -69.09 -34.23 74.79 Favored 'General case' 0 N--CA 1.482 1.158 0 N-CA-C 110.109 -0.33 . . . . 72.5 110.109 171.723 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 104' ' ' ASN . . . . . 0.445 ' O ' ' HG2' ' A' ' 108' ' ' ARG . 27.4 t-20 -60.88 -46.19 91.6 Favored 'General case' 0 N--CA 1.478 0.957 0 C-N-CA 123.16 0.584 . . . . 75.150000000000006 109.479 171.671 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -57.09 -42.79 81.38 Favored 'General case' 0 N--CA 1.477 0.887 0 O-C-N 124.018 0.824 . . . . 51.219999999999999 111.24 178.841 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 106' ' ' TYR . . . . . . . . . . . . . 9.1 t80 -58.47 -51.56 69.34 Favored 'General case' 0 CA--C 1.547 0.848 0 O-C-N 123.737 0.648 . . . . 74.340000000000003 110.276 175.384 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -65.79 -38.59 94.54 Favored Glycine 0 C--N 1.353 1.521 0 O-C-N 123.909 0.755 . . . . 72.099999999999994 113.232 -174.568 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 108' ' ' ARG . . . . . 0.445 ' HG2' ' O ' ' A' ' 104' ' ' ASN . 21.3 mmt180 -70.2 -35.62 74.03 Favored 'General case' 0 C--N 1.348 0.526 0 C-N-CA 122.998 0.519 . . . . 74.040000000000006 109.62 179.248 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 109' ' ' LEU . . . . . 0.449 ' HA ' ' N ' ' A' ' 114' ' ' LEU . 53.2 tp -63.81 -52.69 59.07 Favored 'General case' 0 N--CA 1.48 1.058 0 C-N-CA 122.803 0.441 . . . . 74.420000000000002 110.216 175.782 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 16.2 t -62.91 -37.44 86.97 Favored 'General case' 0 CA--C 1.54 0.581 0 O-C-N 125.109 1.506 . . . . 71.239999999999995 111.03 -172.677 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . -91.05 -62.08 1.24 Allowed Glycine 0 C--N 1.35 1.326 0 CA-C-O 119.919 -0.378 . . . . 75.230000000000004 113.869 178.252 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 112' ' ' MET . . . . . . . . . . . . . 7.3 tpt -93.18 -65.81 0.97 Allowed 'General case' 0 N--CA 1.487 1.425 0 N-CA-C 113.167 0.802 . . . . 73.420000000000002 113.167 -168.213 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 14.4 tp 168.08 16.75 0.0 OUTLIER 'General case' 0 N--CA 1.504 2.271 0 C-N-CA 124.336 1.055 . . . . 74.010000000000005 110.917 -173.911 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 114' ' ' LEU . . . . . 0.449 ' N ' ' HA ' ' A' ' 109' ' ' LEU . 0.7 OUTLIER . . . . . 0 N--CA 1.502 2.13 0 C-N-CA 125.158 1.383 . . . . 71.209999999999994 110.098 -171.633 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 23.4 ttt . . . . . 0 N--CA 1.48 1.027 0 CA-C-O 119.773 -0.156 . . . . 71.109999999999999 111.083 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 87.1 m -52.0 -49.16 63.85 Favored 'General case' 0 N--CA 1.484 1.228 0 C-N-CA 123.387 0.675 . . . . 73.310000000000002 111.865 -178.08 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 22.9 m -63.08 -35.37 80.04 Favored 'General case' 0 N--CA 1.471 0.596 0 C-N-CA 123.708 0.803 . . . . 55.520000000000003 111.479 -178.901 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 4' ' ' THR . . . . . 0.539 HG21 HD12 ' A' ' 60' ' ' ILE . 5.0 m -68.42 -47.9 66.06 Favored 'General case' 0 CA--C 1.544 0.732 0 C-N-CA 123.461 0.704 . . . . 71.150000000000006 110.875 179.37 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 76.5 t -65.23 -39.51 85.66 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.979 0 C-N-CA 123.595 0.758 . . . . 71.519999999999996 110.484 -178.2 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 39.0 mm-40 -59.73 -49.23 78.53 Favored 'General case' 0 C--N 1.35 0.615 0 C-N-CA 123.291 0.636 . . . . 72.540000000000006 110.218 172.479 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 29.3 t80 -59.35 -45.78 90.45 Favored 'General case' 0 CA--C 1.551 1.0 0 C-N-CA 124.296 1.038 . . . . 74.340000000000003 110.873 -176.188 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 8' ' ' ILE . . . . . 0.456 HD13 HG21 ' A' ' 60' ' ' ILE . 77.7 mt -66.8 -42.95 90.0 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.914 0 C-N-CA 123.943 0.897 . . . . 74.109999999999999 110.693 179.635 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 28.5 t-20 -66.64 -34.18 77.31 Favored 'General case' 0 N--CA 1.485 1.32 0 C-N-CA 123.531 0.732 . . . . 75.540000000000006 111.355 -178.16 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 75.9 mtt180 -68.57 -41.42 79.72 Favored 'General case' 0 CA--C 1.537 0.469 0 CA-C-N 115.601 -0.727 . . . . 74.430000000000007 109.383 174.521 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 11' ' ' TRP . . . . . 0.48 ' HH2' ' HG ' ' A' ' 102' ' ' LEU . 42.5 m95 -65.66 -29.26 69.8 Favored 'General case' 0 N--CA 1.477 0.884 0 O-C-N 123.458 0.474 . . . . 73.25 111.632 173.905 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 50.1 mt-30 -61.91 -50.08 73.61 Favored 'General case' 0 C--N 1.359 0.987 0 N-CA-C 108.568 -0.901 . . . . 73.219999999999999 108.568 172.506 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 14.6 tpt180 -57.67 -49.25 77.12 Favored 'General case' 0 CA--C 1.545 0.785 0 O-C-N 124.103 0.877 . . . . 74.319999999999993 111.411 -179.078 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 65.6 mt -63.59 -48.34 87.28 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.359 0 C-N-CA 123.427 0.691 . . . . 72.510000000000005 111.051 -177.897 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . 0.437 ' HB2' ' OE1' ' A' ' 70' ' ' GLN . . . -60.72 -47.79 84.69 Favored 'General case' 0 N--CA 1.478 0.934 0 C-N-CA 124.296 1.038 . . . . 72.129999999999995 111.412 -177.813 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 96.3 mt -74.69 -34.13 62.59 Favored 'General case' 0 N--CA 1.481 1.11 0 CA-C-N 114.756 -1.111 . . . . 75.0 111.452 -176.531 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . 0.48 ' O ' ' HG ' ' A' ' 21' ' ' LEU . 18.6 mt -63.95 -54.97 26.27 Favored 'General case' 0 C--N 1.36 1.058 0 N-CA-C 109.41 -0.589 . . . . 65.219999999999999 109.41 175.745 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 79.6 p -59.63 -35.38 74.28 Favored 'General case' 0 CA--C 1.544 0.749 0 O-C-N 123.894 0.746 . . . . 73.099999999999994 111.276 -178.568 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 6.2 tp-100 -62.29 -49.16 76.76 Favored 'General case' 0 N--CA 1.478 0.932 0 C-N-CA 123.503 0.721 . . . . 74.400000000000006 110.907 174.673 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 57.1 m -60.58 -43.21 97.57 Favored 'General case' 0 N--CA 1.472 0.665 0 C-N-CA 123.33 0.652 . . . . 54.009999999999998 110.444 177.023 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . 0.678 HD23 ' HA ' ' A' ' 33' ' ' LEU . 77.2 mt -68.75 -28.81 67.14 Favored 'General case' 0 C--N 1.346 0.415 0 C-N-CA 123.959 0.904 . . . . 74.450000000000003 110.288 -177.015 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . 0.581 ' HA ' HD23 ' A' ' 78' ' ' LEU . 35.8 tp -68.65 -51.26 43.9 Favored 'General case' 0 C--N 1.354 0.779 0 O-C-N 123.859 0.725 . . . . 62.520000000000003 109.652 175.928 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 76.2 mm-40 -51.87 -54.61 27.21 Favored 'General case' 0 N--CA 1.478 0.94 0 O-C-N 124.091 0.869 . . . . 74.219999999999999 110.526 175.799 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . 0.542 ' HB3' ' HB2' ' A' ' 29' ' ' GLU . 95.5 mt -64.2 -37.27 86.87 Favored 'General case' 0 CA--C 1.545 0.768 0 CA-C-N 114.505 -1.225 . . . . 74.219999999999999 111.46 -174.196 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . 0.557 ' HB3' HD23 ' A' ' 33' ' ' LEU . . . -66.7 -38.12 86.09 Favored 'General case' 0 N--CA 1.489 1.511 0 C-N-CA 122.837 0.455 . . . . 71.299999999999997 111.378 177.73 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 87.1 mt-30 -67.01 -26.76 66.95 Favored 'General case' 0 N--CA 1.478 0.96 0 C-N-CA 123.84 0.856 . . . . 71.329999999999998 110.833 175.481 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 59.2 mtt180 -88.51 -15.19 35.89 Favored 'General case' 0 N--CA 1.481 1.091 0 C-N-CA 124.025 0.93 . . . . 74.319999999999993 111.874 175.086 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 81.44 35.77 22.15 Favored Glycine 0 C--N 1.352 1.443 0 C-N-CA 123.01 0.338 . . . . 60.43 113.285 178.999 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 29' ' ' GLU . . . . . 0.542 ' HB2' ' HB3' ' A' ' 24' ' ' LEU . 13.6 mm-40 -97.83 59.89 1.48 Allowed 'General case' 0 CA--C 1.545 0.774 0 C-N-CA 124.806 1.243 . . . . 74.239999999999995 109.527 -177.551 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 30' ' ' TRP . . . . . . . . . . . . . 61.3 m95 -53.58 -38.71 64.17 Favored 'General case' 0 N--CA 1.485 1.319 0 C-N-CA 124.245 1.018 . . . . 71.519999999999996 112.028 -174.421 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 31' ' ' ASP . . . . . 0.427 ' O ' ' HG3' ' A' ' 35' ' ' GLN . 4.2 m-20 -58.0 -50.15 74.39 Favored 'General case' 0 N--CA 1.483 1.186 0 C-N-CA 123.743 0.817 . . . . 72.299999999999997 110.652 -179.272 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 95.7 mt -62.89 -31.52 72.58 Favored 'General case' 0 N--CA 1.479 0.993 0 C-N-CA 123.93 0.892 . . . . 74.230000000000004 111.755 -176.778 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . 0.678 ' HA ' HD23 ' A' ' 21' ' ' LEU . 11.2 mp -66.26 -45.78 79.35 Favored 'General case' 0 N--CA 1.478 0.956 0 C-N-CA 123.045 0.538 . . . . 75.329999999999998 110.54 173.131 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 81.1 mt -69.31 -24.77 63.98 Favored 'General case' 0 CA--C 1.548 0.897 0 CA-C-N 115.84 -0.618 . . . . 75.530000000000001 111.712 179.43 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 35' ' ' GLN . . . . . 0.427 ' HG3' ' O ' ' A' ' 31' ' ' ASP . 95.1 mt-30 -77.84 -32.42 52.13 Favored 'General case' 0 N--CA 1.474 0.752 0 C-N-CA 122.822 0.449 . . . . 74.329999999999998 111.24 178.067 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 36' ' ' GLN . . . . . 0.555 ' HB2' HD21 ' A' ' 21' ' ' LEU . 87.0 mm-40 -90.67 -14.63 31.89 Favored 'General case' 0 N--CA 1.483 1.183 0 C-N-CA 123.101 0.56 . . . . 74.510000000000005 112.37 174.746 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 42.2 tt0 -47.83 -56.37 7.62 Favored 'General case' 0 N--CA 1.488 1.462 0 C-N-CA 124.104 0.962 . . . . 71.400000000000006 112.871 -176.998 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 91.9 t -60.88 -43.9 96.65 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.869 0 C-N-CA 123.057 0.543 . . . . 74.450000000000003 111.684 -175.3 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 44.7 p -68.47 -34.75 76.49 Favored 'General case' 0 N--CA 1.473 0.723 0 C-N-CA 122.903 0.481 . . . . 65.450000000000003 111.148 -178.725 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 66.2 t80 -69.02 -51.74 35.93 Favored 'General case' 0 CA--C 1.541 0.61 0 C-N-CA 123.707 0.803 . . . . 75.200000000000003 110.027 -179.478 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 72.7 mt -63.73 -43.46 96.45 Favored 'General case' 0 N--CA 1.473 0.71 0 O-C-N 124.254 0.972 . . . . 71.209999999999994 110.834 -179.284 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 53.3 tt0 -67.57 -45.81 74.52 Favored 'General case' 0 N--CA 1.476 0.837 0 C-N-CA 123.027 0.531 . . . . 75.010000000000005 111.102 -176.903 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 43' ' ' SER . . . . . 0.48 ' O ' HG21 ' A' ' 47' ' ' VAL . 68.7 m -65.74 -42.43 90.98 Favored 'General case' 0 N--CA 1.474 0.757 0 O-C-N 123.312 0.383 . . . . 61.439999999999998 111.457 -178.941 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 15.7 tt -69.45 -35.74 68.25 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.019 0 O-C-N 123.077 0.235 . . . . 75.109999999999999 110.704 -178.147 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 9.6 mm-40 -59.12 -44.91 92.03 Favored 'General case' 0 C--N 1.359 1.019 0 C-N-CA 123.428 0.691 . . . . 73.5 110.527 171.726 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 90.0 m -58.61 -45.3 89.47 Favored 'General case' 0 CA--C 1.544 0.738 0 O-C-N 124.277 0.986 . . . . 74.129999999999995 111.261 178.604 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 47' ' ' VAL . . . . . 0.48 HG21 ' O ' ' A' ' 43' ' ' SER . 57.8 t -64.04 -47.85 88.53 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.172 0 C-N-CA 123.108 0.563 . . . . 73.019999999999996 111.443 -178.468 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 48' ' ' MET . . . . . 0.484 ' HE2' HD13 ' A' ' 92' ' ' LEU . 73.6 mtm -73.51 -24.02 60.1 Favored 'General case' 0 N--CA 1.48 1.034 0 CA-C-N 115.95 -0.568 . . . . 73.230000000000004 111.642 -177.397 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 9.8 tp10 -82.16 -35.33 28.52 Favored 'General case' 0 N--CA 1.475 0.777 0 C-N-CA 122.847 0.459 . . . . 72.510000000000005 110.396 178.169 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 12.3 mptt -84.62 151.46 24.48 Favored 'General case' 0 N--CA 1.479 0.991 0 C-N-CA 123.475 0.71 . . . . 72.239999999999995 110.874 -176.971 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 8.7 tt0 -76.23 132.9 40.18 Favored 'General case' 0 CA--C 1.543 0.707 0 CA-C-N 114.76 -1.109 . . . . 65.439999999999998 110.921 -175.131 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 24.1 m -74.46 125.65 89.58 Favored Pre-proline 0 CA--C 1.551 0.989 0 C-N-CA 123.712 0.805 . . . . 72.420000000000002 109.079 170.314 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 73.7 Cg_endo -72.45 152.05 54.19 Favored 'Trans proline' 0 C--N 1.373 1.864 0 C-N-CA 122.075 1.85 . . . . 75.129999999999995 112.777 -178.903 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 52.8 Cg_exo -58.72 -44.94 32.43 Favored 'Trans proline' 0 C--N 1.378 2.099 0 C-N-CA 123.716 2.944 . . . . 74.209999999999994 113.583 176.427 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . -63.83 80.38 0.05 OUTLIER Glycine 0 C--N 1.351 1.409 0 O-C-N 124.342 1.027 . . . . 61.299999999999997 114.117 -176.849 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 72.5 mt -130.49 111.61 21.08 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.673 0 C-N-CA 124.804 1.242 . . . . 72.510000000000005 108.752 178.522 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 57' ' ' THR . . . . . 0.426 ' H ' HD13 ' A' ' 60' ' ' ILE . 74.2 p -80.23 175.14 10.91 Favored 'General case' 0 N--CA 1.471 0.577 0 C-N-CA 123.47 0.708 . . . . 75.209999999999994 109.454 172.544 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 26.3 tpt180 -63.94 -38.96 93.01 Favored 'General case' 0 CA--C 1.541 0.622 0 CA-C-O 119.428 -0.32 . . . . 72.530000000000001 110.398 177.538 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 21.9 m -59.41 -47.39 85.62 Favored 'General case' 0 CA--C 1.548 0.889 0 C-N-CA 122.987 0.515 . . . . 71.219999999999999 110.854 178.252 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 60' ' ' ILE . . . . . 0.539 HD12 HG21 ' A' ' 4' ' ' THR . 93.5 mt -61.09 -42.17 92.18 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.149 0 C-N-CA 123.623 0.769 . . . . 63.409999999999997 110.372 176.159 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 64.4 tt0 -62.54 -38.7 91.01 Favored 'General case' 0 CA--C 1.547 0.837 0 C-N-CA 124.024 0.929 . . . . 73.430000000000007 111.092 -179.171 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 63.9 m-20 -67.68 -43.52 80.0 Favored 'General case' 0 N--CA 1.48 1.028 0 C-N-CA 123.433 0.693 . . . . 73.140000000000001 110.79 177.686 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 63' ' ' MET . . . . . . . . . . . . . 72.3 mtm -64.46 -52.39 58.23 Favored 'General case' 0 N--CA 1.48 1.054 0 O-C-N 123.72 0.638 . . . . 73.209999999999994 111.447 -178.356 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 64' ' ' VAL . . . . . 0.461 ' O ' HG13 ' A' ' 68' ' ' ILE . 92.4 t -60.71 -50.42 80.53 Favored 'Isoleucine or valine' 0 C--N 1.353 0.739 0 C-N-CA 123.71 0.804 . . . . 74.439999999999998 110.372 -179.747 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -61.91 -36.5 81.52 Favored 'General case' 0 N--CA 1.484 1.231 0 O-C-N 123.432 0.457 . . . . 72.310000000000002 111.327 179.78 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -64.25 -38.81 96.41 Favored Glycine 0 C--N 1.345 1.038 0 O-C-N 123.73 0.644 . . . . 54.439999999999998 112.402 178.41 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 67' ' ' TYR . . . . . 0.512 ' O ' HG21 ' A' ' 71' ' ' THR . 17.9 m-30 -72.58 -42.32 64.71 Favored 'General case' 0 N--CA 1.471 0.577 0 C-N-CA 123.277 0.631 . . . . 74.349999999999994 111.452 179.371 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 68' ' ' ILE . . . . . 0.51 ' O ' ' HG ' ' A' ' 72' ' ' LEU . 68.0 mt -56.49 -52.22 55.52 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.112 0 N-CA-C 108.652 -0.87 . . . . 75.510000000000005 108.652 175.207 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 69' ' ' LYS . . . . . 0.561 ' HB2' ' HE2' ' A' ' 106' ' ' TYR . 13.5 tmtt? -53.35 -45.8 69.3 Favored 'General case' 0 N--CA 1.476 0.842 0 C-N-CA 125.25 1.42 . . . . 75.140000000000001 110.345 179.125 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 70' ' ' GLN . . . . . 0.437 ' OE1' ' HB2' ' A' ' 15' ' ' ALA . 61.4 tt0 -61.39 -49.1 78.25 Favored 'General case' 0 C--N 1.349 0.557 0 CA-C-N 115.428 -0.806 . . . . 75.319999999999993 111.328 -176.158 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 71' ' ' THR . . . . . 0.512 HG21 ' O ' ' A' ' 67' ' ' TYR . 1.0 OUTLIER -73.18 -23.59 60.44 Favored 'General case' 0 N--CA 1.474 0.736 0 CA-C-O 119.469 -0.3 . . . . 64.150000000000006 110.874 -178.871 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 72' ' ' LEU . . . . . 0.51 ' HG ' ' O ' ' A' ' 68' ' ' ILE . 37.4 mt -61.21 -55.61 30.2 Favored 'General case' 0 C--N 1.363 1.16 0 N-CA-C 108.878 -0.786 . . . . 73.219999999999999 108.878 173.175 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 73' ' ' ASP . . . . . 0.414 ' O ' ' HG ' ' A' ' 77' ' ' LEU . 4.5 m-20 -55.09 -61.89 2.02 Favored 'General case' 0 N--CA 1.482 1.133 0 O-C-N 124.505 1.128 . . . . 75.319999999999993 111.001 177.373 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 74' ' ' ASN . . . . . 0.533 ' HA ' HD22 ' A' ' 22' ' ' LEU . 83.0 m-20 -53.5 -54.7 33.41 Favored 'General case' 0 N--CA 1.478 0.933 0 O-C-N 124.506 1.129 . . . . 74.510000000000005 112.294 -172.292 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . 0.419 ' HG2' ' HZ2' ' A' ' 79' ' ' LYS . 5.4 tt0 -73.03 -32.77 65.31 Favored 'General case' 0 CA--C 1.547 0.832 0 O-C-N 123.211 0.32 . . . . 72.430000000000007 111.516 -174.634 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 9.0 tt0 -64.9 -37.15 86.69 Favored 'General case' 0 N--CA 1.484 1.266 0 CA-C-O 120.764 0.316 . . . . 73.329999999999998 110.197 175.43 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . 0.414 ' HG ' ' O ' ' A' ' 73' ' ' ASP . 96.8 mt -68.72 -34.92 76.45 Favored 'General case' 0 CA--C 1.539 0.539 0 CA-C-N 116.057 -0.52 . . . . 72.230000000000004 110.198 176.142 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . 0.581 HD23 ' HA ' ' A' ' 22' ' ' LEU . 57.3 mt -61.04 -39.88 91.47 Favored 'General case' 0 N--CA 1.483 1.193 0 C-N-CA 122.89 0.476 . . . . 74.349999999999994 111.03 171.675 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 79' ' ' LYS . . . . . 0.419 ' HZ2' ' HG2' ' A' ' 75' ' ' GLU . 48.8 mmtm -65.01 -45.57 84.97 Favored 'General case' 0 C--O 1.22 -0.449 0 CA-C-N 116.416 -0.356 . . . . 74.019999999999996 110.334 178.224 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -71.32 -25.24 75.83 Favored Glycine 0 CA--C 1.531 1.081 0 O-C-N 124.104 0.877 . . . . 74.150000000000006 113.851 -179.294 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 6.4 tt -86.05 -64.26 1.18 Allowed 'General case' 0 N--CA 1.48 1.052 0 C-N-CA 123.312 0.645 . . . . 73.219999999999999 109.613 -178.002 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 25.6 mt . . . . . 0 N--CA 1.479 1.008 0 C-N-CA 123.914 0.885 . . . . 73.340000000000003 112.167 -168.511 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 92' ' ' LEU . . . . . 0.484 HD13 ' HE2' ' A' ' 48' ' ' MET . 75.7 mt . . . . . 0 CA--C 1.54 0.582 0 CA-C-O 120.792 0.33 . . . . 72.5 110.852 . . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 62.6 mt -90.05 -40.01 12.57 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.69 0 N-CA-C 108.259 -1.015 . . . . 74.319999999999993 108.259 174.161 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 178.92 -56.67 0.09 OUTLIER Glycine 0 C--N 1.345 1.032 0 CA-C-N 114.446 -1.252 . . . . 75.329999999999998 110.176 177.037 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 13.8 pt20 -81.27 175.32 10.7 Favored 'General case' 0 C--O 1.244 0.784 0 C-N-CA 123.626 0.77 . . . . 73.120000000000005 110.764 176.811 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 35.0 p -83.99 51.67 2.11 Favored 'General case' 0 CA--C 1.552 1.042 0 C-N-CA 124.369 1.067 . . . . 73.420000000000002 110.666 177.937 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 15.2 t -67.56 -9.76 45.62 Favored 'General case' 0 N--CA 1.479 1.01 0 C-N-CA 124.189 0.996 . . . . 70.549999999999997 112.837 -174.325 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 98' ' ' ARG . . . . . 0.587 HH11 HD23 ' A' ' 102' ' ' LEU . 2.0 tmm_? -51.28 -50.34 59.47 Favored 'General case' 0 N--CA 1.479 1.003 0 C-N-CA 125.265 1.426 . . . . 74.409999999999997 111.506 -176.439 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 24.7 tm0? -57.26 -53.3 59.71 Favored 'General case' 0 N--CA 1.474 0.752 0 C-N-CA 124.025 0.93 . . . . 74.430000000000007 110.053 -176.887 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 61.5 tttp -65.02 -49.16 71.25 Favored 'General case' 0 C--O 1.218 -0.567 0 O-C-N 124.016 0.823 . . . . 74.299999999999997 111.425 -176.589 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 51.1 m -60.27 -43.98 95.72 Favored 'General case' 0 CA--C 1.542 0.649 0 C-N-CA 123.587 0.755 . . . . 72.329999999999998 111.584 -173.877 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 102' ' ' LEU . . . . . 0.587 HD23 HH11 ' A' ' 98' ' ' ARG . 10.8 mp -78.45 -35.64 46.48 Favored 'General case' 0 N--CA 1.48 1.026 0 N-CA-C 112.306 0.484 . . . . 71.209999999999994 112.306 -179.08 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 26.9 t-20 -69.41 -37.84 77.65 Favored 'General case' 0 N--CA 1.484 1.254 0 CA-C-O 121.035 0.445 . . . . 63.450000000000003 110.392 179.727 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -73.72 -36.51 65.21 Favored 'General case' 0 N--CA 1.47 0.561 0 CA-C-N 115.615 -0.721 . . . . 74.239999999999995 109.164 176.768 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -61.56 -36.76 81.53 Favored 'General case' 0 C--N 1.358 0.937 0 O-C-N 123.605 0.566 . . . . 73.530000000000001 110.892 173.715 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 106' ' ' TYR . . . . . 0.561 ' HE2' ' HB2' ' A' ' 69' ' ' LYS . 2.3 t80 -67.45 -42.03 83.75 Favored 'General case' 0 CA--C 1.541 0.614 0 N-CA-C 108.964 -0.754 . . . . 73.420000000000002 108.964 176.762 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -67.01 -31.79 78.97 Favored Glycine 0 CA--C 1.535 1.283 0 O-C-N 123.59 0.556 . . . . 54.240000000000002 113.449 177.809 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 52.6 mtp180 -71.7 -41.59 68.43 Favored 'General case' 0 N--CA 1.474 0.759 0 C-N-CA 123.694 0.798 . . . . 75.25 109.643 176.668 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 34.8 tp -66.73 -46.59 75.01 Favored 'General case' 0 C--N 1.351 0.635 0 O-C-N 124.248 0.968 . . . . 71.150000000000006 110.021 -179.471 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 33.8 t -66.07 -36.16 82.45 Favored 'General case' 0 CA--C 1.536 0.439 0 C-N-CA 124.221 1.008 . . . . 73.519999999999996 110.548 177.556 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . -77.84 -66.18 1.8 Allowed Glycine 0 C--N 1.36 1.878 0 C-N-CA 120.692 -0.766 . . . . 73.5 112.702 -176.728 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 112' ' ' MET . . . . . . . . . . . . . 41.7 mmm -99.13 -72.89 0.64 Allowed 'General case' 0 N--CA 1.481 1.101 0 CA-C-N 118.315 1.057 . . . . 72.319999999999993 111.647 172.524 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER 171.4 33.27 0.0 OUTLIER 'General case' 0 N--CA 1.487 1.415 0 C-N-CA 125.85 1.66 . . . . 75.549999999999997 109.666 -178.66 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 11.5 tp . . . . . 0 N--CA 1.491 1.604 0 C-N-CA 125.242 1.417 . . . . 73.209999999999994 113.941 170.011 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 25.0 ptm . . . . . 0 N--CA 1.485 1.28 0 N-CA-C 111.936 0.347 . . . . 71.420000000000002 111.936 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 28.6 m -62.69 -40.19 96.36 Favored 'General case' 0 N--CA 1.482 1.127 0 C-N-CA 122.931 0.492 . . . . 74.200000000000003 111.531 -176.111 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 14.3 m -65.59 -35.99 82.44 Favored 'General case' 0 N--CA 1.476 0.871 0 C-N-CA 122.964 0.505 . . . . 75.010000000000005 110.467 176.331 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 4' ' ' THR . . . . . 0.543 ' HA ' ' HG2' ' A' ' 53' ' ' PRO . 33.5 m -66.4 -50.0 64.93 Favored 'General case' 0 C--N 1.361 1.086 0 C-N-CA 123.602 0.761 . . . . 74.099999999999994 111.3 179.241 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 59.0 t -60.45 -40.02 82.91 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.084 0 C-N-CA 123.401 0.68 . . . . 74.019999999999996 110.022 179.173 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 6' ' ' GLU . . . . . 0.475 ' O ' ' HG3' ' A' ' 10' ' ' ARG . 0.2 OUTLIER -63.68 -41.42 98.15 Favored 'General case' 0 CA--C 1.548 0.895 0 CA-C-N 115.326 -0.852 . . . . 75.299999999999997 110.293 176.823 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 7' ' ' PHE . . . . . 0.584 ' HD1' HH11 ' A' ' 10' ' ' ARG . 39.4 t80 -69.44 -40.71 77.04 Favored 'General case' 0 N--CA 1.483 1.198 0 C-N-CA 123.968 0.907 . . . . 73.230000000000004 111.316 -176.665 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 8' ' ' ILE . . . . . 0.459 ' O ' ' HG3' ' A' ' 12' ' ' GLN . 76.7 mt -60.73 -42.48 92.26 Favored 'Isoleucine or valine' 0 C--N 1.353 0.733 0 N-CA-C 108.593 -0.892 . . . . 73.209999999999994 108.593 172.863 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 3.3 t-20 -66.46 -27.62 67.95 Favored 'General case' 0 N--CA 1.475 0.823 0 O-C-N 124.354 1.034 . . . . 75.230000000000004 111.426 -179.835 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . 0.648 ' HB3' HG23 ' A' ' 47' ' ' VAL . 53.8 mtt180 -71.36 -39.02 71.54 Favored 'General case' 0 N--CA 1.475 0.802 0 C-N-CA 123.442 0.697 . . . . 74.230000000000004 110.764 174.465 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 11' ' ' TRP . . . . . 0.441 ' CD1' HG13 ' A' ' 64' ' ' VAL . 92.1 m95 -75.17 -24.18 57.84 Favored 'General case' 0 N--CA 1.477 0.875 0 CA-C-N 116.25 -0.432 . . . . 73.099999999999994 111.654 173.871 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . 0.491 ' HG2' ' CE2' ' A' ' 67' ' ' TYR . 55.7 mt-30 -68.59 -39.74 80.81 Favored 'General case' 0 N--CA 1.473 0.692 0 N-CA-C 108.743 -0.836 . . . . 74.129999999999995 108.743 170.11 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 22.4 tpt180 -60.19 -53.51 56.84 Favored 'General case' 0 CA--C 1.545 0.759 0 C-N-CA 124.174 0.99 . . . . 75.209999999999994 110.658 178.748 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 14' ' ' ILE . . . . . 0.459 HG21 ' OG1' ' A' ' 71' ' ' THR . 49.1 mt -66.32 -42.74 91.22 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.006 0 O-C-N 123.338 0.399 . . . . 75.340000000000003 110.45 -178.466 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . 0.651 ' HA ' ' HB ' ' A' ' 71' ' ' THR . . . -60.34 -48.04 83.46 Favored 'General case' 0 N--CA 1.486 1.337 0 C-N-CA 123.249 0.619 . . . . 72.219999999999999 112.1 -178.776 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 92.1 mt -70.11 -44.36 69.14 Favored 'General case' 0 N--CA 1.481 1.098 0 O-C-N 124.304 1.003 . . . . 72.319999999999993 110.856 -175.985 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . 0.483 ' O ' ' HG ' ' A' ' 21' ' ' LEU . 49.3 mt -62.62 -53.43 54.68 Favored 'General case' 0 C--N 1.354 0.799 0 O-C-N 123.606 0.566 . . . . 72.219999999999999 110.527 179.982 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 94.9 p -60.8 -37.84 83.31 Favored 'General case' 0 N--CA 1.479 0.975 0 C-N-CA 123.338 0.655 . . . . 72.200000000000003 111.432 -178.51 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 6.9 tp-100 -62.65 -48.11 80.78 Favored 'General case' 0 C--N 1.36 1.025 0 O-C-N 123.939 0.775 . . . . 72.150000000000006 110.348 177.699 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 65.2 m -58.91 -49.04 79.29 Favored 'General case' 0 C--O 1.213 -0.855 0 O-C-N 123.944 0.777 . . . . 41.399999999999999 110.3 176.405 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . 0.568 HD21 ' HA ' ' A' ' 33' ' ' LEU . 79.7 mt -64.43 -31.33 72.5 Favored 'General case' 0 N--CA 1.475 0.807 0 C-N-CA 123.93 0.892 . . . . 75.049999999999997 111.28 -176.471 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . 0.591 ' HA ' HD23 ' A' ' 78' ' ' LEU . 69.9 tp -67.42 -55.42 13.74 Favored 'General case' 0 C--N 1.353 0.738 0 C-N-CA 123.191 0.596 . . . . 73.349999999999994 109.766 176.996 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 45.5 mt-10 -55.05 -50.69 68.47 Favored 'General case' 0 C--N 1.352 0.689 0 O-C-N 124.635 1.209 . . . . 70.299999999999997 110.549 179.933 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . 0.471 ' HB3' ' HB2' ' A' ' 29' ' ' GLU . 93.7 mt -63.38 -36.22 82.98 Favored 'General case' 0 CA--C 1.544 0.736 0 C-N-CA 124.508 1.123 . . . . 71.329999999999998 111.251 -177.46 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -63.9 -41.16 97.77 Favored 'General case' 0 N--CA 1.485 1.277 0 C-N-CA 122.87 0.468 . . . . 73.239999999999995 111.279 174.948 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 86.3 mt-30 -71.41 -23.38 61.86 Favored 'General case' 0 N--CA 1.483 1.195 0 C-N-CA 123.892 0.877 . . . . 73.319999999999993 111.289 177.958 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 89.0 mtt180 -91.98 -11.59 35.66 Favored 'General case' 0 N--CA 1.481 1.113 0 C-N-CA 123.943 0.897 . . . . 75.319999999999993 111.685 176.649 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 88.21 6.98 73.95 Favored Glycine 0 C--N 1.349 1.284 0 CA-C-O 119.924 -0.375 . . . . 73.109999999999999 113.941 178.549 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 29' ' ' GLU . . . . . 0.471 ' HB2' ' HB3' ' A' ' 24' ' ' LEU . 44.2 mm-40 -79.01 55.91 1.87 Allowed 'General case' 0 N--CA 1.484 1.23 0 C-N-CA 124.805 1.242 . . . . 65.420000000000002 111.643 176.424 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 30' ' ' TRP . . . . . 0.597 ' HH2' HD22 ' A' ' 81' ' ' LEU . 93.8 m95 -64.17 -27.51 69.12 Favored 'General case' 0 N--CA 1.481 1.08 0 C-N-CA 124.162 0.985 . . . . 72.099999999999994 111.904 -177.492 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 4.9 m-20 -56.94 -47.86 79.67 Favored 'General case' 0 CA--C 1.539 0.536 0 C-N-CA 124.12 0.968 . . . . 73.319999999999993 110.353 176.275 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 98.4 mt -64.84 -26.8 68.49 Favored 'General case' 0 CA--C 1.546 0.826 0 CA-C-N 115.574 -0.739 . . . . 74.409999999999997 111.204 179.983 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . 0.568 ' HA ' HD21 ' A' ' 21' ' ' LEU . 9.8 mp -68.93 -39.63 79.5 Favored 'General case' 0 N--CA 1.484 1.249 0 C-N-CA 122.465 0.306 . . . . 73.109999999999999 110.458 171.34 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . 0.414 ' HG ' ' O ' ' A' ' 30' ' ' TRP . 75.7 mt -66.69 -37.92 85.71 Favored 'General case' 0 N--CA 1.487 1.385 0 O-C-N 123.585 0.553 . . . . 74.409999999999997 111.975 -179.681 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 1.3 mp0 -71.67 -49.19 42.0 Favored 'General case' 0 N--CA 1.485 1.315 0 C-N-CA 122.638 0.375 . . . . 74.340000000000003 110.957 177.598 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 36' ' ' GLN . . . . . 0.457 ' HB2' HD22 ' A' ' 21' ' ' LEU . 87.4 mm-40 -74.42 -13.44 60.72 Favored 'General case' 0 N--CA 1.478 0.955 0 C-N-CA 123.22 0.608 . . . . 72.230000000000004 111.96 -179.563 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . 0.505 ' O ' ' HG ' ' A' ' 41' ' ' LEU . 32.4 tt0 -48.51 -61.14 2.17 Favored 'General case' 0 N--CA 1.486 1.332 0 C-N-CA 124.672 1.189 . . . . 72.420000000000002 111.885 177.584 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 66.0 t -53.55 -46.27 59.91 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.346 0 O-C-N 124.322 1.014 . . . . 74.239999999999995 111.235 -176.517 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 44.6 m -65.66 -38.51 89.51 Favored 'General case' 0 CA--C 1.544 0.748 0 CA-C-N 114.99 -1.005 . . . . 74.230000000000004 111.727 179.818 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 40.0 t80 -69.29 -46.08 68.04 Favored 'General case' 0 N--CA 1.476 0.87 0 C-N-CA 123.056 0.542 . . . . 75.209999999999994 110.564 -177.758 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . 0.505 ' HG ' ' O ' ' A' ' 37' ' ' GLU . 49.9 mt -55.75 -51.79 66.15 Favored 'General case' 0 C--N 1.355 0.829 0 O-C-N 124.673 1.233 . . . . 71.319999999999993 109.81 177.382 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 50.1 tt0 -54.54 -48.02 72.48 Favored 'General case' 0 C--N 1.355 0.812 0 CA-C-N 114.62 -1.173 . . . . 73.019999999999996 111.017 179.404 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 43' ' ' SER . . . . . 0.52 ' O ' HG22 ' A' ' 47' ' ' VAL . 67.5 m -59.03 -62.18 2.08 Favored 'General case' 0 C--N 1.349 0.552 0 O-C-N 124.057 0.848 . . . . 75.219999999999999 111.307 -177.721 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 44' ' ' ILE . . . . . 0.43 HG12 ' HE2' ' A' ' 48' ' ' MET . 14.6 tt -64.52 -34.78 71.84 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.955 0 O-C-N 123.571 0.544 . . . . 72.0 111.628 -171.46 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . 0.528 ' HG2' HD23 ' A' ' 92' ' ' LEU . 17.6 mm-40 -58.93 -53.02 63.15 Favored 'General case' 0 N--CA 1.484 1.237 0 C-N-CA 122.663 0.385 . . . . 70.030000000000001 110.539 171.947 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 87.2 m -56.43 -40.31 74.54 Favored 'General case' 0 C--N 1.358 0.949 0 C-N-CA 123.502 0.721 . . . . 74.430000000000007 111.486 -178.654 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 47' ' ' VAL . . . . . 0.648 HG23 ' HB3' ' A' ' 10' ' ' ARG . 44.9 t -70.36 -41.22 78.43 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.078 0 C-N-CA 123.406 0.682 . . . . 73.329999999999998 111.293 -177.055 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 48' ' ' MET . . . . . 0.43 ' HE2' HG12 ' A' ' 44' ' ' ILE . 77.3 mtm -71.34 -30.8 66.62 Favored 'General case' 0 N--CA 1.486 1.361 0 C-N-CA 122.505 0.322 . . . . 75.319999999999993 111.667 179.519 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 62.3 mt-10 -82.57 -8.3 59.61 Favored 'General case' 0 N--CA 1.482 1.167 0 C-N-CA 123.314 0.646 . . . . 73.329999999999998 111.334 176.332 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . 0.532 ' HB2' ' HZ2' ' A' ' 50' ' ' LYS . 0.1 OUTLIER -90.41 139.9 30.23 Favored 'General case' 0 N--CA 1.469 0.502 0 C-N-CA 123.002 0.521 . . . . 72.319999999999993 110.407 -176.002 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 7.7 tt0 -68.78 140.97 55.31 Favored 'General case' 0 CA--C 1.537 0.477 0 C-N-CA 124.172 0.989 . . . . 74.209999999999994 109.893 174.784 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 52' ' ' THR . . . . . 0.407 ' HA ' ' HD3' ' A' ' 53' ' ' PRO . 25.2 m -83.76 128.18 64.5 Favored Pre-proline 0 CA--C 1.547 0.844 0 N-CA-C 109.548 -0.538 . . . . 63.399999999999999 109.548 174.709 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 53' ' ' PRO . . . . . 0.543 ' HG2' ' HA ' ' A' ' 4' ' ' THR . 25.7 Cg_exo -65.57 155.07 70.89 Favored 'Trans proline' 0 C--N 1.376 1.99 0 C-N-CA 123.086 2.524 . . . . 73.439999999999998 113.548 -179.422 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 54' ' ' PRO . . . . . 0.421 ' HA ' HD12 ' A' ' 113' ' ' LEU . 37.9 Cg_endo -66.1 -47.46 3.47 Favored 'Trans proline' 0 C--N 1.382 2.292 0 C-N-CA 123.165 2.577 . . . . 73.430000000000007 112.687 176.736 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . -75.34 78.89 1.09 Allowed Glycine 0 C--N 1.343 0.938 0 O-C-N 123.748 0.655 . . . . 72.200000000000003 113.882 -172.824 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 65.4 mt -116.88 117.16 54.49 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.651 0 N-CA-C 108.134 -1.062 . . . . 72.140000000000001 108.134 173.99 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 62.8 p -95.92 -168.05 1.69 Allowed 'General case' 0 N--CA 1.476 0.866 0 C-N-CA 123.663 0.785 . . . . 75.109999999999999 110.024 179.11 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 32.5 tpt180 -58.82 -63.76 1.18 Allowed 'General case' 0 C--N 1.355 0.819 0 C-N-CA 124.025 0.93 . . . . 74.420000000000002 110.271 175.355 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 13.1 m -59.84 -38.04 80.94 Favored 'General case' 0 C--N 1.353 0.73 0 O-C-N 123.989 0.805 . . . . 72.219999999999999 111.655 -175.111 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 60' ' ' ILE . . . . . 0.464 HD11 HG23 ' A' ' 4' ' ' THR . 94.5 mt -61.62 -48.79 87.11 Favored 'Isoleucine or valine' 0 C--N 1.357 0.923 0 O-C-N 123.833 0.708 . . . . 75.439999999999998 110.28 176.71 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 49.8 tt0 -59.26 -41.69 89.41 Favored 'General case' 0 N--CA 1.479 1.022 0 C-N-CA 123.259 0.623 . . . . 75.340000000000003 111.261 -179.211 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 23.6 m-20 -74.04 -32.81 63.5 Favored 'General case' 0 N--CA 1.476 0.833 0 N-CA-C 112.297 0.48 . . . . 63.439999999999998 112.297 -178.54 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 63' ' ' MET . . . . . . . . . . . . . 67.8 mtm -71.51 -43.55 66.29 Favored 'General case' 0 N--CA 1.486 1.374 0 CA-C-N 118.194 0.452 . . . . 74.209999999999994 110.432 177.408 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 64' ' ' VAL . . . . . 0.468 ' O ' HG13 ' A' ' 68' ' ' ILE . 78.9 t -63.65 -61.64 1.58 Allowed 'Isoleucine or valine' 0 CA--C 1.54 0.576 0 O-C-N 123.936 0.772 . . . . 73.420000000000002 109.443 177.68 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -63.26 -26.45 68.79 Favored 'General case' 0 N--CA 1.485 1.287 0 C-N-CA 123.433 0.693 . . . . 75.140000000000001 112.442 -179.201 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -66.17 -46.69 78.11 Favored Glycine 0 C--N 1.343 0.958 0 N-CA-C 111.581 -0.607 . . . . 74.329999999999998 111.581 174.797 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 67' ' ' TYR . . . . . 0.491 ' CE2' ' HG2' ' A' ' 12' ' ' GLN . 12.6 m-30 -77.15 -23.17 51.67 Favored 'General case' 0 N--CA 1.468 0.446 0 CA-C-O 118.8 -0.619 . . . . 65.239999999999995 112.12 178.095 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 68' ' ' ILE . . . . . 0.468 HG13 ' O ' ' A' ' 64' ' ' VAL . 49.4 mt -68.96 -53.68 24.72 Favored 'Isoleucine or valine' 0 C--N 1.363 1.156 0 N-CA-C 108.04 -1.096 . . . . 73.239999999999995 108.04 172.472 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 69' ' ' LYS . . . . . 0.494 ' HB2' ' HE2' ' A' ' 106' ' ' TYR . 49.9 tptt -54.14 -46.18 72.15 Favored 'General case' 0 N--CA 1.487 1.394 0 C-N-CA 123.641 0.776 . . . . 75.430000000000007 110.962 178.106 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 62.9 tt0 -57.84 -50.2 74.09 Favored 'General case' 0 CA--C 1.537 0.456 0 O-C-N 124.3 1.0 . . . . 72.349999999999994 109.99 179.532 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 71' ' ' THR . . . . . 0.651 ' HB ' ' HA ' ' A' ' 15' ' ' ALA . 11.5 t -74.16 -20.44 60.22 Favored 'General case' 0 C--O 1.207 -1.179 0 CA-C-O 118.539 -0.743 . . . . 72.019999999999996 111.632 -178.818 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 72' ' ' LEU . . . . . 0.542 HD23 ' HB3' ' A' ' 102' ' ' LEU . 17.9 mt -70.15 -40.04 74.98 Favored 'General case' 0 N--CA 1.484 1.237 0 CA-C-N 118.622 0.646 . . . . 74.140000000000001 109.436 175.464 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 71.5 m-20 -66.88 -52.54 42.17 Favored 'General case' 0 C--N 1.342 0.266 0 O-C-N 123.898 0.749 . . . . 65.0 109.799 178.808 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 74' ' ' ASN . . . . . 0.504 ' HA ' HD23 ' A' ' 22' ' ' LEU . 53.9 m-20 -58.04 -50.45 73.39 Favored 'General case' 0 N--CA 1.479 1.025 0 C-N-CA 123.661 0.785 . . . . 73.239999999999995 110.932 -179.523 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . 0.485 ' O ' ' HG2' ' A' ' 79' ' ' LYS . 4.8 tp10 -57.35 -60.2 3.99 Favored 'General case' 0 N--CA 1.473 0.724 0 C-N-CA 124.162 0.985 . . . . 72.319999999999993 110.564 179.674 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 7.8 tt0 -61.29 -35.48 77.45 Favored 'General case' 0 N--CA 1.479 1.002 0 C-N-CA 123.985 0.914 . . . . 73.420000000000002 111.658 -171.525 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . 0.414 ' O ' ' HB2' ' A' ' 81' ' ' LEU . 63.5 mt -60.35 -51.29 70.13 Favored 'General case' 0 C--N 1.357 0.902 0 O-C-N 123.862 0.726 . . . . 75.129999999999995 109.426 173.579 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . 0.591 HD23 ' HA ' ' A' ' 22' ' ' LEU . 75.6 mt -59.03 -39.4 81.83 Favored 'General case' 0 N--CA 1.484 1.246 0 O-C-N 123.765 0.666 . . . . 75.209999999999994 112.45 177.952 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 79' ' ' LYS . . . . . 0.485 ' HG2' ' O ' ' A' ' 75' ' ' GLU . 7.8 mmpt? -65.5 -40.19 92.76 Favored 'General case' 0 CA--C 1.546 0.802 0 N-CA-C 109.618 -0.512 . . . . 72.519999999999996 109.618 -178.079 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -85.5 -8.87 79.99 Favored Glycine 0 C--N 1.349 1.257 0 CA-C-N 115.347 -0.842 . . . . 72.219999999999999 113.586 176.291 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 81' ' ' LEU . . . . . 0.597 HD22 ' HH2' ' A' ' 30' ' ' TRP . 2.5 tt -81.99 -41.85 20.18 Favored 'General case' 0 N--CA 1.479 0.996 0 C-N-CA 123.114 0.565 . . . . 73.409999999999997 109.635 178.693 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 82' ' ' LEU . . . . . 0.423 ' HG ' ' O ' ' A' ' 78' ' ' LEU . 97.1 mt . . . . . 0 N--CA 1.482 1.144 0 N-CA-C 112.68 0.622 . . . . 70.230000000000004 112.68 -173.976 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 92' ' ' LEU . . . . . 0.528 HD23 ' HG2' ' A' ' 45' ' ' GLU . 20.8 mt . . . . . 0 N--CA 1.474 0.767 0 CA-C-O 118.459 -0.781 . . . . 72.400000000000006 109.003 . . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 65.3 mt -42.52 -48.24 1.1 Allowed 'Isoleucine or valine' 0 C--N 1.367 1.368 0 C-N-CA 124.151 0.98 . . . . 65.219999999999999 110.341 167.915 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 169.87 -133.97 3.0 Favored Glycine 0 C--N 1.344 1.009 0 CA-C-N 115.534 -0.757 . . . . 62.329999999999998 111.424 171.211 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -69.91 154.72 41.59 Favored 'General case' 0 CA--C 1.548 0.871 0 C-N-CA 123.077 0.551 . . . . 70.530000000000001 110.919 173.493 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 19.6 m 66.12 -82.91 0.03 OUTLIER 'General case' 0 N--CA 1.48 1.068 0 C-N-CA 125.15 1.38 . . . . 73.340000000000003 110.749 -175.766 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 97' ' ' THR . . . . . 0.435 ' HB ' ' HD3' ' A' ' 98' ' ' ARG . 28.6 m 47.02 -82.35 0.01 OUTLIER 'General case' 0 CA--C 1.553 1.072 0 C-N-CA 126.23 1.812 . . . . 55.200000000000003 114.795 175.676 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 98' ' ' ARG . . . . . 0.539 ' HD3' ' H ' ' A' ' 98' ' ' ARG . 0.8 OUTLIER -57.48 -56.44 21.79 Favored 'General case' 0 N--CA 1.477 0.919 0 C-N-CA 124.593 1.157 . . . . 75.5 111.539 -164.993 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 51.3 tt0 -61.28 -54.89 38.27 Favored 'General case' 0 CA--C 1.539 0.547 0 CA-C-N 114.672 -1.149 . . . . 71.510000000000005 110.596 -174.142 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 87.9 tttt -64.99 -53.65 42.85 Favored 'General case' 0 N--CA 1.476 0.854 0 O-C-N 123.719 0.637 . . . . 73.219999999999999 111.704 -176.034 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 44.8 t -57.48 -49.26 76.87 Favored 'General case' 0 N--CA 1.478 0.938 0 C-N-CA 123.773 0.829 . . . . 72.329999999999998 111.772 -174.747 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 102' ' ' LEU . . . . . 0.542 ' HB3' HD23 ' A' ' 72' ' ' LEU . 9.4 mp -77.49 -27.03 51.78 Favored 'General case' 0 CA--C 1.556 1.187 0 O-C-N 123.586 0.554 . . . . 74.450000000000003 111.55 -176.203 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 24.9 t-20 -70.1 -41.35 74.12 Favored 'General case' 0 N--CA 1.49 1.574 0 C-N-CA 122.64 0.376 . . . . 74.120000000000005 111.119 173.946 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -68.89 -41.22 78.59 Favored 'General case' 0 N--CA 1.476 0.871 0 C-N-CA 123.536 0.734 . . . . 71.299999999999997 109.194 178.035 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -60.08 -40.11 88.42 Favored 'General case' 0 C--N 1.352 0.694 0 O-C-N 124.07 0.856 . . . . 54.240000000000002 110.478 176.284 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 106' ' ' TYR . . . . . 0.494 ' HE2' ' HB2' ' A' ' 69' ' ' LYS . 4.6 t80 -64.2 -49.5 71.76 Favored 'General case' 0 N--CA 1.475 0.784 0 C-N-CA 123.695 0.798 . . . . 73.239999999999995 110.596 178.278 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -63.96 -40.49 98.31 Favored Glycine 0 C--N 1.353 1.513 0 O-C-N 123.431 0.457 . . . . 31.440000000000001 113.019 -175.65 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 93.8 mtt180 -74.49 -30.22 61.74 Favored 'General case' 0 N--CA 1.469 0.49 0 C-N-CA 123.446 0.698 . . . . 74.239999999999995 110.603 178.239 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 52.4 tp -64.17 -45.06 90.09 Favored 'General case' 0 N--CA 1.484 1.238 0 C-N-CA 123.368 0.667 . . . . 75.209999999999994 110.272 173.895 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 39.8 t -63.0 -48.75 77.47 Favored 'General case' 0 CA--C 1.538 0.484 0 O-C-N 124.558 1.161 . . . . 63.350000000000001 110.149 -179.521 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . -81.22 -61.45 2.1 Favored Glycine 0 C--N 1.349 1.295 0 C-N-CA 121.243 -0.503 . . . . 73.340000000000003 113.515 -176.565 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 112' ' ' MET . . . . . . . . . . . . . 64.6 mmm -93.44 -65.72 0.97 Allowed 'General case' 0 N--CA 1.484 1.271 0 N-CA-C 114.127 1.158 . . . . 72.040000000000006 114.127 -173.351 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 113' ' ' LEU . . . . . 0.439 ' O ' ' HB2' ' A' ' 114' ' ' LEU . 5.8 tt 179.94 -36.29 0.01 OUTLIER 'General case' 0 N--CA 1.474 0.771 0 C-N-CA 124.099 0.96 . . . . 74.109999999999999 108.517 -168.947 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 114' ' ' LEU . . . . . 0.439 ' HB2' ' O ' ' A' ' 113' ' ' LEU . 3.5 tt . . . . . 0 N--CA 1.498 1.936 0 C-N-CA 129.263 3.025 . . . . 73.150000000000006 106.367 178.284 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 1' ' ' MET . . . . . 0.432 ' HE1' HD11 ' A' ' 60' ' ' ILE . 22.1 ttt . . . . . 0 N--CA 1.485 1.313 0 CA-C-O 119.628 -0.225 . . . . 65.420000000000002 110.777 . . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 36.8 p -52.36 -45.84 65.91 Favored 'General case' 0 N--CA 1.487 1.378 0 C-N-CA 123.736 0.815 . . . . 75.340000000000003 112.394 -175.221 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 17.4 m -67.81 -33.47 74.87 Favored 'General case' 0 CA--C 1.552 1.051 0 C-N-CA 123.46 0.704 . . . . 73.219999999999999 111.497 -178.547 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 4' ' ' THR . . . . . 0.52 HG23 HD12 ' A' ' 60' ' ' ILE . 60.2 m -70.94 -41.18 71.49 Favored 'General case' 0 N--CA 1.475 0.793 0 C-N-CA 123.705 0.802 . . . . 73.329999999999998 110.739 177.536 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 95.5 t -66.67 -37.56 79.78 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.835 0 C-N-CA 123.353 0.661 . . . . 70.209999999999994 109.62 -179.168 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 6' ' ' GLU . . . . . 0.405 ' O ' ' HG3' ' A' ' 10' ' ' ARG . 57.2 mt-10 -62.49 -48.69 78.46 Favored 'General case' 0 C--N 1.356 0.861 0 O-C-N 123.727 0.642 . . . . 70.409999999999997 110.242 171.344 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 30.4 t80 -61.34 -46.17 91.36 Favored 'General case' 0 N--CA 1.481 1.102 0 C-N-CA 124.268 1.027 . . . . 74.340000000000003 111.249 -174.086 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 82.9 mt -65.57 -41.31 90.49 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.785 0 C-N-CA 123.789 0.835 . . . . 70.409999999999997 109.741 176.208 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 3.7 t-20 -65.6 -28.17 68.94 Favored 'General case' 0 N--CA 1.484 1.26 0 C-N-CA 123.02 0.528 . . . . 62.009999999999998 111.426 179.452 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . 0.405 ' HG3' ' O ' ' A' ' 6' ' ' GLU . 62.4 mtt85 -70.11 -46.9 63.84 Favored 'General case' 0 C--O 1.224 -0.244 0 N-CA-C 109.168 -0.679 . . . . 74.0 109.168 174.504 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 11' ' ' TRP . . . . . 0.412 ' CD1' HG11 ' A' ' 64' ' ' VAL . 91.1 m95 -68.86 -20.96 64.29 Favored 'General case' 0 N--CA 1.478 0.935 0 O-C-N 123.385 0.428 . . . . 62.0 111.818 175.731 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 53.9 mt-30 -65.97 -52.19 51.72 Favored 'General case' 0 N--CA 1.477 0.921 0 N-CA-C 108.016 -1.105 . . . . 73.409999999999997 108.016 169.323 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 14.8 tpt180 -55.61 -44.86 77.44 Favored 'General case' 0 CA--C 1.547 0.856 0 O-C-N 124.267 0.98 . . . . 73.129999999999995 111.224 -179.368 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 14' ' ' ILE . . . . . 0.528 HD11 HG13 ' A' ' 44' ' ' ILE . 77.8 mt -70.41 -50.25 47.3 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.81 0 C-N-CA 123.775 0.83 . . . . 72.450000000000003 111.096 -177.011 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -58.54 -44.57 89.66 Favored 'General case' 0 N--CA 1.485 1.275 0 C-N-CA 123.688 0.795 . . . . 73.420000000000002 111.263 -178.8 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 95.1 mt -71.92 -43.58 65.09 Favored 'General case' 0 N--CA 1.475 0.821 0 CA-C-N 114.514 -1.221 . . . . 71.420000000000002 110.918 -177.879 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . 0.417 ' O ' ' HG ' ' A' ' 21' ' ' LEU . 17.7 mt -63.1 -44.59 95.26 Favored 'General case' 0 N--CA 1.487 1.396 0 CA-C-O 119.227 -0.416 . . . . 64.450000000000003 110.992 178.772 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 81.0 p -65.08 -39.58 93.41 Favored 'General case' 0 N--CA 1.474 0.773 0 C-N-CA 123.006 0.522 . . . . 74.209999999999994 110.667 -178.961 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 6.6 tp-100 -59.66 -47.98 83.46 Favored 'General case' 0 C--N 1.359 1.014 0 O-C-N 123.894 0.746 . . . . 74.409999999999997 110.33 174.47 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 68.1 m -58.37 -52.94 63.51 Favored 'General case' 0 C--O 1.208 -1.116 0 CA-C-N 115.456 -0.793 . . . . 74.140000000000001 110.481 177.701 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . 0.551 HD22 ' HA ' ' A' ' 33' ' ' LEU . 89.1 mt -65.92 -24.71 66.88 Favored 'General case' 0 N--CA 1.474 0.736 0 C-N-CA 124.197 0.999 . . . . 72.200000000000003 111.486 -175.145 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . 0.655 ' HA ' HD22 ' A' ' 78' ' ' LEU . 57.4 tp -69.88 -53.81 16.34 Favored 'General case' 0 C--N 1.356 0.873 0 N-CA-C 109.814 -0.439 . . . . 75.430000000000007 109.814 174.357 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . 0.414 ' O ' ' HG3' ' A' ' 27' ' ' ARG . 40.8 mt-10 -57.27 -49.94 74.47 Favored 'General case' 0 N--CA 1.48 1.067 0 O-C-N 123.968 0.792 . . . . 74.109999999999999 110.161 178.628 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . 0.519 ' HB3' ' HB2' ' A' ' 29' ' ' GLU . 95.0 mt -59.4 -42.23 91.27 Favored 'General case' 0 CA--C 1.536 0.438 0 C-N-CA 125.244 1.418 . . . . 72.439999999999998 110.878 -178.218 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . 0.553 ' HB1' HD22 ' A' ' 33' ' ' LEU . . . -58.73 -48.62 80.52 Favored 'General case' 0 N--CA 1.48 1.032 0 C-N-CA 122.613 0.365 . . . . 73.430000000000007 110.753 175.78 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 96.1 mt-30 -63.04 -30.25 71.45 Favored 'General case' 0 CA--C 1.55 0.945 0 O-C-N 124.063 0.852 . . . . 73.120000000000005 111.407 -179.591 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 27' ' ' ARG . . . . . 0.414 ' HG3' ' O ' ' A' ' 23' ' ' GLU . 90.4 mtt180 -78.83 -28.05 44.36 Favored 'General case' 0 N--CA 1.483 1.207 0 C-N-CA 123.688 0.795 . . . . 74.219999999999999 111.082 178.216 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 98.73 22.53 13.66 Favored Glycine 0 C--N 1.352 1.436 0 C-N-CA 123.117 0.389 . . . . 50.229999999999997 113.603 -176.493 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 29' ' ' GLU . . . . . 0.519 ' HB2' ' HB3' ' A' ' 24' ' ' LEU . 14.8 mm-40 -86.52 54.27 3.1 Favored 'General case' 0 CA--C 1.552 1.044 0 C-N-CA 125.04 1.336 . . . . 74.439999999999998 110.396 177.72 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 30' ' ' TRP . . . . . 0.522 ' HH2' HD23 ' A' ' 81' ' ' LEU . 57.2 m95 -59.49 -33.84 71.84 Favored 'General case' 0 N--CA 1.486 1.34 0 C-N-CA 124.257 1.023 . . . . 71.219999999999999 112.009 -171.952 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 3.7 m-20 -58.62 -41.42 85.88 Favored 'General case' 0 N--CA 1.474 0.736 0 C-N-CA 124.462 1.105 . . . . 75.239999999999995 110.697 -178.407 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 86.0 mt -69.78 -31.83 69.99 Favored 'General case' 0 N--CA 1.472 0.647 0 CA-C-N 115.141 -0.936 . . . . 72.150000000000006 110.955 -177.369 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . 0.553 HD22 ' HB1' ' A' ' 25' ' ' ALA . 10.1 mp -67.71 -43.94 78.85 Favored 'General case' 0 N--CA 1.482 1.146 0 C-N-CA 122.934 0.494 . . . . 75.239999999999995 110.466 174.35 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . 0.409 ' HG ' ' O ' ' A' ' 30' ' ' TRP . 73.1 mt -67.07 -37.58 84.25 Favored 'General case' 0 N--CA 1.484 1.238 0 O-C-N 123.606 0.566 . . . . 61.32 111.767 -177.53 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 98.5 mt-30 -70.91 -54.1 12.64 Favored 'General case' 0 N--CA 1.477 0.889 0 C-N-CA 123.025 0.53 . . . . 75.140000000000001 110.172 177.969 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 83.6 mm-40 -68.34 -16.45 63.94 Favored 'General case' 0 N--CA 1.474 0.741 0 CA-C-O 118.484 -0.769 . . . . 74.129999999999995 112.382 -178.622 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 33.3 tt0 -50.39 -46.3 56.01 Favored 'General case' 0 N--CA 1.48 1.068 0 C-N-CA 123.306 0.642 . . . . 74.510000000000005 111.348 176.947 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 60.5 t -62.32 -55.67 22.51 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.752 0 C-N-CA 123.336 0.655 . . . . 72.519999999999996 111.403 -176.022 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 29.4 p -68.52 -39.62 81.11 Favored 'General case' 0 N--CA 1.478 0.95 0 C-N-CA 123.614 0.766 . . . . 63.009999999999998 111.675 -175.957 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 45.6 t80 -64.83 -49.31 71.12 Favored 'General case' 0 N--CA 1.477 0.92 0 C-N-CA 124.189 0.996 . . . . 75.420000000000002 111.063 -177.412 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . 0.475 ' HA ' HG22 ' A' ' 44' ' ' ILE . 86.8 mt -72.77 -34.09 66.73 Favored 'General case' 0 C--O 1.243 0.76 0 O-C-N 123.721 0.638 . . . . 71.329999999999998 111.066 -178.566 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 53.2 tt0 -57.36 -51.85 67.72 Favored 'General case' 0 C--N 1.353 0.736 0 O-C-N 123.666 0.604 . . . . 74.530000000000001 109.513 173.625 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 43' ' ' SER . . . . . 0.536 ' O ' HG21 ' A' ' 47' ' ' VAL . 69.0 m -56.94 -56.39 22.31 Favored 'General case' 0 C--N 1.351 0.664 0 O-C-N 124.479 1.112 . . . . 65.030000000000001 110.423 179.865 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 44' ' ' ILE . . . . . 0.528 HG13 HD11 ' A' ' 14' ' ' ILE . 14.3 tt -62.61 -38.54 81.78 Favored 'Isoleucine or valine' 0 C--O 1.252 1.236 0 C-N-CA 123.553 0.741 . . . . 54.030000000000001 112.205 -168.687 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 31.9 mm-40 -69.62 -37.78 76.97 Favored 'General case' 0 C--N 1.359 0.993 0 O-C-N 123.114 0.258 . . . . 74.420000000000002 110.508 174.819 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 87.6 m -65.46 -28.4 69.19 Favored 'General case' 0 CA--C 1.557 1.214 0 C-N-CA 123.44 0.696 . . . . 65.0 111.762 176.166 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 47' ' ' VAL . . . . . 0.536 HG21 ' O ' ' A' ' 43' ' ' SER . 12.9 t -77.23 -42.45 31.09 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.396 0 O-C-N 122.086 -0.384 . . . . 75.049999999999997 110.074 179.123 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 48' ' ' MET . . . . . . . . . . . . . 74.3 mtm -74.43 -13.63 60.74 Favored 'General case' 0 N--CA 1.482 1.135 0 CA-C-N 116.294 -0.412 . . . . 73.530000000000001 110.936 173.927 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 15.8 tp10 -80.47 -35.21 35.18 Favored 'General case' 0 N--CA 1.477 0.877 0 C-N-CA 123.457 0.703 . . . . 73.140000000000001 109.649 169.171 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 13.9 mptt -70.52 123.58 22.15 Favored 'General case' 0 N--CA 1.472 0.649 0 N-CA-C 109.156 -0.683 . . . . 75.140000000000001 109.156 175.611 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 8.8 tt0 -62.71 150.46 41.07 Favored 'General case' 0 C--O 1.242 0.672 0 CA-C-N 115.049 -0.978 . . . . 72.420000000000002 110.289 178.316 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 52' ' ' THR . . . . . 0.413 HG23 ' HG ' ' A' ' 113' ' ' LEU . 11.3 m -58.56 116.23 14.45 Favored Pre-proline 0 CA--C 1.552 1.037 0 N-CA-C 109.737 -0.468 . . . . 64.329999999999998 109.737 174.452 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 46.5 Cg_endo -64.93 156.08 64.34 Favored 'Trans proline' 0 C--N 1.373 1.848 0 C-N-CA 122.378 2.052 . . . . 75.510000000000005 112.414 -177.196 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 46.8 Cg_exo -57.49 -46.4 27.73 Favored 'Trans proline' 0 C--N 1.378 2.102 0 C-N-CA 123.249 2.632 . . . . 70.040000000000006 112.875 179.167 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . -77.47 71.13 2.34 Favored Glycine 0 C--N 1.348 1.206 0 CA-C-N 115.597 -0.728 . . . . 75.299999999999997 114.343 -175.511 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 19.8 mm -103.56 108.39 24.39 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.6 0 N-CA-C 107.93 -1.137 . . . . 74.140000000000001 107.93 170.595 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 64.5 p -89.67 176.31 6.91 Favored 'General case' 0 C--O 1.247 0.946 0 N-CA-C 108.349 -0.982 . . . . 72.400000000000006 108.349 167.725 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 34.2 tpt85 -61.5 -50.67 71.8 Favored 'General case' 0 CA--C 1.543 0.702 0 N-CA-C 109.747 -0.464 . . . . 74.549999999999997 109.747 179.813 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 37.4 m -58.02 -39.94 79.6 Favored 'General case' 0 CA--C 1.543 0.71 0 O-C-N 124.083 0.865 . . . . 51.43 111.64 179.207 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 60' ' ' ILE . . . . . 0.52 HD12 HG23 ' A' ' 4' ' ' THR . 81.2 mt -63.02 -46.48 96.16 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.094 0 C-N-CA 123.664 0.786 . . . . 74.120000000000005 110.784 178.387 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 56.6 tt0 -57.18 -42.71 81.66 Favored 'General case' 0 N--CA 1.478 0.947 0 C-N-CA 123.541 0.736 . . . . 64.530000000000001 110.918 177.573 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 44.3 m-20 -70.61 -38.99 74.03 Favored 'General case' 0 N--CA 1.48 1.033 0 CA-C-N 116.025 -0.534 . . . . 71.099999999999994 112.151 179.571 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 63' ' ' MET . . . . . . . . . . . . . 72.6 mtm -69.67 -42.37 74.25 Favored 'General case' 0 N--CA 1.485 1.318 0 C-N-CA 122.509 0.324 . . . . 62.219999999999999 110.774 -177.816 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 64' ' ' VAL . . . . . 0.512 ' O ' HG13 ' A' ' 68' ' ' ILE . 79.4 t -64.07 -56.7 15.08 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.519 0 O-C-N 123.994 0.809 . . . . 72.430000000000007 109.421 177.499 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -63.33 -29.58 70.87 Favored 'General case' 0 N--CA 1.486 1.339 0 C-N-CA 122.871 0.468 . . . . 73.319999999999993 112.012 -179.158 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -67.16 -40.85 92.64 Favored Glycine 0 C--N 1.347 1.168 0 N-CA-C 111.659 -0.576 . . . . 74.239999999999995 111.659 175.84 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 67' ' ' TYR . . . . . 0.469 ' O ' HG21 ' A' ' 71' ' ' THR . 15.4 m-30 -69.21 -39.85 78.34 Favored 'General case' 0 C--O 1.241 0.639 0 C-N-CA 123.425 0.69 . . . . 74.540000000000006 110.999 175.943 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 68' ' ' ILE . . . . . 0.521 ' O ' ' HG ' ' A' ' 72' ' ' LEU . 36.9 mt -60.11 -44.71 95.67 Favored 'Isoleucine or valine' 0 C--N 1.365 1.256 0 N-CA-C 108.286 -1.005 . . . . 74.040000000000006 108.286 176.152 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 69' ' ' LYS . . . . . 0.469 ' HB2' ' HE2' ' A' ' 106' ' ' TYR . 51.5 tptt -58.07 -45.26 87.38 Favored 'General case' 0 N--CA 1.476 0.856 0 C-N-CA 123.82 0.848 . . . . 73.239999999999995 110.683 179.166 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 70' ' ' GLN . . . . . 0.415 ' HG2' ' ND2' ' A' ' 74' ' ' ASN . 60.5 tt0 -60.02 -45.97 91.02 Favored 'General case' 0 C--N 1.352 0.688 0 O-C-N 123.798 0.687 . . . . 75.099999999999994 110.413 -179.676 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 71' ' ' THR . . . . . 0.469 HG21 ' O ' ' A' ' 67' ' ' TYR . 1.8 t -75.57 -22.74 56.71 Favored 'General case' 0 C--N 1.355 0.814 0 CA-C-O 119.196 -0.431 . . . . 75.230000000000004 111.259 -178.584 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 72' ' ' LEU . . . . . 0.521 ' HG ' ' O ' ' A' ' 68' ' ' ILE . 34.2 mt -64.03 -53.33 51.69 Favored 'General case' 0 C--N 1.361 1.101 0 N-CA-C 108.794 -0.817 . . . . 75.120000000000005 108.794 173.871 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 66.9 m-20 -64.39 -52.92 55.83 Favored 'General case' 0 N--CA 1.475 0.779 0 O-C-N 123.906 0.754 . . . . 74.349999999999994 111.24 -177.077 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 74' ' ' ASN . . . . . 0.423 ' HA ' HD23 ' A' ' 22' ' ' LEU . 90.3 m-20 -55.58 -54.0 49.44 Favored 'General case' 0 N--CA 1.482 1.17 0 O-C-N 124.164 0.915 . . . . 75.5 111.188 -177.964 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . 0.467 ' HG2' ' HE2' ' A' ' 79' ' ' LYS . 13.8 tt0 -73.31 -30.09 63.14 Favored 'General case' 0 CA--C 1.553 1.077 0 CA-C-N 115.723 -0.672 . . . . 72.420000000000002 110.857 -173.225 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 10.1 tt0 -69.1 -39.08 79.19 Favored 'General case' 0 N--CA 1.488 1.472 0 C-N-CA 123.458 0.703 . . . . 75.200000000000003 110.568 177.284 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 90.4 mt -63.37 -40.08 96.28 Favored 'General case' 0 C--N 1.351 0.671 0 CA-C-N 115.516 -0.766 . . . . 73.129999999999995 109.251 172.478 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . 0.655 HD22 ' HA ' ' A' ' 22' ' ' LEU . 50.2 mt -60.56 -37.07 80.08 Favored 'General case' 0 N--CA 1.478 0.958 0 O-C-N 123.904 0.752 . . . . 75.439999999999998 112.12 175.112 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 79' ' ' LYS . . . . . 0.467 ' HE2' ' HG2' ' A' ' 75' ' ' GLU . 66.4 mmtt -63.99 -54.79 28.82 Favored 'General case' 0 N--CA 1.476 0.853 0 N-CA-C 108.747 -0.835 . . . . 74.349999999999994 108.747 176.493 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -59.87 -26.95 63.67 Favored Glycine 0 C--N 1.358 1.764 0 O-C-N 124.214 0.946 . . . . 53.409999999999997 113.72 -179.767 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 81' ' ' LEU . . . . . 0.522 HD23 ' HH2' ' A' ' 30' ' ' TRP . 8.5 tt -77.91 -40.71 38.94 Favored 'General case' 0 CA--C 1.545 0.76 0 C-N-CA 124.258 1.023 . . . . 71.209999999999994 109.755 179.711 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 58.1 mt . . . . . 0 N--CA 1.478 0.968 0 C-N-CA 122.447 0.299 . . . . 72.340000000000003 111.435 -178.624 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 92' ' ' LEU . . . . . 0.508 HD12 ' HE ' ' A' ' 98' ' ' ARG . 11.2 mt . . . . . 0 N--CA 1.483 1.191 0 CA-C-O 121.505 0.669 . . . . 74.129999999999995 110.437 . . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 65.5 mt -148.87 -51.46 0.08 OUTLIER 'Isoleucine or valine' 0 N--CA 1.476 0.839 0 N-CA-C 106.179 -1.785 . . . . 62.439999999999998 106.179 -164.93 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -131.63 -175.74 14.12 Favored Glycine 0 C--N 1.352 1.426 0 CA-C-N 114.032 -1.44 . . . . 63.039999999999999 112.568 -178.627 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 34.9 tt0 -74.15 -71.25 0.34 Allowed 'General case' 0 N--CA 1.473 0.719 0 C-N-CA 125.145 1.378 . . . . 72.510000000000005 111.708 -170.829 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 33.4 p -94.66 10.78 33.58 Favored 'General case' 0 C--O 1.241 0.609 0 C-N-CA 123.428 0.691 . . . . 75.319999999999993 111.63 -173.869 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 88.4 m -52.59 -39.51 61.67 Favored 'General case' 0 C--N 1.361 1.071 0 C-N-CA 124.544 1.138 . . . . 60.130000000000003 111.976 177.833 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 98' ' ' ARG . . . . . 0.883 HH12 HD21 ' A' ' 102' ' ' LEU . 4.0 tpm_? -56.89 -61.68 2.27 Favored 'General case' 0 N--CA 1.469 0.515 0 C-N-CA 123.275 0.63 . . . . 74.120000000000005 112.039 -168.145 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 8.4 tt0 -83.66 -42.57 16.52 Favored 'General case' 0 CA--C 1.534 0.362 0 CA-C-N 115.063 -0.972 . . . . 71.519999999999996 110.28 -169.526 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 8.0 tmtm? -62.81 -55.61 24.8 Favored 'General case' 0 N--CA 1.476 0.835 0 O-C-N 124.106 0.879 . . . . 73.430000000000007 109.529 -177.332 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 46.6 t -72.79 -35.37 67.38 Favored 'General case' 0 N--CA 1.478 0.931 0 CA-C-O 118.622 -0.704 . . . . 74.340000000000003 111.916 -174.896 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 102' ' ' LEU . . . . . 0.883 HD21 HH12 ' A' ' 98' ' ' ARG . 21.6 tp -67.96 -47.35 68.87 Favored 'General case' 0 C--N 1.368 1.402 0 CA-C-N 118.93 0.786 . . . . 75.340000000000003 111.212 179.748 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 59.7 t30 -74.08 -24.35 59.48 Favored 'General case' 0 N--CA 1.478 0.93 0 CA-C-N 115.796 -0.638 . . . . 74.120000000000005 110.792 -178.754 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 104' ' ' ASN . . . . . 0.417 ' O ' ' HG2' ' A' ' 108' ' ' ARG . 7.7 t30 -71.13 -39.16 72.16 Favored 'General case' 0 N--CA 1.479 1.016 0 C-N-CA 122.531 0.332 . . . . 75.209999999999994 110.223 170.781 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -63.09 -37.92 89.13 Favored 'General case' 0 N--CA 1.483 1.2 0 C-N-CA 123.047 0.539 . . . . 54.520000000000003 110.306 178.204 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 106' ' ' TYR . . . . . 0.469 ' HE2' ' HB2' ' A' ' 69' ' ' LYS . 3.5 t80 -57.93 -52.07 67.01 Favored 'General case' 0 C--N 1.356 0.876 0 CA-C-N 114.941 -1.027 . . . . 75.400000000000006 108.973 168.85 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -60.51 -31.95 76.29 Favored Glycine 0 C--N 1.352 1.423 0 O-C-N 124.056 0.848 . . . . 75.340000000000003 113.673 -176.235 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 108' ' ' ARG . . . . . 0.417 ' HG2' ' O ' ' A' ' 104' ' ' ASN . 5.1 mmp_? -76.69 -36.42 57.26 Favored 'General case' 0 C--N 1.344 0.344 0 N-CA-C 109.259 -0.645 . . . . 73.310000000000002 109.259 177.871 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 42.1 tp -68.75 -30.69 69.35 Favored 'General case' 0 N--CA 1.489 1.489 0 C-N-CA 123.015 0.526 . . . . 73.120000000000005 111.152 177.235 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 38.5 t -77.66 -39.04 46.34 Favored 'General case' 0 CA--C 1.543 0.699 0 CA-C-N 115.014 -0.994 . . . . 72.019999999999996 109.584 178.105 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . -90.07 -64.03 1.25 Allowed Glycine 0 C--N 1.36 1.904 0 CA-C-O 119.571 -0.572 . . . . 72.109999999999999 114.272 -177.36 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 112' ' ' MET . . . . . . . . . . . . . 11.2 tpt -96.79 -70.56 0.71 Allowed 'General case' 0 N--CA 1.489 1.501 0 CA-C-N 118.104 0.952 . . . . 74.510000000000005 113.272 -178.548 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 113' ' ' LEU . . . . . 0.413 ' HG ' HG23 ' A' ' 52' ' ' THR . 22.0 tp 170.11 41.69 0.0 OUTLIER 'General case' 0 N--CA 1.495 1.822 0 C-N-CA 124.195 0.998 . . . . 75.439999999999998 109.389 -177.125 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 5.3 tt . . . . . 0 N--CA 1.504 2.248 0 C-N-CA 126.36 1.864 . . . . 74.549999999999997 111.575 179.668 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 25.5 ptm . . . . . 0 N--CA 1.482 1.167 0 N-CA-C 110.621 -0.14 . . . . 72.329999999999998 110.621 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 40.3 p -57.06 -46.32 82.54 Favored 'General case' 0 N--CA 1.479 0.996 0 C-N-CA 123.802 0.841 . . . . 71.099999999999994 112.356 -175.784 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 23.5 m -70.79 -25.42 62.87 Favored 'General case' 0 N--CA 1.473 0.724 0 C-N-CA 123.265 0.626 . . . . 65.129999999999995 111.331 -179.518 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 25.5 m -75.56 -40.63 56.48 Favored 'General case' 0 C--N 1.35 0.602 0 C-N-CA 123.426 0.691 . . . . 64.329999999999998 110.839 178.1 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 92.8 t -67.85 -34.9 70.15 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.849 0 C-N-CA 123.543 0.737 . . . . 73.140000000000001 109.538 175.285 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 6' ' ' GLU . . . . . 0.509 ' O ' ' HG3' ' A' ' 10' ' ' ARG . 10.5 tm-20 -71.91 -32.32 67.27 Favored 'General case' 0 N--CA 1.472 0.668 0 C-N-CA 124.179 0.992 . . . . 72.109999999999999 110.226 176.504 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 7' ' ' PHE . . . . . 0.409 ' O ' ' HB2' ' A' ' 10' ' ' ARG . 62.3 t80 -70.68 -43.48 69.0 Favored 'General case' 0 N--CA 1.48 1.03 0 C-N-CA 123.871 0.868 . . . . 64.5 110.72 177.47 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 8' ' ' ILE . . . . . 0.515 HD11 HG22 ' A' ' 60' ' ' ILE . 84.5 mt -62.34 -39.21 83.38 Favored 'Isoleucine or valine' 0 C--O 1.212 -0.898 0 N-CA-C 109.178 -0.675 . . . . 75.140000000000001 109.178 173.326 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 3.3 t-20 -61.09 -38.03 84.81 Favored 'General case' 0 N--CA 1.483 1.177 0 C-N-CA 124.043 0.937 . . . . 73.209999999999994 111.086 175.866 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . 0.533 ' HB3' HG22 ' A' ' 47' ' ' VAL . 73.4 mtt180 -56.77 -53.77 53.94 Favored 'General case' 0 N--CA 1.475 0.811 0 O-C-N 123.82 0.7 . . . . 75.230000000000004 109.925 174.625 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 11' ' ' TRP . . . . . 0.407 ' CD1' HG11 ' A' ' 64' ' ' VAL . 99.7 m95 -75.59 -23.27 56.45 Favored 'General case' 0 N--CA 1.471 0.58 0 CA-C-N 114.918 -1.037 . . . . 75.540000000000006 113.107 -176.062 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 51.4 mt-30 -62.88 -46.7 86.6 Favored 'General case' 0 N--CA 1.47 0.556 0 N-CA-C 108.134 -1.061 . . . . 75.530000000000001 108.134 169.841 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 10.9 tpt180 -63.99 -48.39 76.58 Favored 'General case' 0 CA--C 1.54 0.59 0 CA-C-N 114.695 -1.139 . . . . 73.25 111.226 -175.721 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 14' ' ' ILE . . . . . 0.471 HD13 HG13 ' A' ' 44' ' ' ILE . 48.2 mt -64.62 -48.91 82.83 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.316 0 O-C-N 123.194 0.309 . . . . 71.25 110.287 -179.978 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . 0.576 ' HA ' ' HB ' ' A' ' 71' ' ' THR . . . -54.41 -45.56 72.97 Favored 'General case' 0 C--N 1.36 1.046 0 O-C-N 123.983 0.802 . . . . 74.299999999999997 111.163 -178.969 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 84.4 mt -78.73 -36.52 43.11 Favored 'General case' 0 N--CA 1.476 0.858 0 CA-C-N 114.989 -1.005 . . . . 55.340000000000003 112.124 -174.311 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . 0.436 ' O ' ' HG ' ' A' ' 21' ' ' LEU . 64.3 mt -67.54 -45.36 75.91 Favored 'General case' 0 N--CA 1.487 1.375 0 CA-C-N 118.057 0.39 . . . . 71.349999999999994 110.395 179.813 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 77.8 p -67.49 -37.25 82.58 Favored 'General case' 0 N--CA 1.477 0.901 0 C-N-CA 123.211 0.604 . . . . 74.109999999999999 110.79 176.794 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 6.9 tp-100 -61.13 -42.29 98.27 Favored 'General case' 0 C--N 1.357 0.906 0 O-C-N 123.701 0.626 . . . . 70.319999999999993 110.612 175.407 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 69.2 m -60.31 -49.5 77.36 Favored 'General case' 0 C--N 1.347 0.461 0 O-C-N 124.069 0.856 . . . . 73.420000000000002 109.686 176.37 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . 0.706 HD23 ' HA ' ' A' ' 33' ' ' LEU . 26.2 mt -61.36 -33.36 73.5 Favored 'General case' 0 CA--C 1.547 0.85 0 O-C-N 124.014 0.821 . . . . 71.310000000000002 110.917 -178.919 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . 0.71 ' HA ' HD22 ' A' ' 78' ' ' LEU . 56.0 tp -67.29 -54.01 24.62 Favored 'General case' 0 N--CA 1.482 1.139 0 C-N-CA 123.271 0.629 . . . . 73.409999999999997 110.692 179.74 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 42.5 mt-10 -56.53 -49.6 74.32 Favored 'General case' 0 N--CA 1.474 0.752 0 C-N-CA 124.335 1.054 . . . . 73.140000000000001 110.735 178.95 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . 0.407 HD23 HD12 ' A' ' 32' ' ' LEU . 91.5 mt -67.24 -33.74 75.98 Favored 'General case' 0 C--O 1.217 -0.62 0 CA-C-N 114.987 -1.006 . . . . 75.310000000000002 111.21 -176.133 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . 0.492 ' HB3' HD23 ' A' ' 33' ' ' LEU . . . -67.65 -42.62 81.92 Favored 'General case' 0 N--CA 1.483 1.208 0 C-N-CA 122.867 0.467 . . . . 74.420000000000002 111.594 177.699 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 97.1 mt-30 -70.97 -23.86 62.3 Favored 'General case' 0 N--CA 1.475 0.812 0 CA-C-N 115.532 -0.758 . . . . 73.299999999999997 111.069 176.678 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 79.0 mtt180 -78.68 -21.13 48.67 Favored 'General case' 0 N--CA 1.479 0.999 0 C-N-CA 123.562 0.745 . . . . 74.200000000000003 110.588 170.71 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 91.77 9.55 62.52 Favored Glycine 0 C--N 1.348 1.216 0 C-N-CA 123.05 0.357 . . . . 72.340000000000003 113.332 179.485 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 18.6 mm-40 -82.81 61.27 5.78 Favored 'General case' 0 CA--C 1.547 0.828 0 C-N-CA 124.622 1.169 . . . . 75.219999999999999 110.687 177.775 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 30' ' ' TRP . . . . . 0.402 ' O ' ' HG ' ' A' ' 34' ' ' LEU . 59.6 m95 -63.91 -29.71 70.86 Favored 'General case' 0 N--CA 1.484 1.25 0 C-N-CA 123.863 0.865 . . . . 74.209999999999994 110.999 -176.788 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 -56.21 -47.31 78.65 Favored 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 124.265 1.026 . . . . 64.310000000000002 110.287 175.718 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . 0.407 HD12 HD23 ' A' ' 24' ' ' LEU . 35.5 mt -64.59 -31.03 72.07 Favored 'General case' 0 N--CA 1.474 0.733 0 CA-C-N 115.16 -0.927 . . . . 72.0 110.927 -179.0 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . 0.706 ' HA ' HD23 ' A' ' 21' ' ' LEU . 10.5 mp -62.42 -49.01 77.19 Favored 'General case' 0 N--CA 1.477 0.884 0 N-CA-C 109.76 -0.459 . . . . 71.329999999999998 109.76 171.554 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . 0.402 ' HG ' ' O ' ' A' ' 30' ' ' TRP . 80.5 mt -58.01 -41.47 83.19 Favored 'General case' 0 N--CA 1.484 1.257 0 O-C-N 123.856 0.722 . . . . 74.150000000000006 112.397 -177.195 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 1.4 mp0 -73.81 -56.55 4.84 Favored 'General case' 0 N--CA 1.488 1.438 0 C-N-CA 122.859 0.464 . . . . 74.439999999999998 111.778 178.572 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 84.7 mm-40 -66.04 -19.71 65.94 Favored 'General case' 0 N--CA 1.488 1.46 0 C-N-CA 122.965 0.506 . . . . 74.549999999999997 111.793 -175.205 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . 0.456 ' O ' ' HG ' ' A' ' 41' ' ' LEU . 22.7 tt0 -60.02 -36.98 78.43 Favored 'General case' 0 C--N 1.358 0.969 0 C-N-CA 123.291 0.636 . . . . 73.099999999999994 111.277 179.578 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 62.2 t -53.1 -48.95 52.62 Favored 'Isoleucine or valine' 0 CA--C 1.556 1.182 0 C-N-CA 123.341 0.656 . . . . 74.340000000000003 110.764 -179.24 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 70.9 m -72.65 -33.2 66.43 Favored 'General case' 0 CA--C 1.537 0.444 0 CA-C-N 115.129 -0.941 . . . . 74.120000000000005 111.617 177.618 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 33.2 t80 -62.12 -40.75 96.97 Favored 'General case' 0 N--CA 1.481 1.08 0 C-N-CA 122.786 0.434 . . . . 73.150000000000006 110.984 176.24 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . 0.456 ' HG ' ' O ' ' A' ' 37' ' ' GLU . 56.0 mt -69.74 -52.78 22.43 Favored 'General case' 0 C--O 1.245 0.857 0 C-N-CA 123.953 0.901 . . . . 72.140000000000001 109.859 -178.28 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 53.2 tt0 -55.81 -49.97 71.8 Favored 'General case' 0 C--N 1.358 0.954 0 CA-C-N 114.882 -1.054 . . . . 73.510000000000005 110.832 -179.112 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 43' ' ' SER . . . . . 0.521 ' O ' HG21 ' A' ' 47' ' ' VAL . 66.1 m -60.94 -56.28 22.93 Favored 'General case' 0 C--N 1.348 0.541 0 O-C-N 123.991 0.807 . . . . 70.540000000000006 111.055 -178.78 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 44' ' ' ILE . . . . . 0.589 HG12 ' HE1' ' A' ' 48' ' ' MET . 11.9 tt -58.97 -42.77 87.09 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.192 0 O-C-N 123.692 0.62 . . . . 74.340000000000003 111.558 -171.806 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . 0.441 ' HG2' HD22 ' A' ' 92' ' ' LEU . 54.9 mm-40 -63.65 -44.96 92.3 Favored 'General case' 0 C--N 1.359 0.99 0 C-N-CA 122.705 0.402 . . . . 75.109999999999999 111.039 177.263 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 46' ' ' THR . . . . . 0.409 HG21 ' HZ1' ' A' ' 50' ' ' LYS . 99.2 m -55.93 -42.58 76.33 Favored 'General case' 0 N--CA 1.479 1.003 0 O-C-N 123.638 0.586 . . . . 75.530000000000001 111.248 177.55 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 47' ' ' VAL . . . . . 0.533 HG22 ' HB3' ' A' ' 10' ' ' ARG . 96.2 t -63.67 -46.45 94.69 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.701 0 C-N-CA 124.018 0.927 . . . . 75.040000000000006 111.074 -179.579 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 48' ' ' MET . . . . . 0.589 ' HE1' HG12 ' A' ' 44' ' ' ILE . 77.2 mtm -71.52 -25.89 62.43 Favored 'General case' 0 N--CA 1.478 0.939 0 CA-C-N 115.432 -0.804 . . . . 72.310000000000002 112.469 -176.55 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 54.9 mt-10 -94.3 -18.79 21.28 Favored 'General case' 0 N--CA 1.485 1.284 0 N-CA-C 112.544 0.572 . . . . 72.310000000000002 112.544 179.605 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . 0.409 ' HZ1' HG21 ' A' ' 46' ' ' THR . 1.3 mptm? -91.38 146.33 23.9 Favored 'General case' 0 N--CA 1.483 1.213 0 C-N-CA 122.981 0.512 . . . . 75.140000000000001 109.861 179.387 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 4.9 pt20 -70.75 143.54 51.21 Favored 'General case' 0 CA--C 1.537 0.479 0 C-N-CA 123.503 0.721 . . . . 74.239999999999995 112.806 -167.888 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 95.2 m -80.16 118.26 71.58 Favored Pre-proline 0 CA--C 1.55 0.949 0 C-N-CA 124.413 1.085 . . . . 74.219999999999999 108.735 172.007 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 31.8 Cg_endo -61.99 153.37 69.18 Favored 'Trans proline' 0 C--N 1.374 1.884 0 C-N-CA 122.28 1.987 . . . . 74.319999999999993 112.14 -179.266 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 45.6 Cg_endo -68.27 -46.86 1.88 Allowed 'Trans proline' 0 C--N 1.371 1.757 0 C-N-CA 122.612 2.208 . . . . 62.119999999999997 112.216 179.236 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . -74.24 79.4 0.91 Allowed Glycine 0 C--N 1.349 1.28 0 O-C-N 123.591 0.557 . . . . 72.409999999999997 113.23 -176.571 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 56' ' ' ILE . . . . . 0.452 ' HB ' HD21 ' A' ' 113' ' ' LEU . 66.9 mt -128.49 107.84 16.56 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.79 0 C-N-CA 124.858 1.263 . . . . 74.239999999999995 107.704 175.554 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 38.4 p -82.4 -178.44 7.05 Favored 'General case' 0 CA--C 1.542 0.662 0 C-N-CA 123.506 0.722 . . . . 64.420000000000002 110.989 -179.678 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 25.1 tpt180 -53.71 -55.61 24.6 Favored 'General case' 0 N--CA 1.475 0.802 0 C-N-CA 124.892 1.277 . . . . 74.329999999999998 111.884 -177.329 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 17.5 m -59.6 -40.31 87.06 Favored 'General case' 0 N--CA 1.478 0.954 0 O-C-N 123.782 0.676 . . . . 74.430000000000007 112.107 -177.542 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 60' ' ' ILE . . . . . 0.515 HG22 HD11 ' A' ' 8' ' ' ILE . 66.4 mt -66.42 -40.8 87.52 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.75 0 O-C-N 123.941 0.775 . . . . 74.439999999999998 110.61 178.625 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 61.1 tt0 -64.17 -38.62 91.73 Favored 'General case' 0 CA--C 1.543 0.711 0 C-N-CA 124.288 1.035 . . . . 75.120000000000005 110.524 -179.049 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 43.4 m-20 -72.8 -38.14 67.32 Favored 'General case' 0 N--CA 1.476 0.868 0 CA-C-N 115.661 -0.699 . . . . 71.439999999999998 111.731 177.815 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 63' ' ' MET . . . . . . . . . . . . . 74.1 mtm -65.23 -48.23 74.04 Favored 'General case' 0 N--CA 1.486 1.327 0 C-N-CA 122.291 0.236 . . . . 72.439999999999998 110.963 177.841 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 64' ' ' VAL . . . . . 0.498 ' O ' HG13 ' A' ' 68' ' ' ILE . 75.7 t -61.87 -55.93 21.06 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.589 0 C-N-CA 123.554 0.742 . . . . 65.010000000000005 110.729 179.188 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -63.59 -27.36 69.19 Favored 'General case' 0 N--CA 1.485 1.32 0 C-N-CA 122.416 0.286 . . . . 74.540000000000006 111.368 -179.396 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -67.23 -40.11 92.28 Favored Glycine 0 C--N 1.349 1.271 0 O-C-N 123.66 0.6 . . . . 51.420000000000002 112.063 174.677 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 18.6 m-30 -71.39 -35.44 71.04 Favored 'General case' 0 N--CA 1.472 0.656 0 C-N-CA 123.499 0.72 . . . . 73.230000000000004 111.624 176.866 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 68' ' ' ILE . . . . . 0.511 ' O ' ' HG ' ' A' ' 72' ' ' LEU . 20.3 mt -63.55 -48.92 84.72 Favored 'Isoleucine or valine' 0 C--N 1.358 0.947 0 N-CA-C 108.162 -1.051 . . . . 74.019999999999996 108.162 176.541 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 69' ' ' LYS . . . . . 0.537 ' HB2' ' HE2' ' A' ' 106' ' ' TYR . 46.6 tptt -53.74 -47.71 70.36 Favored 'General case' 0 N--CA 1.481 1.079 0 C-N-CA 124.239 1.016 . . . . 71.450000000000003 110.879 176.76 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 62.4 tt0 -60.99 -46.04 92.37 Favored 'General case' 0 CA--C 1.535 0.39 0 O-C-N 124.094 0.871 . . . . 73.120000000000005 110.97 -177.638 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 71' ' ' THR . . . . . 0.576 ' HB ' ' HA ' ' A' ' 15' ' ' ALA . 13.1 t -79.16 -21.29 46.66 Favored 'General case' 0 C--N 1.352 0.683 0 CA-C-O 118.904 -0.57 . . . . 72.319999999999993 111.45 -176.017 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 72' ' ' LEU . . . . . 0.511 ' HG ' ' O ' ' A' ' 68' ' ' ILE . 25.2 mt -75.98 -31.72 59.13 Favored 'General case' 0 N--CA 1.486 1.354 0 N-CA-C 109.802 -0.444 . . . . 72.010000000000005 109.802 173.385 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 97.8 m-20 -70.33 -51.12 32.44 Favored 'General case' 0 N--CA 1.469 0.491 0 O-C-N 123.744 0.652 . . . . 73.420000000000002 109.842 174.723 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 67.4 m-20 -57.35 -42.96 83.0 Favored 'General case' 0 N--CA 1.479 0.997 0 O-C-N 123.96 0.788 . . . . 73.329999999999998 109.912 178.314 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 53.5 tp10 -58.54 -56.37 23.03 Favored 'General case' 0 N--CA 1.473 0.68 0 C-N-CA 124.494 1.117 . . . . 75.120000000000005 110.712 177.202 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 10.1 tt0 -65.67 -39.05 90.91 Favored 'General case' 0 N--CA 1.477 0.897 0 C-N-CA 122.724 0.41 . . . . 72.510000000000005 111.786 -174.441 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 92.9 mt -64.58 -47.74 77.55 Favored 'General case' 0 N--CA 1.478 0.934 0 C-N-CA 123.349 0.66 . . . . 75.219999999999999 110.524 179.881 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . 0.71 HD22 ' HA ' ' A' ' 22' ' ' LEU . 42.5 mt -61.01 -61.86 2.27 Favored 'General case' 0 N--CA 1.482 1.128 0 C-N-CA 123.968 0.907 . . . . 73.209999999999994 111.985 178.68 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 43.9 mmtm -67.17 -38.04 84.75 Favored 'General case' 0 CA--C 1.543 0.679 0 CA-C-N 113.872 -1.513 . . . . 74.400000000000006 110.356 -171.563 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -68.94 -29.69 72.44 Favored Glycine 0 C--N 1.343 0.939 0 CA-C-N 115.822 -0.626 . . . . 71.109999999999999 113.037 175.957 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 8.5 tt -63.14 -44.79 94.56 Favored 'General case' 0 N--CA 1.475 0.81 0 N-CA-C 109.044 -0.725 . . . . 71.010000000000005 109.044 171.016 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 82' ' ' LEU . . . . . 0.425 ' HG ' ' O ' ' A' ' 78' ' ' LEU . 67.4 mt . . . . . 0 N--CA 1.477 0.875 0 O-C-N 123.663 0.602 . . . . 72.099999999999994 110.497 -178.411 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 92' ' ' LEU . . . . . 0.441 HD22 ' HG2' ' A' ' 45' ' ' GLU . 40.5 mt . . . . . 0 N--CA 1.478 0.944 0 N-CA-C 109.598 -0.519 . . . . 74.430000000000007 109.598 . . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 93' ' ' ILE . . . . . 0.478 ' HB ' ' HA ' ' A' ' 97' ' ' THR . 35.2 mt -120.44 146.39 25.38 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.06 0 C-N-CA 124.093 0.957 . . . . 72.450000000000003 109.072 -177.755 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -64.46 126.7 33.46 Favored Glycine 0 C--N 1.344 0.988 0 O-C-N 123.316 0.385 . . . . 63.219999999999999 112.585 177.09 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 17.4 mt-30 66.18 -85.76 0.03 OUTLIER 'General case' 0 N--CA 1.477 0.905 0 C-N-CA 125.038 1.335 . . . . 73.299999999999997 111.584 179.247 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 22.7 m -92.39 102.94 15.42 Favored 'General case' 0 N--CA 1.467 0.384 0 C-N-CA 123.547 0.739 . . . . 61.020000000000003 109.624 -177.908 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 97' ' ' THR . . . . . 0.586 HG23 ' H ' ' A' ' 99' ' ' GLN . 97.1 m -93.16 155.64 17.34 Favored 'General case' 0 CA--C 1.55 0.949 0 C-N-CA 123.869 0.868 . . . . 75.129999999999995 109.916 173.036 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 30.7 mmt180 -58.16 -13.26 4.56 Favored 'General case' 0 CA--C 1.556 1.181 0 C-N-CA 125.291 1.436 . . . . 72.340000000000003 113.016 175.554 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 99' ' ' GLN . . . . . 0.586 ' H ' HG23 ' A' ' 97' ' ' THR . 12.5 pt20 -57.89 -29.8 65.34 Favored 'General case' 0 N--CA 1.491 1.601 0 C-N-CA 124.34 1.056 . . . . 74.430000000000007 112.069 176.444 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 27.5 ttpp -68.3 -46.47 70.21 Favored 'General case' 0 N--CA 1.478 0.944 0 N-CA-C 109.061 -0.718 . . . . 74.219999999999999 109.061 173.65 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 48.7 m -72.1 -12.68 61.31 Favored 'General case' 0 N--CA 1.479 1.011 0 C-N-CA 124.307 1.043 . . . . 70.299999999999997 111.941 174.897 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 102' ' ' LEU . . . . . 0.545 HD12 ' SD ' ' A' ' 48' ' ' MET . 24.7 tp -76.49 -48.26 20.11 Favored 'General case' 0 N--CA 1.483 1.188 0 C-N-CA 124.751 1.22 . . . . 75.319999999999993 109.19 177.098 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 9.2 t30 -65.53 -37.87 87.99 Favored 'General case' 0 CA--C 1.553 1.087 0 CA-C-N 114.672 -1.149 . . . . 72.25 110.536 173.433 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 104' ' ' ASN . . . . . 0.406 ' O ' ' HG2' ' A' ' 108' ' ' ARG . 24.5 t-20 -70.03 -32.54 70.74 Favored 'General case' 0 N--CA 1.478 0.947 0 CA-C-N 115.611 -0.722 . . . . 63.409999999999997 110.936 175.952 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -63.69 -40.23 96.29 Favored 'General case' 0 N--CA 1.48 1.072 0 C-N-CA 123.572 0.749 . . . . 75.140000000000001 110.165 175.853 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 106' ' ' TYR . . . . . 0.537 ' HE2' ' HB2' ' A' ' 69' ' ' LYS . 2.9 t80 -57.34 -51.97 67.24 Favored 'General case' 0 C--N 1.353 0.758 0 O-C-N 124.274 0.983 . . . . 71.510000000000005 109.443 172.016 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -53.19 -55.01 26.4 Favored Glycine 0 C--N 1.353 1.49 0 O-C-N 124.133 0.896 . . . . 42.509999999999998 114.204 -177.179 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 108' ' ' ARG . . . . . 0.625 ' HG3' ' HA ' ' A' ' 114' ' ' LEU . 17.2 ptp180 -66.6 -31.43 72.12 Favored 'General case' 0 CA--C 1.548 0.897 0 C-N-CA 123.295 0.638 . . . . 75.319999999999993 111.905 178.983 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 109' ' ' LEU . . . . . 0.518 ' HA ' ' N ' ' A' ' 114' ' ' LEU . 56.4 tp -68.05 -45.81 72.87 Favored 'General case' 0 N--CA 1.484 1.247 0 C-N-CA 122.645 0.378 . . . . 75.420000000000002 111.096 176.505 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 11.6 t -72.23 -29.54 64.04 Favored 'General case' 0 CA--C 1.54 0.595 0 CA-C-N 115.344 -0.843 . . . . 44.539999999999999 109.84 -174.659 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . -88.03 -62.96 1.4 Allowed Glycine 0 C--N 1.36 1.905 0 CA-C-O 119.364 -0.687 . . . . 72.420000000000002 113.844 -179.928 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 112' ' ' MET . . . . . . . . . . . . . 1.0 OUTLIER -98.99 -69.92 0.75 Allowed 'General case' 0 N--CA 1.485 1.31 0 CA-C-N 118.622 1.211 . . . . 74.450000000000003 112.065 177.576 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 113' ' ' LEU . . . . . 0.452 HD21 ' HB ' ' A' ' 56' ' ' ILE . 0.9 OUTLIER 163.29 51.2 0.0 OUTLIER 'General case' 0 N--CA 1.497 1.899 0 C-N-CA 125.746 1.618 . . . . 75.519999999999996 108.228 -174.322 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 114' ' ' LEU . . . . . 0.625 ' HA ' ' HG3' ' A' ' 108' ' ' ARG . 0.3 OUTLIER . . . . . 0 N--CA 1.487 1.414 0 C-N-CA 125.574 1.55 . . . . 74.310000000000002 112.934 171.221 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 23.5 ttt . . . . . 0 N--CA 1.488 1.439 0 CA-C-O 119.475 -0.298 . . . . 73.25 111.326 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 27.2 p -47.13 -39.02 12.61 Favored 'General case' 0 N--CA 1.497 1.885 0 N-CA-C 113.634 0.975 . . . . 74.140000000000001 113.634 -174.25 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 16.6 m -65.19 -45.35 85.16 Favored 'General case' 0 N--CA 1.478 0.932 0 C-N-CA 123.249 0.62 . . . . 73.109999999999999 111.464 178.384 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 4' ' ' THR . . . . . 0.518 ' HA ' ' HG3' ' A' ' 53' ' ' PRO . 5.2 m -70.96 -37.21 72.78 Favored 'General case' 0 N--CA 1.476 0.863 0 C-N-CA 123.351 0.66 . . . . 65.319999999999993 111.822 179.947 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 69.9 t -62.1 -47.58 92.48 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.84 0 C-N-CA 123.258 0.623 . . . . 74.310000000000002 109.758 178.529 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 44.9 mm-40 -57.27 -51.72 68.21 Favored 'General case' 0 N--CA 1.473 0.718 0 CA-C-N 115.778 -0.646 . . . . 54.109999999999999 110.927 172.205 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 40.7 t80 -57.32 -50.3 73.36 Favored 'General case' 0 CA--C 1.552 1.024 0 C-N-CA 124.197 0.999 . . . . 74.239999999999995 111.849 -173.853 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 8' ' ' ILE . . . . . 0.407 ' O ' ' HG3' ' A' ' 12' ' ' GLN . 83.6 mt -62.38 -46.25 96.87 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.065 0 C-N-CA 123.977 0.911 . . . . 71.349999999999994 110.237 177.337 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 25.1 t-20 -67.09 -27.69 67.57 Favored 'General case' 0 N--CA 1.486 1.351 0 C-N-CA 123.781 0.833 . . . . 73.120000000000005 112.032 -176.441 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . 0.459 ' O ' HG13 ' A' ' 14' ' ' ILE . 96.5 mtt180 -76.23 -38.41 56.39 Favored 'General case' 0 N--CA 1.469 0.484 0 N-CA-C 109.041 -0.726 . . . . 74.209999999999994 109.041 175.325 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 11' ' ' TRP . . . . . 0.518 ' HH2' ' HG ' ' A' ' 102' ' ' LEU . 57.0 m95 -67.42 -29.65 69.19 Favored 'General case' 0 N--CA 1.484 1.274 0 C-N-CA 123.055 0.542 . . . . 75.120000000000005 111.696 172.152 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . 0.407 ' HG3' ' O ' ' A' ' 8' ' ' ILE . 52.7 mt-30 -64.08 -49.45 72.2 Favored 'General case' 0 N--CA 1.472 0.65 0 N-CA-C 107.671 -1.233 . . . . 74.129999999999995 107.671 171.773 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 53.5 ttt180 -60.85 -43.25 98.59 Favored 'General case' 0 CA--C 1.548 0.898 0 CA-C-N 114.996 -1.002 . . . . 75.5 111.382 -176.303 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 14' ' ' ILE . . . . . 0.459 HG13 ' O ' ' A' ' 10' ' ' ARG . 64.2 mt -66.52 -47.41 83.74 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.388 0 C-N-CA 122.731 0.412 . . . . 74.209999999999994 109.899 178.782 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . 0.599 ' HA ' ' HB ' ' A' ' 71' ' ' THR . . . -58.63 -43.71 89.8 Favored 'General case' 0 N--CA 1.486 1.343 0 C-N-CA 123.888 0.875 . . . . 72.310000000000002 111.824 -179.53 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 96.4 mt -81.83 -34.55 30.13 Favored 'General case' 0 N--CA 1.483 1.176 0 CA-C-N 114.613 -1.176 . . . . 74.030000000000001 111.112 -173.591 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . 0.466 ' O ' ' HG ' ' A' ' 21' ' ' LEU . 25.3 mt -65.18 -51.76 59.06 Favored 'General case' 0 N--CA 1.486 1.352 0 N-CA-C 109.589 -0.523 . . . . 75.230000000000004 109.589 176.0 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 80.9 p -63.6 -37.32 86.9 Favored 'General case' 0 N--CA 1.48 1.028 0 C-N-CA 123.389 0.675 . . . . 74.299999999999997 111.557 -179.484 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 6.4 tp-100 -58.58 -50.14 74.91 Favored 'General case' 0 N--CA 1.476 0.866 0 O-C-N 123.613 0.57 . . . . 75.420000000000002 110.582 173.685 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 70.9 m -58.0 -49.91 75.21 Favored 'General case' 0 C--O 1.207 -1.161 0 CA-C-N 115.167 -0.924 . . . . 74.25 110.18 176.923 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . 0.578 HD22 ' HA ' ' A' ' 33' ' ' LEU . 92.4 mt -63.21 -29.88 71.14 Favored 'General case' 0 N--CA 1.474 0.772 0 C-N-CA 123.783 0.833 . . . . 74.409999999999997 111.393 -175.627 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . 0.565 ' HA ' HD22 ' A' ' 78' ' ' LEU . 58.9 tp -68.56 -53.95 19.69 Favored 'General case' 0 C--O 1.252 1.19 0 C-N-CA 123.063 0.545 . . . . 62.030000000000001 110.221 176.903 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . 0.534 ' HB3' ' HE ' ' A' ' 27' ' ' ARG . 46.1 mt-10 -55.37 -51.2 67.58 Favored 'General case' 0 N--CA 1.475 0.798 0 CA-C-N 114.775 -1.102 . . . . 75.329999999999998 110.024 177.749 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . 0.42 HD22 HD11 ' A' ' 32' ' ' LEU . 95.4 mt -60.6 -39.73 89.21 Favored 'General case' 0 N--CA 1.476 0.873 0 C-N-CA 125.382 1.473 . . . . 72.099999999999994 111.589 -176.683 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . 0.498 ' HB3' HD21 ' A' ' 33' ' ' LEU . . . -59.76 -48.87 79.95 Favored 'General case' 0 N--CA 1.481 1.106 0 C-N-CA 123.097 0.559 . . . . 74.109999999999999 110.823 176.168 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 95.6 mt-30 -66.63 -30.38 70.64 Favored 'General case' 0 CA--C 1.552 1.049 0 CA-C-N 114.901 -1.045 . . . . 65.400000000000006 111.633 178.919 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 27' ' ' ARG . . . . . 0.534 ' HE ' ' HB3' ' A' ' 23' ' ' GLU . 44.5 mtt-85 -76.28 -25.45 54.92 Favored 'General case' 0 N--CA 1.488 1.448 0 C-N-CA 123.473 0.709 . . . . 74.219999999999999 110.846 176.856 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 98.18 9.54 53.49 Favored Glycine 0 C--N 1.348 1.221 0 CA-C-N 116.364 -0.38 . . . . 71.219999999999999 113.244 -177.825 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 29' ' ' GLU . . . . . 0.4 ' HB2' ' HB3' ' A' ' 24' ' ' LEU . 12.8 mm-40 -80.13 57.41 2.69 Favored 'General case' 0 CA--C 1.55 0.976 0 C-N-CA 124.508 1.123 . . . . 72.420000000000002 110.482 174.985 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 30' ' ' TRP . . . . . 0.437 ' O ' ' HG ' ' A' ' 34' ' ' LEU . 89.2 m95 -62.0 -35.29 78.08 Favored 'General case' 0 N--CA 1.482 1.169 0 C-N-CA 124.218 1.007 . . . . 73.25 111.51 -175.892 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 6.2 m-20 -54.23 -40.01 67.28 Favored 'General case' 0 N--CA 1.476 0.871 0 C-N-CA 124.766 1.226 . . . . 73.420000000000002 111.51 179.619 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . 0.42 HD11 HD22 ' A' ' 24' ' ' LEU . 87.9 mt -69.1 -31.23 69.8 Favored 'General case' 0 CA--C 1.543 0.685 0 CA-C-N 115.096 -0.956 . . . . 64.319999999999993 110.981 179.112 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . 0.578 ' HA ' HD22 ' A' ' 21' ' ' LEU . 8.5 mp -70.48 -40.3 73.72 Favored 'General case' 0 N--CA 1.491 1.604 0 C-N-CA 122.252 0.221 . . . . 70.519999999999996 110.57 173.051 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . 0.437 ' HG ' ' O ' ' A' ' 30' ' ' TRP . 82.6 mt -65.1 -40.65 94.87 Favored 'General case' 0 N--CA 1.479 0.986 0 C-N-CA 123.648 0.779 . . . . 71.129999999999995 111.364 -176.916 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 1.6 mp0 -80.32 -55.76 4.67 Favored 'General case' 0 N--CA 1.473 0.72 0 C-N-CA 123.429 0.692 . . . . 71.150000000000006 111.197 178.541 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 36' ' ' GLN . . . . . 0.409 ' HB2' HD23 ' A' ' 21' ' ' LEU . 84.1 mm-40 -64.44 -13.08 49.55 Favored 'General case' 0 N--CA 1.494 1.768 0 N-CA-C 113.088 0.773 . . . . 75.010000000000005 113.088 -178.935 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . 0.455 ' O ' ' HG ' ' A' ' 41' ' ' LEU . 43.4 tt0 -47.55 -49.43 26.42 Favored 'General case' 0 N--CA 1.478 0.952 0 C-N-CA 122.914 0.486 . . . . 73.019999999999996 110.454 169.296 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 40.9 t -57.1 -53.75 39.18 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.088 0 O-C-N 124.061 0.851 . . . . 75.219999999999999 111.897 -176.906 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 46.4 p -69.09 -34.17 74.67 Favored 'General case' 0 N--CA 1.483 1.179 0 C-N-CA 122.801 0.44 . . . . 71.340000000000003 111.926 -177.399 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 40.9 t80 -64.9 -42.88 94.4 Favored 'General case' 0 N--CA 1.475 0.815 0 C-N-CA 123.513 0.725 . . . . 74.430000000000007 110.064 176.836 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . 0.455 ' HG ' ' O ' ' A' ' 37' ' ' GLU . 96.6 mt -60.81 -44.35 96.97 Favored 'General case' 0 C--N 1.35 0.627 0 O-C-N 124.192 0.932 . . . . 74.129999999999995 109.856 175.117 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 47.6 tt0 -63.86 -42.6 97.5 Favored 'General case' 0 N--CA 1.473 0.724 0 O-C-N 123.269 0.356 . . . . 74.219999999999999 110.761 -179.246 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 30.9 m -59.82 -53.76 54.2 Favored 'General case' 0 N--CA 1.482 1.156 0 C-N-CA 123.157 0.583 . . . . 72.150000000000006 111.355 -179.047 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 44' ' ' ILE . . . . . 0.516 HG12 ' HE2' ' A' ' 48' ' ' MET . 11.5 tt -66.1 -33.99 67.27 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.054 0 CA-C-N 115.072 -0.967 . . . . 72.329999999999998 111.054 -176.706 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 10.1 mm-40 -64.15 -44.93 90.64 Favored 'General case' 0 N--CA 1.484 1.251 0 C-N-CA 123.119 0.568 . . . . 73.129999999999995 111.307 172.774 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 46' ' ' THR . . . . . 0.422 ' O ' ' HB2' ' A' ' 50' ' ' LYS . 67.7 m -62.8 -34.06 76.49 Favored 'General case' 0 N--CA 1.478 0.932 0 C-N-CA 122.65 0.38 . . . . 75.420000000000002 110.969 -177.882 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 47' ' ' VAL . . . . . . . . . . . . . 58.3 t -71.46 -51.82 30.68 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.021 0 N-CA-C 111.615 0.228 . . . . 64.310000000000002 111.615 175.518 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 48' ' ' MET . . . . . 0.516 ' HE2' HG12 ' A' ' 44' ' ' ILE . 75.6 mtm -67.85 -32.84 73.64 Favored 'General case' 0 N--CA 1.488 1.473 0 N-CA-C 112.899 0.703 . . . . 72.549999999999997 112.899 -172.777 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 49.6 mt-10 -84.02 -34.42 24.29 Favored 'General case' 0 N--CA 1.483 1.198 0 C-N-CA 123.371 0.668 . . . . 64.510000000000005 111.626 -178.632 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . 0.422 ' HB2' ' O ' ' A' ' 46' ' ' THR . 13.8 mptt -79.86 164.08 23.86 Favored 'General case' 0 N--CA 1.483 1.186 0 CA-C-O 121.181 0.515 . . . . 75.25 110.699 -179.677 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 8.9 tt0 -82.83 138.39 33.97 Favored 'General case' 0 C--O 1.241 0.61 0 CA-C-N 115.046 -0.979 . . . . 70.430000000000007 110.65 -172.361 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 52' ' ' THR . . . . . 0.674 HG21 ' HB3' ' A' ' 114' ' ' LEU . 39.1 m -72.29 123.59 89.69 Favored Pre-proline 0 CA--C 1.556 1.187 0 N-CA-C 109.178 -0.675 . . . . 72.140000000000001 109.178 171.914 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 53' ' ' PRO . . . . . 0.518 ' HG3' ' HA ' ' A' ' 4' ' ' THR . 61.7 Cg_endo -69.3 155.46 67.39 Favored 'Trans proline' 0 C--N 1.376 2.01 0 C-N-CA 123.162 2.575 . . . . 74.530000000000001 112.675 -176.664 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 43.9 Cg_endo -67.98 -47.29 1.86 Allowed 'Trans proline' 0 C--N 1.377 2.063 0 C-N-CA 122.367 2.045 . . . . 72.400000000000006 112.258 175.004 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . -69.97 80.1 0.36 Allowed Glycine 0 C--N 1.352 1.46 0 O-C-N 123.566 0.541 . . . . 75.450000000000003 113.656 -175.796 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 77.7 mt -125.86 98.4 4.96 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.526 0 N-CA-C 107.91 -1.144 . . . . 75.450000000000003 107.91 175.085 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 78.5 p -74.45 -179.65 4.12 Favored 'General case' 0 N--CA 1.473 0.712 0 C-N-CA 122.867 0.467 . . . . 72.400000000000006 109.917 175.373 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 21.1 tpt180 -64.99 -40.03 94.35 Favored 'General case' 0 N--CA 1.476 0.828 0 N-CA-C 110.371 -0.233 . . . . 74.109999999999999 110.371 177.79 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 51.9 m -60.25 -45.24 93.94 Favored 'General case' 0 N--CA 1.478 0.953 0 C-N-CA 123.309 0.644 . . . . 62.340000000000003 111.4 177.005 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 60' ' ' ILE . . . . . 0.404 HD11 HG23 ' A' ' 4' ' ' THR . 80.1 mt -64.8 -39.13 84.61 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.971 0 CA-C-N 115.479 -0.782 . . . . 74.019999999999996 110.377 177.272 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 63.2 tt0 -63.18 -41.95 99.28 Favored 'General case' 0 N--CA 1.482 1.143 0 C-N-CA 124.012 0.925 . . . . 73.109999999999999 111.131 179.525 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 52.3 m-20 -69.4 -41.54 76.28 Favored 'General case' 0 N--CA 1.477 0.91 0 C-N-CA 123.163 0.585 . . . . 73.420000000000002 111.503 179.78 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 63' ' ' MET . . . . . . . . . . . . . 64.9 mtm -65.88 -52.3 51.41 Favored 'General case' 0 N--CA 1.485 1.295 0 C-N-CA 122.351 0.26 . . . . 73.540000000000006 111.311 178.477 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 64' ' ' VAL . . . . . 0.521 ' O ' HG13 ' A' ' 68' ' ' ILE . 71.4 t -60.99 -55.84 21.99 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.998 0 C-N-CA 123.456 0.702 . . . . 72.239999999999995 110.563 -178.957 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . 0.512 ' HB3' HD23 ' A' ' 109' ' ' LEU . . . -61.33 -37.8 84.61 Favored 'General case' 0 N--CA 1.488 1.455 0 O-C-N 123.478 0.486 . . . . 71.239999999999995 111.406 179.715 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -60.98 -37.17 93.41 Favored Glycine 0 C--N 1.346 1.109 0 CA-C-N 116.413 -0.358 . . . . 74.129999999999995 112.383 176.521 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 19.3 m-30 -75.86 -34.23 60.04 Favored 'General case' 0 N--CA 1.476 0.846 0 C-N-CA 123.137 0.575 . . . . 73.340000000000003 111.622 177.018 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 68' ' ' ILE . . . . . 0.521 HG13 ' O ' ' A' ' 64' ' ' VAL . 61.5 mt -59.69 -53.57 46.48 Favored 'Isoleucine or valine' 0 C--N 1.357 0.923 0 N-CA-C 108.808 -0.812 . . . . 72.420000000000002 108.808 175.812 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 69' ' ' LYS . . . . . 0.519 ' HB2' ' HE2' ' A' ' 106' ' ' TYR . 0.6 OUTLIER -59.77 -46.28 89.67 Favored 'General case' 0 C--N 1.348 0.507 0 CA-C-N 115.359 -0.837 . . . . 74.230000000000004 110.274 179.919 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 63.3 tt0 -57.08 -45.86 82.98 Favored 'General case' 0 C--N 1.352 0.675 0 O-C-N 124.564 1.165 . . . . 65.120000000000005 111.398 -178.589 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 71' ' ' THR . . . . . 0.599 ' HB ' ' HA ' ' A' ' 15' ' ' ALA . 15.1 t -79.66 -21.94 44.13 Favored 'General case' 0 C--O 1.216 -0.684 0 CA-C-O 119.188 -0.434 . . . . 73.209999999999994 110.559 -174.657 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 72' ' ' LEU . . . . . 0.512 ' HG ' ' O ' ' A' ' 68' ' ' ILE . 44.0 mt -74.62 -31.84 62.12 Favored 'General case' 0 N--CA 1.483 1.207 0 O-C-N 123.321 0.388 . . . . 74.150000000000006 110.521 172.122 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 73' ' ' ASP . . . . . 0.417 ' O ' ' HG ' ' A' ' 77' ' ' LEU . 48.5 m-20 -64.1 -60.17 3.55 Favored 'General case' 0 C--N 1.351 0.654 0 N-CA-C 108.627 -0.879 . . . . 74.349999999999994 108.627 172.702 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 48.4 m-20 -55.48 -41.35 72.86 Favored 'General case' 0 N--CA 1.483 1.21 0 C-N-CA 124.354 1.062 . . . . 74.5 111.335 -178.309 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . 0.535 ' O ' ' HG2' ' A' ' 79' ' ' LYS . 5.3 tp10 -58.88 -59.03 6.1 Favored 'General case' 0 N--CA 1.476 0.851 0 C-N-CA 124.348 1.059 . . . . 71.299999999999997 109.879 178.447 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 9.4 tt0 -72.45 -26.1 61.7 Favored 'General case' 0 CA--C 1.548 0.891 0 O-C-N 124.128 0.892 . . . . 75.209999999999994 111.851 -171.999 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . 0.417 ' HG ' ' O ' ' A' ' 73' ' ' ASP . 97.4 mt -67.61 -43.25 80.9 Favored 'General case' 0 N--CA 1.481 1.08 0 N-CA-C 109.246 -0.65 . . . . 73.019999999999996 109.246 174.165 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . 0.565 HD22 ' HA ' ' A' ' 22' ' ' LEU . 28.9 mt -57.3 -46.05 83.54 Favored 'General case' 0 N--CA 1.48 1.032 0 O-C-N 123.726 0.641 . . . . 75.420000000000002 111.196 169.55 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 79' ' ' LYS . . . . . 0.535 ' HG2' ' O ' ' A' ' 75' ' ' GLU . 36.2 mmtm -64.67 -38.13 89.93 Favored 'General case' 0 N--CA 1.478 0.955 0 C-N-CA 123.408 0.683 . . . . 75.340000000000003 112.316 -175.764 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -71.25 -30.6 67.05 Favored Glycine 0 C--N 1.342 0.906 0 CA-C-N 115.936 -0.574 . . . . 63.310000000000002 112.002 174.534 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 4.8 tt -68.8 -43.83 74.8 Favored 'General case' 0 CA--C 1.557 1.225 0 C-N-CA 123.488 0.715 . . . . 72.310000000000002 109.728 173.302 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 82' ' ' LEU . . . . . 0.404 ' HG ' ' O ' ' A' ' 78' ' ' LEU . 57.7 mt . . . . . 0 N--CA 1.478 0.947 0 C-N-CA 123.413 0.685 . . . . 74.239999999999995 110.201 -170.652 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 92' ' ' LEU . . . . . 0.421 HD11 ' HE3' ' A' ' 48' ' ' MET . 64.4 mt . . . . . 0 N--CA 1.481 1.121 0 CA-C-O 119.696 -0.193 . . . . 73.329999999999998 110.93 . . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 76.4 mt -41.31 -41.05 0.68 Allowed 'Isoleucine or valine' 0 N--CA 1.488 1.467 0 C-N-CA 125.224 1.41 . . . . 75.239999999999995 111.018 167.967 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -163.31 -151.67 6.53 Favored Glycine 0 C--O 1.242 0.641 0 N-CA-C 110.497 -1.041 . . . . 64.5 110.497 169.049 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 3.9 pt20 -73.92 167.32 21.71 Favored 'General case' 0 CA--C 1.547 0.828 0 N-CA-C 109.128 -0.693 . . . . 73.150000000000006 109.128 168.825 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 78.1 p 49.98 -88.21 0.01 OUTLIER 'General case' 0 CA--C 1.555 1.142 0 C-N-CA 125.051 1.34 . . . . 73.030000000000001 111.842 -170.469 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 28.2 m 55.64 -78.38 0.01 OUTLIER 'General case' 0 CA--C 1.559 1.303 0 C-N-CA 125.379 1.472 . . . . 73.450000000000003 113.27 176.652 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 4.9 ptm180 -45.98 -48.63 16.48 Favored 'General case' 0 N--CA 1.485 1.293 0 C-N-CA 125.699 1.599 . . . . 74.019999999999996 114.665 -169.274 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 60.2 tp60 -67.99 -52.02 40.58 Favored 'General case' 0 N--CA 1.471 0.602 0 N-CA-C 109.842 -0.429 . . . . 64.519999999999996 109.842 -176.976 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 87.3 tttt -60.68 -45.41 94.28 Favored 'General case' 0 N--CA 1.475 0.791 0 CA-C-N 115.797 -0.638 . . . . 74.450000000000003 111.3 -179.231 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 23.0 t -73.63 -46.83 44.5 Favored 'General case' 0 N--CA 1.468 0.432 0 C-N-CA 124.058 0.943 . . . . 73.349999999999994 110.983 -168.835 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 102' ' ' LEU . . . . . 0.518 ' HG ' ' HH2' ' A' ' 11' ' ' TRP . 9.4 mp -78.29 -35.51 47.86 Favored 'General case' 0 N--CA 1.473 0.718 0 O-C-N 123.347 0.404 . . . . 75.129999999999995 111.427 -176.538 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 60.6 t30 -70.85 -35.73 72.54 Favored 'General case' 0 N--CA 1.488 1.466 0 N-CA-C 109.732 -0.47 . . . . 72.140000000000001 109.732 177.874 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 104' ' ' ASN . . . . . 0.434 ' O ' ' HG2' ' A' ' 108' ' ' ARG . 24.4 t-20 -67.0 -43.68 82.29 Favored 'General case' 0 N--CA 1.479 0.998 0 N-CA-C 109.423 -0.584 . . . . 74.430000000000007 109.423 172.57 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -60.49 -34.88 74.69 Favored 'General case' 0 N--CA 1.484 1.236 0 C-N-CA 123.407 0.683 . . . . 74.239999999999995 111.698 178.703 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 106' ' ' TYR . . . . . 0.519 ' HE2' ' HB2' ' A' ' 69' ' ' LYS . 13.6 t80 -65.56 -52.89 48.97 Favored 'General case' 0 CA--C 1.539 0.536 0 N-CA-C 109.03 -0.729 . . . . 73.420000000000002 109.03 175.699 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -62.3 -35.69 91.99 Favored Glycine 0 C--N 1.353 1.508 0 O-C-N 124.095 0.872 . . . . 73.030000000000001 112.673 -177.78 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 108' ' ' ARG . . . . . 0.434 ' HG2' ' O ' ' A' ' 104' ' ' ASN . 21.4 mmt180 -75.21 -34.59 61.5 Favored 'General case' 0 N--CA 1.468 0.446 0 C-N-CA 122.879 0.471 . . . . 72.439999999999998 110.544 179.16 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 109' ' ' LEU . . . . . 0.512 HD23 ' HB3' ' A' ' 65' ' ' ALA . 41.9 tp -67.13 -41.71 85.67 Favored 'General case' 0 N--CA 1.487 1.412 0 CA-C-O 121.311 0.577 . . . . 73.040000000000006 109.857 177.447 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 33.2 t -68.12 -38.76 82.58 Favored 'General case' 0 CA--C 1.545 0.774 0 CA-C-N 114.17 -1.377 . . . . 75.109999999999999 109.81 -179.775 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . -89.8 -64.8 1.25 Allowed Glycine 0 C--N 1.355 1.608 0 C-N-CA 121.153 -0.546 . . . . 73.329999999999998 113.674 -178.165 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 112' ' ' MET . . . . . 0.573 ' SD ' ' HB2' ' A' ' 113' ' ' LEU . 0.2 OUTLIER -93.8 -71.43 0.66 Allowed 'General case' 0 N--CA 1.481 1.093 0 CA-C-N 117.853 0.826 . . . . 73.120000000000005 111.389 -175.793 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 113' ' ' LEU . . . . . 0.573 ' HB2' ' SD ' ' A' ' 112' ' ' MET . 6.1 mt 170.12 35.57 0.0 OUTLIER 'General case' 0 N--CA 1.507 2.409 0 C-N-CA 125.649 1.579 . . . . 74.439999999999998 110.342 -178.47 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 114' ' ' LEU . . . . . 0.674 ' HB3' HG21 ' A' ' 52' ' ' THR . 1.9 tt . . . . . 0 N--CA 1.506 2.357 0 C-N-CA 127.03 2.132 . . . . 75.299999999999997 111.722 176.843 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 25.2 ttt . . . . . 0 N--CA 1.487 1.375 0 CA-C-O 119.672 -0.204 . . . . 72.430000000000007 110.856 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 2' ' ' THR . . . . . 0.42 ' O ' ' HG2' ' A' ' 6' ' ' GLU . 41.6 m -49.47 -49.4 45.61 Favored 'General case' 0 N--CA 1.487 1.398 0 C-N-CA 123.65 0.78 . . . . 74.450000000000003 112.798 -173.547 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 68.8 p -60.72 -41.16 94.73 Favored 'General case' 0 N--CA 1.482 1.173 0 C-N-CA 123.609 0.764 . . . . 71.430000000000007 112.033 -178.392 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 30.4 m -69.1 -40.69 78.23 Favored 'General case' 0 N--CA 1.48 1.045 0 C-N-CA 123.261 0.625 . . . . 72.439999999999998 111.347 179.748 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 99.4 t -65.04 -46.08 92.5 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.922 0 C-N-CA 123.029 0.532 . . . . 73.129999999999995 109.885 178.942 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 6' ' ' GLU . . . . . 0.42 ' HG2' ' O ' ' A' ' 2' ' ' THR . 63.0 mm-40 -59.02 -44.69 91.75 Favored 'General case' 0 N--CA 1.476 0.844 0 C-N-CA 123.367 0.667 . . . . 64.439999999999998 110.328 174.854 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 39.2 t80 -57.49 -55.62 32.4 Favored 'General case' 0 N--CA 1.479 0.979 0 C-N-CA 124.451 1.1 . . . . 74.540000000000006 110.542 -176.036 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 45.3 mt -66.18 -37.36 79.57 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.986 0 C-N-CA 123.518 0.727 . . . . 74.349999999999994 110.322 -178.452 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 2.7 t-20 -72.28 -26.7 62.08 Favored 'General case' 0 N--CA 1.488 1.469 0 C-N-CA 123.298 0.639 . . . . 75.519999999999996 111.147 -177.442 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . 0.616 ' HB3' HG21 ' A' ' 47' ' ' VAL . 82.0 mtt180 -78.03 -35.47 49.77 Favored 'General case' 0 CA--C 1.536 0.421 0 C-N-CA 123.437 0.695 . . . . 74.400000000000006 109.648 174.688 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 11' ' ' TRP . . . . . 0.407 ' CZ3' HG12 ' A' ' 68' ' ' ILE . 73.4 m95 -67.67 -34.16 76.37 Favored 'General case' 0 N--CA 1.479 1.02 0 O-C-N 123.096 0.248 . . . . 74.450000000000003 110.381 172.028 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 54.4 mt-30 -60.0 -48.42 81.8 Favored 'General case' 0 C--N 1.359 0.993 0 N-CA-C 108.248 -1.019 . . . . 75.540000000000006 108.248 171.1 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 32.2 tpt180 -58.8 -46.81 86.75 Favored 'General case' 0 CA--C 1.552 1.045 0 CA-C-N 115.158 -0.928 . . . . 75.200000000000003 111.503 -175.754 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 14' ' ' ILE . . . . . 0.478 HG13 ' O ' ' A' ' 10' ' ' ARG . 31.7 mt -67.05 -45.36 87.06 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.439 0 C-N-CA 122.665 0.386 . . . . 75.5 110.163 -179.652 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . 0.406 ' HB1' ' OE1' ' A' ' 70' ' ' GLN . . . -62.15 -42.79 99.6 Favored 'General case' 0 N--CA 1.483 1.193 0 C-N-CA 124.339 1.055 . . . . 73.310000000000002 111.792 -177.894 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 95.2 mt -75.51 -39.35 58.59 Favored 'General case' 0 N--CA 1.484 1.249 0 CA-C-N 114.593 -1.185 . . . . 74.310000000000002 110.247 -175.694 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . 0.518 ' O ' ' HG ' ' A' ' 21' ' ' LEU . 44.2 mt -63.9 -49.14 73.84 Favored 'General case' 0 C--O 1.211 -0.948 0 O-C-N 123.565 0.54 . . . . 74.510000000000005 109.99 176.48 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 83.3 p -65.42 -30.55 71.37 Favored 'General case' 0 N--CA 1.484 1.265 0 C-N-CA 122.821 0.448 . . . . 71.409999999999997 111.515 -179.54 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 19' ' ' GLN . . . . . 0.534 ' HA ' HD21 ' A' ' 74' ' ' ASN . 5.6 tp-100 -63.42 -47.69 80.91 Favored 'General case' 0 N--CA 1.481 1.115 0 CA-C-O 121.546 0.688 . . . . 72.030000000000001 110.124 173.037 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 55.0 m -61.39 -48.12 82.68 Favored 'General case' 0 CA--C 1.538 0.502 0 CA-C-N 114.321 -1.309 . . . . 61.340000000000003 110.394 178.488 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . 0.518 ' HG ' ' O ' ' A' ' 17' ' ' LEU . 95.6 mt -60.46 -38.42 84.15 Favored 'General case' 0 N--CA 1.473 0.679 0 C-N-CA 124.218 1.007 . . . . 75.120000000000005 110.136 -178.117 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . 0.773 ' HA ' HD21 ' A' ' 78' ' ' LEU . 35.9 tp -61.09 -55.72 29.24 Favored 'General case' 0 C--O 1.253 1.276 0 C-N-CA 123.539 0.736 . . . . 74.140000000000001 110.733 178.812 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . 0.503 ' O ' ' HG3' ' A' ' 27' ' ' ARG . 56.0 mt-10 -59.19 -55.48 34.46 Favored 'General case' 0 CA--C 1.543 0.699 0 CA-C-N 114.917 -1.038 . . . . 74.209999999999994 111.678 -178.743 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . 0.483 HD21 HD12 ' A' ' 32' ' ' LEU . 78.5 mt -58.42 -38.68 77.9 Favored 'General case' 0 N--CA 1.478 0.973 0 C-N-CA 124.714 1.206 . . . . 74.430000000000007 111.776 -175.952 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . 0.468 ' HB1' HD22 ' A' ' 33' ' ' LEU . . . -62.13 -45.16 94.67 Favored 'General case' 0 N--CA 1.478 0.934 0 C-N-CA 123.247 0.619 . . . . 74.010000000000005 111.727 176.033 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 92.6 mt-30 -73.17 -14.82 61.43 Favored 'General case' 0 CA--C 1.557 1.217 0 CA-C-N 115.42 -0.809 . . . . 74.299999999999997 111.564 177.48 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 27' ' ' ARG . . . . . 0.503 ' HG3' ' O ' ' A' ' 23' ' ' GLU . 72.7 mtt-85 -87.84 -2.15 58.43 Favored 'General case' 0 N--CA 1.491 1.616 0 C-N-CA 123.58 0.752 . . . . 72.5 111.489 170.979 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 85.45 0.02 88.32 Favored Glycine 0 N--CA 1.48 1.591 0 N-CA-C 113.9 0.32 . . . . 63.149999999999999 113.9 -179.311 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 24.2 mm-40 -85.2 68.2 10.43 Favored 'General case' 0 N--CA 1.473 0.695 0 C-N-CA 124.696 1.199 . . . . 74.319999999999993 111.287 -176.692 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 30' ' ' TRP . . . . . 0.429 ' O ' ' HG ' ' A' ' 34' ' ' LEU . 69.2 m95 -67.84 -28.7 67.78 Favored 'General case' 0 N--CA 1.48 1.046 0 CA-C-N 115.712 -0.677 . . . . 75.310000000000002 110.386 178.292 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 10.4 m-20 -53.13 -46.67 68.88 Favored 'General case' 0 N--CA 1.479 1.017 0 C-N-CA 124.738 1.215 . . . . 75.409999999999997 111.576 176.022 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . 0.483 HD12 HD21 ' A' ' 24' ' ' LEU . 70.7 mt -70.44 -26.53 63.7 Favored 'General case' 0 CA--C 1.544 0.749 0 CA-C-N 114.856 -1.065 . . . . 72.030000000000001 110.758 -175.82 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . 0.468 HD22 ' HB1' ' A' ' 25' ' ' ALA . 11.0 mp -70.04 -42.86 72.34 Favored 'General case' 0 N--CA 1.485 1.325 0 C-N-CA 122.937 0.495 . . . . 74.430000000000007 110.418 172.45 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . 0.429 ' HG ' ' O ' ' A' ' 30' ' ' TRP . 77.0 mt -65.02 -33.97 77.32 Favored 'General case' 0 N--CA 1.484 1.263 0 C-N-CA 123.495 0.718 . . . . 73.010000000000005 111.292 -179.776 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 96.5 mt-30 -71.47 -52.16 19.93 Favored 'General case' 0 N--CA 1.477 0.915 0 C-N-CA 123.446 0.698 . . . . 74.099999999999994 110.658 176.716 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 84.8 mm-40 -74.5 -12.74 60.56 Favored 'General case' 0 N--CA 1.481 1.081 0 C-N-CA 123.743 0.817 . . . . 71.319999999999993 112.594 -177.571 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . 0.423 ' O ' ' HG ' ' A' ' 41' ' ' LEU . 38.4 tt0 -52.86 -53.84 43.08 Favored 'General case' 0 N--CA 1.48 1.051 0 C-N-CA 124.066 0.947 . . . . 75.230000000000004 111.577 178.456 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 83.8 t -60.42 -39.53 81.34 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.258 0 C-N-CA 123.241 0.616 . . . . 74.049999999999997 110.901 -178.239 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 36.4 m -63.72 -43.63 95.98 Favored 'General case' 0 CA--C 1.551 0.987 0 CA-C-N 115.458 -0.792 . . . . 72.549999999999997 111.03 177.246 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 59.5 t80 -65.04 -52.66 54.61 Favored 'General case' 0 N--CA 1.479 0.977 0 C-N-CA 124.778 1.231 . . . . 74.239999999999995 110.242 -175.888 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . 0.423 ' HG ' ' O ' ' A' ' 37' ' ' GLU . 69.6 mt -63.01 -44.74 95.13 Favored 'General case' 0 C--N 1.35 0.609 0 CA-C-N 114.729 -1.123 . . . . 63.310000000000002 110.95 -177.64 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 50.9 tt0 -61.04 -47.9 84.24 Favored 'General case' 0 N--CA 1.481 1.08 0 C-N-CA 122.797 0.439 . . . . 74.099999999999994 111.009 179.709 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 43' ' ' SER . . . . . 0.46 ' O ' HG23 ' A' ' 47' ' ' VAL . 63.2 m -57.76 -53.76 54.52 Favored 'General case' 0 N--CA 1.481 1.124 0 C-N-CA 123.381 0.672 . . . . 74.239999999999995 111.407 -178.968 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 20.8 tt -69.37 -28.67 39.23 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.864 0 CA-C-N 115.54 -0.754 . . . . 73.430000000000007 112.045 -174.037 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 14.0 mm-40 -62.52 -47.42 84.0 Favored 'General case' 0 N--CA 1.479 0.982 0 C-N-CA 122.709 0.404 . . . . 63.310000000000002 110.151 169.374 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 19.2 m -61.96 -27.67 69.01 Favored 'General case' 0 N--CA 1.481 1.082 0 O-C-N 123.906 0.754 . . . . 72.030000000000001 111.139 179.987 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 47' ' ' VAL . . . . . 0.616 HG21 ' HB3' ' A' ' 10' ' ' ARG . 21.1 t -75.4 -50.98 22.27 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.213 0 O-C-N 122.26 -0.275 . . . . 74.230000000000004 111.602 175.086 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 48' ' ' MET . . . . . . . . . . . . . 73.9 mtm -73.4 -20.87 60.64 Favored 'General case' 0 N--CA 1.492 1.648 0 N-CA-C 112.818 0.673 . . . . 71.230000000000004 112.818 -172.35 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 16.1 pt-20 -85.05 -11.51 55.16 Favored 'General case' 0 N--CA 1.48 1.045 0 C-N-CA 122.598 0.359 . . . . 74.209999999999994 111.134 175.047 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 11.9 mptt -94.62 155.88 16.68 Favored 'General case' 0 N--CA 1.485 1.294 0 C-N-CA 124.213 1.005 . . . . 65.319999999999993 110.852 -178.567 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 8.8 tt0 -87.07 142.23 28.08 Favored 'General case' 0 CA--C 1.545 0.773 0 CA-C-N 114.901 -1.045 . . . . 75.420000000000002 110.218 -179.396 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 95.7 m -68.74 131.59 91.17 Favored Pre-proline 0 CA--C 1.555 1.173 0 C-N-CA 123.868 0.867 . . . . 73.319999999999993 110.128 174.48 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 26.9 Cg_exo -66.79 151.91 81.52 Favored 'Trans proline' 0 C--N 1.381 2.285 0 C-N-CA 122.388 2.059 . . . . 72.129999999999995 112.475 172.891 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 17.0 Cg_exo -71.4 -46.88 0.57 Allowed 'Trans proline' 0 C--N 1.373 1.824 0 C-N-CA 122.898 2.398 . . . . 75.019999999999996 112.339 174.916 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . -81.98 48.92 4.0 Favored Glycine 0 C--N 1.351 1.383 0 CA-C-N 115.792 -0.64 . . . . 73.200000000000003 114.636 -172.742 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 56' ' ' ILE . . . . . 0.495 ' HB ' HD22 ' A' ' 113' ' ' LEU . 44.2 mt -81.71 109.1 15.52 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.598 0 N-CA-C 108.331 -0.988 . . . . 63.240000000000002 108.331 170.89 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 67.6 p -75.76 -178.36 4.2 Favored 'General case' 0 N--CA 1.476 0.84 0 C-N-CA 123.434 0.694 . . . . 72.519999999999996 110.729 -179.687 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 47.4 tpt85 -60.1 -48.44 81.72 Favored 'General case' 0 CA--C 1.546 0.811 0 C-N-CA 123.331 0.653 . . . . 73.329999999999998 109.638 174.48 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 14.9 m -59.33 -44.59 92.59 Favored 'General case' 0 C--O 1.248 0.982 0 C-N-CA 124.502 1.121 . . . . 74.109999999999999 111.625 179.754 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 87.5 mt -66.07 -38.35 81.82 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.652 0 CA-C-N 114.87 -1.059 . . . . 74.319999999999993 110.38 179.812 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 51.9 tt0 -64.27 -40.28 95.67 Favored 'General case' 0 N--CA 1.48 1.071 0 C-N-CA 123.028 0.531 . . . . 72.510000000000005 110.655 177.642 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 40.2 m-20 -60.92 -50.34 73.81 Favored 'General case' 0 N--CA 1.479 0.993 0 C-N-CA 123.11 0.564 . . . . 64.019999999999996 110.811 178.259 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 63' ' ' MET . . . . . . . . . . . . . 71.4 mtm -63.41 -57.83 9.02 Favored 'General case' 0 N--CA 1.478 0.971 0 CA-C-N 115.856 -0.611 . . . . 75.400000000000006 110.787 -178.902 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 64' ' ' VAL . . . . . 0.487 ' O ' HG13 ' A' ' 68' ' ' ILE . 55.7 t -54.72 -57.89 5.42 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.146 0 C-N-CA 124.04 0.936 . . . . 74.5 111.412 -177.495 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -63.76 -41.91 97.92 Favored 'General case' 0 N--CA 1.488 1.427 0 C-N-CA 122.393 0.277 . . . . 74.129999999999995 111.5 -178.072 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -58.26 -37.35 86.69 Favored Glycine 0 C--N 1.351 1.375 0 O-C-N 123.192 0.307 . . . . 74.239999999999995 112.446 177.813 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 67' ' ' TYR . . . . . 0.503 ' O ' HG21 ' A' ' 71' ' ' THR . 18.1 m-30 -71.67 -38.73 70.62 Favored 'General case' 0 N--CA 1.472 0.671 0 C-N-CA 123.422 0.689 . . . . 73.450000000000003 111.48 177.028 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 68' ' ' ILE . . . . . 0.495 ' O ' ' HG ' ' A' ' 72' ' ' LEU . 69.8 mt -57.93 -53.39 45.93 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.05 0 O-C-N 123.904 0.752 . . . . 73.049999999999997 109.232 177.363 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 69' ' ' LYS . . . . . 0.484 ' HB2' ' CE2' ' A' ' 106' ' ' TYR . 23.0 tptm -61.02 -38.24 85.4 Favored 'General case' 0 N--CA 1.474 0.767 0 C-N-CA 123.262 0.625 . . . . 74.519999999999996 110.93 179.109 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 70' ' ' GLN . . . . . 0.406 ' OE1' ' HB1' ' A' ' 15' ' ' ALA . 64.3 tt0 -59.67 -47.04 87.19 Favored 'General case' 0 C--N 1.349 0.586 0 O-C-N 123.746 0.654 . . . . 73.140000000000001 110.715 179.737 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 71' ' ' THR . . . . . 0.503 HG21 ' O ' ' A' ' 67' ' ' TYR . 2.2 t -77.51 -26.97 51.6 Favored 'General case' 0 C--N 1.354 0.78 0 O-C-N 122.341 -0.224 . . . . 72.099999999999994 111.601 -177.169 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 72' ' ' LEU . . . . . 0.515 HD23 ' HB2' ' A' ' 102' ' ' LEU . 41.7 mt -69.97 -41.36 74.58 Favored 'General case' 0 N--CA 1.483 1.183 0 C-N-CA 122.153 0.181 . . . . 64.450000000000003 110.892 175.853 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 73' ' ' ASP . . . . . 0.413 ' O ' ' HG ' ' A' ' 77' ' ' LEU . 18.8 t70 -78.08 -42.12 33.19 Favored 'General case' 0 N--CA 1.477 0.9 0 O-C-N 123.952 0.782 . . . . 70.299999999999997 110.517 -175.717 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 74' ' ' ASN . . . . . 0.534 HD21 ' HA ' ' A' ' 19' ' ' GLN . 3.7 m-20 -63.43 -45.15 92.25 Favored 'General case' 0 N--CA 1.482 1.151 0 C-N-CA 122.986 0.514 . . . . 74.310000000000002 110.448 176.976 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 27.2 tt0 -66.07 -36.69 83.87 Favored 'General case' 0 C--O 1.206 -1.192 0 O-C-N 123.427 0.454 . . . . 70.340000000000003 110.093 175.934 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 7.7 tt0 -56.98 -44.34 82.6 Favored 'General case' 0 N--CA 1.494 1.734 0 C-N-CA 123.818 0.847 . . . . 73.450000000000003 110.83 178.518 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . 0.413 ' HG ' ' O ' ' A' ' 73' ' ' ASP . 94.8 mt -67.67 -46.41 72.44 Favored 'General case' 0 N--CA 1.478 0.958 0 CA-C-N 114.829 -1.078 . . . . 75.230000000000004 110.983 179.59 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . 0.773 HD21 ' HA ' ' A' ' 22' ' ' LEU . 71.3 mt -61.0 -52.85 63.24 Favored 'General case' 0 N--CA 1.488 1.427 0 C-N-CA 124.219 1.008 . . . . 74.409999999999997 112.802 178.43 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 36.6 ttmt -68.19 -30.31 69.38 Favored 'General case' 0 C--N 1.315 -0.894 0 C-N-CA 125.409 1.484 . . . . 75.0 110.395 -175.328 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -71.11 -37.67 63.79 Favored Glycine 0 CA--C 1.536 1.364 0 CA-C-N 115.798 -0.637 . . . . 51.340000000000003 112.571 170.062 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 4.2 tt -63.88 -53.79 44.99 Favored 'General case' 0 N--CA 1.491 1.597 0 C-N-CA 124.043 0.937 . . . . 62.509999999999998 108.979 179.951 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 76.3 mt . . . . . 0 CA--C 1.54 0.559 0 C-N-CA 124.705 1.202 . . . . 74.030000000000001 110.048 178.788 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 76.3 mt . . . . . 0 N--CA 1.48 1.055 0 N-CA-C 112.574 0.583 . . . . 64.439999999999998 112.574 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 36.7 mt -82.28 75.03 0.93 Allowed 'Isoleucine or valine' 0 N--CA 1.475 0.811 0 N-CA-C 108.144 -1.058 . . . . 75.450000000000003 108.144 -177.193 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 75.32 -77.04 1.23 Allowed Glycine 0 C--N 1.347 1.146 0 CA-C-N 114.61 -1.177 . . . . 75.510000000000005 111.098 -169.092 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 84.4 mt-30 -104.59 -159.96 0.74 Allowed 'General case' 0 CA--C 1.549 0.922 0 C-N-CA 124.187 0.995 . . . . 73.209999999999994 110.593 -178.259 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 20.4 p -76.87 44.83 0.4 Allowed 'General case' 0 N--CA 1.478 0.97 0 C-N-CA 125.142 1.377 . . . . 75.230000000000004 113.159 176.334 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 28.5 m -62.21 -18.56 61.44 Favored 'General case' 0 CA--C 1.555 1.17 0 C-N-CA 124.785 1.234 . . . . 75.209999999999994 111.915 177.782 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 12.7 ttp85 -52.48 -55.38 22.34 Favored 'General case' 0 C--N 1.363 1.182 0 C-N-CA 124.435 1.094 . . . . 63.299999999999997 113.511 -172.278 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 7.3 tp60 -60.36 -44.41 95.61 Favored 'General case' 0 N--CA 1.478 0.935 0 O-C-N 123.916 0.76 . . . . 63.329999999999998 109.71 -173.824 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 27.0 mtpp -64.59 -40.75 96.09 Favored 'General case' 0 N--CA 1.477 0.879 0 CA-C-N 114.716 -1.129 . . . . 75.120000000000005 111.682 178.136 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 45.0 t -67.77 -47.73 68.35 Favored 'General case' 0 N--CA 1.478 0.941 0 C-N-CA 124.245 1.018 . . . . 73.420000000000002 110.752 -172.4 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 102' ' ' LEU . . . . . 0.515 ' HB2' HD23 ' A' ' 72' ' ' LEU . 10.2 mp -77.52 -30.26 52.79 Favored 'General case' 0 N--CA 1.472 0.652 0 CA-C-N 115.856 -0.611 . . . . 63.509999999999998 111.16 -179.236 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -64.28 -46.14 84.97 Favored 'General case' 0 N--CA 1.484 1.267 0 N-CA-C 109.064 -0.717 . . . . 74.439999999999998 109.064 176.492 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 104' ' ' ASN . . . . . 0.413 ' O ' ' HG2' ' A' ' 108' ' ' ARG . 6.1 t-20 -63.7 -46.27 86.26 Favored 'General case' 0 CA--C 1.539 0.525 0 CA-C-N 115.248 -0.887 . . . . 73.420000000000002 109.895 176.35 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -58.03 -37.49 74.45 Favored 'General case' 0 N--CA 1.482 1.146 0 C-N-CA 124.03 0.932 . . . . 73.349999999999994 111.438 179.348 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 106' ' ' TYR . . . . . 0.484 ' CE2' ' HB2' ' A' ' 69' ' ' LYS . 12.0 t80 -65.23 -50.37 66.1 Favored 'General case' 0 N--CA 1.475 0.793 0 C-N-CA 123.707 0.803 . . . . 74.209999999999994 109.394 177.324 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -60.95 -40.01 97.8 Favored Glycine 0 C--N 1.351 1.362 0 O-C-N 124.01 0.819 . . . . 74.299999999999997 112.966 -177.513 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 108' ' ' ARG . . . . . 0.413 ' HG2' ' O ' ' A' ' 104' ' ' ASN . 26.7 mmt180 -75.08 -29.38 60.65 Favored 'General case' 0 CA--C 1.548 0.881 0 C-N-CA 122.764 0.425 . . . . 74.430000000000007 110.244 179.307 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 109' ' ' LEU . . . . . 0.461 ' HA ' ' N ' ' A' ' 114' ' ' LEU . 45.6 tp -71.05 -36.63 72.39 Favored 'General case' 0 N--CA 1.492 1.657 0 C-N-CA 123.221 0.608 . . . . 64.420000000000002 110.475 176.361 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 45.3 t -69.85 -41.23 75.16 Favored 'General case' 0 CA--C 1.54 0.587 0 CA-C-N 115.019 -0.991 . . . . 74.109999999999999 109.604 177.758 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . -89.58 -63.68 1.28 Allowed Glycine 0 C--N 1.359 1.819 0 CA-C-O 119.42 -0.656 . . . . 71.409999999999997 114.438 -175.075 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 112' ' ' MET . . . . . . . . . . . . . 1.1 tmm? -96.26 -67.53 0.84 Allowed 'General case' 0 N--CA 1.493 1.721 0 CA-C-N 118.38 1.09 . . . . 74.120000000000005 112.366 -175.125 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 113' ' ' LEU . . . . . 0.495 HD22 ' HB ' ' A' ' 56' ' ' ILE . 1.4 tt 165.77 48.72 0.0 OUTLIER 'General case' 0 N--CA 1.508 2.458 0 C-N-CA 125.704 1.602 . . . . 75.430000000000007 107.878 179.755 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 114' ' ' LEU . . . . . 0.461 ' N ' ' HA ' ' A' ' 109' ' ' LEU . 1.3 tt . . . . . 0 N--CA 1.496 1.837 0 C-N-CA 126.76 2.024 . . . . 74.530000000000001 111.281 177.171 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 1' ' ' MET . . . . . 0.528 ' HG2' ' HB ' ' A' ' 4' ' ' THR . 38.6 ttp . . . . . 0 N--CA 1.483 1.219 0 N-CA-C 109.253 -0.647 . . . . 65.319999999999993 109.253 . . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 42.5 m -50.25 -50.55 49.65 Favored 'General case' 0 N--CA 1.478 0.958 0 C-N-CA 124.85 1.26 . . . . 75.310000000000002 113.405 -170.118 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 37.0 m -56.25 -47.99 77.41 Favored 'General case' 0 N--CA 1.48 1.042 0 C-N-CA 123.249 0.619 . . . . 74.129999999999995 111.628 -176.688 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 4' ' ' THR . . . . . 0.528 ' HB ' ' HG2' ' A' ' 1' ' ' MET . 40.9 m -68.66 -44.71 73.53 Favored 'General case' 0 C--N 1.35 0.625 0 CA-C-N 115.614 -0.721 . . . . 72.510000000000005 110.979 -179.29 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 83.9 t -62.33 -40.12 86.71 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.939 0 C-N-CA 123.115 0.566 . . . . 73.230000000000004 110.88 -177.789 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 6' ' ' GLU . . . . . 0.424 ' O ' ' HG3' ' A' ' 10' ' ' ARG . 34.2 mm-40 -69.21 -39.97 78.29 Favored 'General case' 0 N--CA 1.47 0.561 0 O-C-N 123.554 0.534 . . . . 72.450000000000003 110.591 177.226 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 30.4 t80 -65.38 -40.01 92.97 Favored 'General case' 0 CA--C 1.554 1.13 0 C-N-CA 122.67 0.388 . . . . 74.340000000000003 110.568 -179.545 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 8' ' ' ILE . . . . . 0.543 HD13 HG22 ' A' ' 60' ' ' ILE . 81.0 mt -68.06 -37.03 77.59 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.161 0 C-N-CA 123.876 0.87 . . . . 72.099999999999994 109.723 173.984 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 26.6 t-20 -64.45 -28.7 69.85 Favored 'General case' 0 N--CA 1.483 1.207 0 C-N-CA 124.001 0.92 . . . . 74.310000000000002 110.896 176.384 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . 0.626 ' HB3' HG22 ' A' ' 47' ' ' VAL . 91.5 mtt180 -82.11 -28.8 32.08 Favored 'General case' 0 CA--C 1.539 0.552 0 C-N-CA 123.474 0.71 . . . . 74.230000000000004 110.407 177.135 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 11' ' ' TRP . . . . . . . . . . . . . 53.4 m95 -70.92 -33.54 70.63 Favored 'General case' 0 N--CA 1.48 1.034 0 CA-C-O 119.745 -0.169 . . . . 72.109999999999999 110.632 167.608 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . 0.426 ' HG2' ' CE2' ' A' ' 67' ' ' TYR . 53.0 mt-30 -60.65 -49.19 78.52 Favored 'General case' 0 C--N 1.361 1.092 0 N-CA-C 107.874 -1.158 . . . . 65.310000000000002 107.874 171.838 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 28.5 tpt180 -53.19 -54.16 39.96 Favored 'General case' 0 CA--C 1.551 1.001 0 CA-C-N 114.267 -1.333 . . . . 73.25 111.345 -177.834 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 14' ' ' ILE . . . . . 0.401 HG13 ' O ' ' A' ' 10' ' ' ARG . 52.7 mt -62.38 -49.14 85.14 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.263 0 C-N-CA 122.501 0.321 . . . . 75.129999999999995 110.304 179.704 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . 0.549 ' HA ' ' HB ' ' A' ' 71' ' ' THR . . . -58.94 -44.15 91.34 Favored 'General case' 0 N--CA 1.485 1.288 0 C-N-CA 124.08 0.952 . . . . 70.219999999999999 112.319 -176.004 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 91.1 mt -74.47 -45.27 47.31 Favored 'General case' 0 N--CA 1.479 1.023 0 CA-C-N 114.956 -1.02 . . . . 73.430000000000007 110.632 -173.741 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . 0.525 ' O ' ' HG ' ' A' ' 21' ' ' LEU . 90.2 mt -59.8 -51.21 70.72 Favored 'General case' 0 N--CA 1.474 0.748 0 O-C-N 123.588 0.555 . . . . 71.099999999999994 110.201 179.041 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 78.1 p -66.01 -37.1 85.06 Favored 'General case' 0 N--CA 1.479 0.993 0 O-C-N 123.698 0.623 . . . . 71.129999999999995 111.97 -177.088 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 6.8 tp-100 -63.26 -44.24 95.73 Favored 'General case' 0 C--O 1.25 1.1 0 CA-C-O 121.281 0.563 . . . . 75.430000000000007 110.753 178.022 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 35.9 m -59.48 -46.02 90.01 Favored 'General case' 0 CA--C 1.535 0.372 0 CA-C-N 114.978 -1.01 . . . . 74.019999999999996 109.823 174.255 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . 0.673 HD21 ' HA ' ' A' ' 33' ' ' LEU . 47.9 mt -63.95 -29.27 70.45 Favored 'General case' 0 N--CA 1.473 0.712 0 C-N-CA 123.142 0.577 . . . . 64.319999999999993 111.392 -178.836 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . 0.644 ' HA ' HD23 ' A' ' 78' ' ' LEU . 36.5 tp -70.48 -50.99 32.25 Favored 'General case' 0 C--O 1.245 0.818 0 O-C-N 123.332 0.395 . . . . 72.25 110.043 178.842 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 23.8 mt-10 -60.96 -43.14 99.16 Favored 'General case' 0 N--CA 1.483 1.22 0 O-C-N 123.361 0.413 . . . . 75.129999999999995 111.435 177.063 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 96.5 mt -63.46 -39.64 94.99 Favored 'General case' 0 N--CA 1.475 0.782 0 C-N-CA 123.604 0.762 . . . . 73.329999999999998 110.767 -179.658 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . 0.486 ' HB3' HD21 ' A' ' 33' ' ' LEU . . . -63.75 -40.53 96.95 Favored 'General case' 0 N--CA 1.481 1.117 0 C-N-CA 123.246 0.618 . . . . 74.340000000000003 111.573 178.004 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 26' ' ' GLN . . . . . 0.417 HE21 ' HG ' ' A' ' 22' ' ' LEU . 66.9 mt-30 -59.87 -39.54 85.6 Favored 'General case' 0 N--CA 1.484 1.256 0 C-N-CA 123.527 0.731 . . . . 75.549999999999997 110.785 173.209 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 47.8 mtt180 -81.61 -5.42 58.02 Favored 'General case' 0 N--CA 1.484 1.254 0 C-N-CA 123.63 0.772 . . . . 73.409999999999997 112.155 -179.613 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 79.12 15.97 79.46 Favored Glycine 0 C--N 1.35 1.313 0 O-C-N 123.126 0.266 . . . . 64.140000000000001 113.671 177.852 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 18.7 mm-40 -83.41 51.31 1.96 Allowed 'General case' 0 N--CA 1.476 0.859 0 C-N-CA 124.805 1.242 . . . . 54.210000000000001 111.248 177.273 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 30' ' ' TRP . . . . . 0.479 ' O ' ' HG ' ' A' ' 34' ' ' LEU . 88.5 m95 -62.33 -27.0 68.75 Favored 'General case' 0 N--CA 1.475 0.808 0 C-N-CA 123.457 0.703 . . . . 72.319999999999993 111.369 -177.309 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 11.2 m-20 -51.89 -54.74 25.8 Favored 'General case' 0 N--CA 1.478 0.928 0 O-C-N 123.933 0.771 . . . . 74.040000000000006 109.816 171.242 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 93.6 mt -63.18 -28.79 70.29 Favored 'General case' 0 N--CA 1.471 0.586 0 CA-C-N 114.862 -1.063 . . . . 70.340000000000003 111.417 -177.335 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . 0.673 ' HA ' HD21 ' A' ' 21' ' ' LEU . 8.4 mp -66.62 -42.8 86.24 Favored 'General case' 0 N--CA 1.479 0.977 0 O-C-N 123.151 0.282 . . . . 75.219999999999999 110.849 172.206 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . 0.479 ' HG ' ' O ' ' A' ' 30' ' ' TRP . 77.0 mt -68.81 -35.87 77.52 Favored 'General case' 0 N--CA 1.483 1.178 0 O-C-N 123.621 0.575 . . . . 73.019999999999996 111.792 -176.826 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 1.3 mp0 -73.51 -55.33 6.47 Favored 'General case' 0 N--CA 1.483 1.21 0 N-CA-C 110.134 -0.321 . . . . 74.109999999999999 110.134 176.636 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 36' ' ' GLN . . . . . 0.474 ' HB2' HD22 ' A' ' 21' ' ' LEU . 82.6 mm-40 -65.63 -14.87 62.06 Favored 'General case' 0 N--CA 1.487 1.381 0 C-N-CA 123.516 0.726 . . . . 74.450000000000003 112.524 179.775 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . 0.509 ' O ' ' HG ' ' A' ' 41' ' ' LEU . 29.8 tt0 -50.36 -53.62 27.76 Favored 'General case' 0 C--O 1.217 -0.657 0 O-C-N 124.228 0.955 . . . . 74.349999999999994 110.591 173.386 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 60.7 t -55.58 -43.9 74.52 Favored 'Isoleucine or valine' 0 C--O 1.249 1.052 0 C-N-CA 123.981 0.913 . . . . 73.439999999999998 111.361 -175.632 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 19.6 m -61.34 -49.15 78.13 Favored 'General case' 0 N--CA 1.476 0.86 0 CA-C-N 115.517 -0.765 . . . . 61.109999999999999 110.398 175.324 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 40.2 t80 -60.38 -40.43 90.81 Favored 'General case' 0 N--CA 1.474 0.745 0 C-N-CA 124.434 1.094 . . . . 74.200000000000003 111.448 -176.932 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . 0.509 ' HG ' ' O ' ' A' ' 37' ' ' GLU . 71.7 mt -70.69 -46.56 62.93 Favored 'General case' 0 C--N 1.349 0.57 0 C-N-CA 123.62 0.768 . . . . 73.129999999999995 110.26 -176.62 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 53.3 tt0 -58.2 -42.39 86.03 Favored 'General case' 0 N--CA 1.474 0.748 0 O-C-N 123.503 0.502 . . . . 75.209999999999994 110.638 177.304 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 43' ' ' SER . . . . . 0.458 ' O ' HG21 ' A' ' 47' ' ' VAL . 49.6 m -63.71 -57.01 11.34 Favored 'General case' 0 CA--C 1.542 0.641 0 CA-C-N 115.514 -0.766 . . . . 74.219999999999999 112.007 -177.973 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 15.9 tt -63.06 -34.15 64.93 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.88 0 C-N-CA 123.391 0.676 . . . . 72.200000000000003 111.115 -174.959 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . 0.576 ' HG2' HD23 ' A' ' 92' ' ' LEU . 23.7 mm-40 -61.02 -53.6 55.22 Favored 'General case' 0 C--N 1.359 0.992 0 O-C-N 123.252 0.345 . . . . 73.150000000000006 110.594 169.819 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 46' ' ' THR . . . . . 0.414 ' O ' ' HB2' ' A' ' 50' ' ' LYS . 96.0 m -53.26 -34.43 57.21 Favored 'General case' 0 N--CA 1.482 1.155 0 C-N-CA 123.532 0.733 . . . . 73.340000000000003 111.664 -176.976 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 47' ' ' VAL . . . . . 0.626 HG22 ' HB3' ' A' ' 10' ' ' ARG . 41.2 t -75.64 -48.57 29.64 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.938 0 C-N-CA 123.189 0.595 . . . . 73.25 111.782 179.019 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 48' ' ' MET . . . . . . . . . . . . . 76.2 mtm -68.78 -30.53 69.15 Favored 'General case' 0 N--CA 1.489 1.485 0 C-N-CA 122.611 0.365 . . . . 74.340000000000003 111.736 -177.736 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 51.2 mt-10 -75.64 -18.48 59.66 Favored 'General case' 0 N--CA 1.48 1.063 0 C-N-CA 124.121 0.968 . . . . 73.430000000000007 110.867 175.845 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . 0.585 ' HZ3' ' HB2' ' A' ' 50' ' ' LYS . 0.1 OUTLIER -93.36 142.52 27.23 Favored 'General case' 0 C--O 1.237 0.409 0 C-N-CA 122.936 0.494 . . . . 74.049999999999997 110.056 -175.738 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 36.8 tt0 -79.46 141.41 36.8 Favored 'General case' 0 C--O 1.244 0.814 0 N-CA-C 108.954 -0.758 . . . . 71.540000000000006 108.954 173.628 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 52' ' ' THR . . . . . 0.669 HG21 ' HB3' ' A' ' 114' ' ' LEU . 32.1 m -73.78 131.29 82.04 Favored Pre-proline 0 CA--C 1.552 1.033 0 O-C-N 123.624 0.578 . . . . 73.049999999999997 110.263 177.255 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 53' ' ' PRO . . . . . 0.407 ' HG2' ' HA ' ' A' ' 4' ' ' THR . 25.5 Cg_exo -65.29 155.12 70.3 Favored 'Trans proline' 0 C--N 1.371 1.743 0 C-N-CA 122.94 2.427 . . . . 74.530000000000001 112.814 174.784 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 32.8 Cg_exo -61.49 -47.7 11.05 Favored 'Trans proline' 0 C--N 1.376 1.999 0 C-N-CA 123.603 2.869 . . . . 72.519999999999996 112.812 179.268 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . -65.52 84.85 0.08 OUTLIER Glycine 0 C--N 1.347 1.148 0 CA-C-N 115.156 -0.929 . . . . 74.439999999999998 113.932 -173.553 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 62.6 mt -121.15 103.99 14.53 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.467 0 N-CA-C 107.932 -1.136 . . . . 73.209999999999994 107.932 173.75 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 58.0 p -91.97 -174.36 3.77 Favored 'General case' 0 CA--C 1.544 0.743 0 C-N-CA 123.476 0.711 . . . . 75.010000000000005 109.668 175.175 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 3.6 tmt_? -60.52 -52.31 65.72 Favored 'General case' 0 CA--C 1.545 0.774 0 C-N-CA 123.949 0.9 . . . . 73.420000000000002 110.905 178.727 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 57.6 p -62.7 -39.11 92.96 Favored 'General case' 0 N--CA 1.481 1.085 0 C-N-CA 123.373 0.669 . . . . 71.439999999999998 111.635 -179.563 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 60' ' ' ILE . . . . . 0.543 HG22 HD13 ' A' ' 8' ' ' ILE . 87.0 mt -63.13 -47.98 89.91 Favored 'Isoleucine or valine' 0 C--N 1.349 0.55 0 CA-C-N 115.108 -0.951 . . . . 72.420000000000002 110.795 179.065 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 27.9 pt20 -70.97 -25.13 62.58 Favored 'General case' 0 N--CA 1.481 1.104 0 CA-C-N 117.491 0.132 . . . . 74.340000000000003 110.997 -177.885 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 53.8 m-20 -65.58 -48.56 71.93 Favored 'General case' 0 N--CA 1.482 1.132 0 C-N-CA 122.268 0.227 . . . . 75.109999999999999 111.256 172.647 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 63' ' ' MET . . . . . 0.515 ' HE1' HD11 ' A' ' 8' ' ' ILE . 73.4 mtm -65.87 -45.03 83.59 Favored 'General case' 0 N--CA 1.478 0.953 0 O-C-N 123.448 0.467 . . . . 72.439999999999998 111.061 178.29 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 64' ' ' VAL . . . . . 0.439 ' O ' HG13 ' A' ' 68' ' ' ILE . 55.6 t -64.49 -64.59 0.66 Allowed 'Isoleucine or valine' 0 N--CA 1.475 0.796 0 C-N-CA 123.337 0.655 . . . . 73.129999999999995 110.389 -178.921 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -63.48 -29.81 71.03 Favored 'General case' 0 N--CA 1.482 1.134 0 C-N-CA 123.053 0.541 . . . . 64.040000000000006 111.534 -177.149 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -60.24 -54.01 40.89 Favored Glycine 0 C--N 1.35 1.333 0 O-C-N 123.871 0.732 . . . . 74.209999999999994 111.378 174.71 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 67' ' ' TYR . . . . . 0.431 ' HB3' ' HB3' ' A' ' 15' ' ' ALA . 12.1 m-85 -66.44 -33.9 76.73 Favored 'General case' 0 N--CA 1.469 0.513 0 C-N-CA 122.999 0.52 . . . . 73.010000000000005 112.109 179.99 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 68' ' ' ILE . . . . . 0.512 ' O ' ' HG ' ' A' ' 72' ' ' LEU . 70.0 mt -59.97 -56.13 19.49 Favored 'Isoleucine or valine' 0 C--N 1.357 0.924 0 N-CA-C 108.982 -0.747 . . . . 71.239999999999995 108.982 175.958 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 54.7 tptt -54.42 -48.31 71.8 Favored 'General case' 0 N--CA 1.475 0.777 0 O-C-N 123.994 0.809 . . . . 63.329999999999998 110.927 -179.366 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 56.6 mt-30 -57.76 -46.41 84.58 Favored 'General case' 0 N--CA 1.474 0.767 0 O-C-N 124.021 0.825 . . . . 74.209999999999994 111.272 179.836 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 71' ' ' THR . . . . . 0.549 ' HB ' ' HA ' ' A' ' 15' ' ' ALA . 14.0 t -79.29 -18.96 51.63 Favored 'General case' 0 C--N 1.353 0.745 0 CA-C-O 118.981 -0.533 . . . . 71.25 111.233 -175.749 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 72' ' ' LEU . . . . . 0.512 ' HG ' ' O ' ' A' ' 68' ' ' ILE . 39.8 mt -70.67 -41.31 72.25 Favored 'General case' 0 N--CA 1.485 1.278 0 N-CA-C 109.627 -0.508 . . . . 73.239999999999995 109.627 171.918 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 6.2 m-20 -62.22 -50.17 72.83 Favored 'General case' 0 N--CA 1.474 0.762 0 O-C-N 123.676 0.61 . . . . 73.430000000000007 110.187 174.007 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 71.5 m-20 -59.47 -52.0 67.45 Favored 'General case' 0 N--CA 1.481 1.109 0 C-N-CA 122.975 0.51 . . . . 75.140000000000001 110.557 -178.712 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . 0.414 ' O ' ' HG2' ' A' ' 79' ' ' LYS . 40.1 tp10 -52.75 -56.21 17.28 Favored 'General case' 0 N--CA 1.485 1.286 0 C-N-CA 125.109 1.364 . . . . 75.400000000000006 111.455 178.547 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 10.0 tt0 -70.56 -42.14 71.52 Favored 'General case' 0 N--CA 1.473 0.724 0 C-N-CA 123.088 0.555 . . . . 73.409999999999997 111.51 -171.336 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 84.4 mt -62.11 -38.4 88.76 Favored 'General case' 0 N--CA 1.483 1.217 0 O-C-N 123.397 0.436 . . . . 74.5 110.677 178.207 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . 0.644 HD23 ' HA ' ' A' ' 22' ' ' LEU . 46.0 mt -63.35 -49.1 75.22 Favored 'General case' 0 N--CA 1.476 0.845 0 O-C-N 123.452 0.47 . . . . 75.329999999999998 111.396 174.525 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 79' ' ' LYS . . . . . 0.414 ' HG2' ' O ' ' A' ' 75' ' ' GLU . 46.6 mmtm -62.87 -34.03 76.52 Favored 'General case' 0 N--CA 1.485 1.291 0 C-N-CA 122.978 0.511 . . . . 75.510000000000005 111.635 -177.766 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -75.28 -35.78 47.23 Favored Glycine 0 C--N 1.346 1.113 0 CA-C-N 115.197 -0.911 . . . . 54.43 112.408 177.125 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 1.5 tt -67.28 -37.37 83.32 Favored 'General case' 0 N--CA 1.477 0.877 0 C-N-CA 123.786 0.834 . . . . 71.299999999999997 109.03 178.172 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 82' ' ' LEU . . . . . 0.472 ' HG ' ' O ' ' A' ' 78' ' ' LEU . 60.1 mt . . . . . 0 C--N 1.352 0.697 0 C-N-CA 123.768 0.827 . . . . 74.519999999999996 111.565 179.683 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 92' ' ' LEU . . . . . 0.576 HD23 ' HG2' ' A' ' 45' ' ' GLU . 43.7 mt . . . . . 0 N--CA 1.492 1.647 0 N-CA-C 112.629 0.603 . . . . 74.120000000000005 112.629 . . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 49.4 mt -53.41 111.12 0.26 Allowed 'Isoleucine or valine' 0 CA--C 1.558 1.26 0 C-N-CA 123.892 0.877 . . . . 74.129999999999995 110.182 167.203 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -76.86 0.61 65.44 Favored Glycine 0 C--N 1.35 1.314 0 CA-C-N 115.82 -0.627 . . . . 72.129999999999995 114.114 -175.561 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 9.9 tt0 -69.69 -11.58 60.96 Favored 'General case' 0 N--CA 1.48 1.071 0 C-N-CA 123.858 0.863 . . . . 64.129999999999995 110.67 169.254 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 19.6 t 73.25 17.49 3.97 Favored 'General case' 0 C--N 1.358 0.973 0 C-N-CA 124.944 1.298 . . . . 71.409999999999997 111.453 176.856 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 13.5 t -86.57 16.7 4.41 Favored 'General case' 0 CA--C 1.553 1.067 0 C-N-CA 123.732 0.813 . . . . 74.140000000000001 111.571 -179.346 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 14.3 mtm-85 -65.59 -58.13 6.49 Favored 'General case' 0 N--CA 1.489 1.515 0 C-N-CA 123.839 0.855 . . . . 74.340000000000003 112.554 -167.441 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 44.8 tt0 -63.4 -37.81 88.73 Favored 'General case' 0 CA--C 1.542 0.65 0 CA-C-N 115.296 -0.865 . . . . 75.140000000000001 109.675 178.344 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 51.5 tttm -68.17 -26.45 65.75 Favored 'General case' 0 CA--C 1.546 0.816 0 CA-C-N 114.794 -1.094 . . . . 72.219999999999999 111.357 177.766 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 47.2 t -73.23 -48.39 35.4 Favored 'General case' 0 N--CA 1.471 0.608 0 C-N-CA 123.502 0.721 . . . . 72.349999999999994 109.159 -178.509 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 9.5 mp -69.3 -30.1 68.1 Favored 'General case' 0 N--CA 1.484 1.266 0 O-C-N 123.498 0.499 . . . . 61.340000000000003 111.418 176.225 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 20.9 t-20 -71.01 -50.33 35.37 Favored 'General case' 0 N--CA 1.478 0.964 0 CA-C-O 121.055 0.455 . . . . 71.310000000000002 110.499 179.642 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 10.8 m120 -71.09 -18.9 62.52 Favored 'General case' 0 N--CA 1.479 1.016 0 C-N-CA 123.072 0.549 . . . . 73.329999999999998 111.091 176.449 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -64.91 -47.43 77.77 Favored 'General case' 0 C--N 1.349 0.572 0 O-C-N 123.626 0.579 . . . . 75.030000000000001 109.795 169.18 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 106' ' ' TYR . . . . . . . . . . . . . 1.1 t80 -58.11 -45.02 87.97 Favored 'General case' 0 N--CA 1.482 1.161 0 N-CA-C 109.482 -0.562 . . . . 73.530000000000001 109.482 174.225 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -58.79 -44.85 95.62 Favored Glycine 0 C--N 1.35 1.361 0 CA-C-N 115.778 -0.646 . . . . 71.129999999999995 113.345 -179.777 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 31.4 ptt180 -81.7 -14.53 56.44 Favored 'General case' 0 N--CA 1.476 0.828 0 C-N-CA 122.746 0.418 . . . . 73.219999999999999 111.051 -179.979 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 109' ' ' LEU . . . . . 0.544 HD12 ' HB2' ' A' ' 114' ' ' LEU . 36.4 tp -70.83 -43.37 68.7 Favored 'General case' 0 N--CA 1.486 1.373 0 N-CA-C 109.218 -0.66 . . . . 73.450000000000003 109.218 171.012 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 19.1 m -71.83 -36.44 70.2 Favored 'General case' 0 CA--C 1.547 0.837 0 CA-C-N 114.984 -1.007 . . . . 74.040000000000006 110.376 177.762 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . -91.02 -61.61 1.26 Allowed Glycine 0 C--N 1.358 1.789 0 N-CA-C 114.585 0.594 . . . . 72.0 114.585 -177.568 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 112' ' ' MET . . . . . . . . . . . . . 12.5 tpt -91.83 -69.72 0.73 Allowed 'General case' 0 N--CA 1.488 1.431 0 N-CA-C 112.961 0.726 . . . . 70.329999999999998 112.961 -172.377 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 18.8 tp 170.75 21.92 0.0 OUTLIER 'General case' 0 N--CA 1.493 1.721 0 C-N-CA 124.54 1.136 . . . . 72.219999999999999 110.593 -178.543 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 114' ' ' LEU . . . . . 0.669 ' HB3' HG21 ' A' ' 52' ' ' THR . 39.0 tp . . . . . 0 N--CA 1.499 1.999 0 C-N-CA 124.788 1.235 . . . . 75.129999999999995 111.698 -175.922 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 25.3 ttt . . . . . 0 CA--C 1.558 1.257 0 N-CA-C 110.369 -0.234 . . . . 62.039999999999999 110.369 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 74.1 p -55.63 -56.48 19.85 Favored 'General case' 0 N--CA 1.489 1.523 0 C-N-CA 123.957 0.903 . . . . 73.200000000000003 112.546 -171.971 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 34.1 t -65.23 -30.63 71.54 Favored 'General case' 0 N--CA 1.478 0.94 0 C-N-CA 123.208 0.603 . . . . 74.219999999999999 111.474 -177.178 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 4' ' ' THR . . . . . 0.446 ' HA ' ' HG3' ' A' ' 53' ' ' PRO . 28.0 m -72.27 -43.03 64.88 Favored 'General case' 0 N--CA 1.471 0.624 0 C-N-CA 123.162 0.585 . . . . 70.310000000000002 111.214 179.078 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 76.6 t -63.59 -45.77 96.72 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.759 0 N-CA-C 109.2 -0.667 . . . . 70.299999999999997 109.2 179.29 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 24.1 mm-40 -56.66 -51.63 68.01 Favored 'General case' 0 N--CA 1.475 0.783 0 O-C-N 124.058 0.849 . . . . 74.510000000000005 110.627 174.226 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 34.0 t80 -58.11 -53.65 55.84 Favored 'General case' 0 N--CA 1.481 1.122 0 C-N-CA 124.195 0.998 . . . . 73.340000000000003 111.496 -173.577 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 8' ' ' ILE . . . . . 0.407 ' O ' ' HG3' ' A' ' 12' ' ' GLN . 72.1 mt -61.77 -45.32 98.94 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.967 0 C-N-CA 123.54 0.736 . . . . 72.310000000000002 110.151 178.776 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 26.2 t-20 -62.01 -32.86 73.38 Favored 'General case' 0 N--CA 1.488 1.436 0 C-N-CA 123.894 0.878 . . . . 74.239999999999995 111.954 -177.897 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . 0.415 ' O ' HG13 ' A' ' 14' ' ' ILE . 96.6 mtt180 -78.13 -34.75 49.75 Favored 'General case' 0 C--O 1.214 -0.773 0 CA-C-N 115.954 -0.566 . . . . 74.310000000000002 110.042 178.694 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 11' ' ' TRP . . . . . . . . . . . . . 53.0 m95 -67.28 -33.76 75.98 Favored 'General case' 0 N--CA 1.482 1.163 0 O-C-N 122.916 0.135 . . . . 74.310000000000002 111.131 172.037 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . 0.43 ' HG2' ' CE2' ' A' ' 67' ' ' TYR . 51.4 mt-30 -61.42 -48.41 81.31 Favored 'General case' 0 C--O 1.218 -0.562 0 N-CA-C 108.327 -0.99 . . . . 73.409999999999997 108.327 171.939 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 79.2 ttt180 -62.56 -48.59 78.83 Favored 'General case' 0 C--O 1.216 -0.687 0 O-C-N 124.638 1.211 . . . . 74.329999999999998 111.373 -175.799 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 14' ' ' ILE . . . . . 0.415 HG13 ' O ' ' A' ' 10' ' ' ARG . 90.9 mt -62.44 -43.12 97.93 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.002 0 C-N-CA 123.615 0.766 . . . . 75.299999999999997 109.69 -179.312 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . 0.64 ' HA ' ' HB ' ' A' ' 71' ' ' THR . . . -60.79 -44.3 97.0 Favored 'General case' 0 N--CA 1.482 1.139 0 C-N-CA 123.373 0.669 . . . . 73.319999999999993 111.799 176.645 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 87.8 mt -74.76 -35.58 62.58 Favored 'General case' 0 N--CA 1.485 1.301 0 CA-C-N 115.143 -0.935 . . . . 73.400000000000006 111.038 -175.027 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . 0.498 ' O ' ' HG ' ' A' ' 21' ' ' LEU . 72.4 mt -72.05 -47.31 52.57 Favored 'General case' 0 N--CA 1.475 0.798 0 C-N-CA 122.912 0.485 . . . . 75.299999999999997 109.742 -177.721 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 79.3 p -65.1 -36.0 82.9 Favored 'General case' 0 N--CA 1.48 1.048 0 C-N-CA 123.04 0.536 . . . . 72.310000000000002 111.091 176.951 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 6.4 tp-100 -61.88 -45.57 93.16 Favored 'General case' 0 N--CA 1.475 0.79 0 C-N-CA 123.391 0.676 . . . . 74.120000000000005 110.189 174.971 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 66.5 m -58.79 -52.93 63.63 Favored 'General case' 0 C--O 1.202 -1.442 0 CA-C-N 114.929 -1.032 . . . . 75.239999999999995 109.584 174.7 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . 0.626 HD22 ' HA ' ' A' ' 33' ' ' LEU . 52.6 mt -62.22 -27.69 69.16 Favored 'General case' 0 N--CA 1.473 0.699 0 C-N-CA 123.676 0.79 . . . . 74.430000000000007 111.323 -175.963 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . 0.661 ' HA ' HD23 ' A' ' 78' ' ' LEU . 56.8 tp -70.51 -54.09 13.59 Favored 'General case' 0 N--CA 1.472 0.651 0 C-N-CA 122.953 0.501 . . . . 74.120000000000005 109.894 176.691 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . 0.447 ' O ' ' HG3' ' A' ' 27' ' ' ARG . 44.6 mt-10 -59.12 -52.74 64.43 Favored 'General case' 0 CA--C 1.545 0.776 0 O-C-N 123.929 0.768 . . . . 74.439999999999998 110.246 179.506 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . 0.446 ' HB3' ' HB2' ' A' ' 29' ' ' GLU . 92.2 mt -53.56 -42.56 67.65 Favored 'General case' 0 N--CA 1.479 1.007 0 C-N-CA 125.441 1.496 . . . . 75.109999999999999 112.174 176.578 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . 0.466 ' HB3' HD23 ' A' ' 33' ' ' LEU . . . -58.28 -47.68 82.87 Favored 'General case' 0 N--CA 1.484 1.237 0 C-N-CA 122.944 0.498 . . . . 74.019999999999996 110.901 176.918 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 90.8 mt-30 -66.59 -30.34 70.61 Favored 'General case' 0 CA--C 1.555 1.157 0 CA-C-N 114.99 -1.005 . . . . 73.329999999999998 111.141 178.721 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 27' ' ' ARG . . . . . 0.447 ' HG3' ' O ' ' A' ' 23' ' ' GLU . 94.9 mtt180 -78.38 -17.81 55.94 Favored 'General case' 0 N--CA 1.483 1.202 0 C-N-CA 123.857 0.863 . . . . 75.450000000000003 111.326 178.253 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 92.43 9.27 61.83 Favored Glycine 0 N--CA 1.475 1.283 0 C-N-CA 122.922 0.296 . . . . 63.200000000000003 113.564 -178.231 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 29' ' ' GLU . . . . . 0.446 ' HB2' ' HB3' ' A' ' 24' ' ' LEU . 5.4 mm-40 -82.58 53.72 2.42 Favored 'General case' 0 CA--C 1.55 0.973 0 C-N-CA 124.387 1.075 . . . . 72.209999999999994 111.014 178.09 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 30' ' ' TRP . . . . . . . . . . . . . 86.4 m95 -63.56 -28.89 70.25 Favored 'General case' 0 N--CA 1.483 1.187 0 C-N-CA 123.902 0.881 . . . . 73.109999999999999 111.717 -176.404 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 31' ' ' ASP . . . . . 0.477 ' O ' ' HG3' ' A' ' 35' ' ' GLN . 3.4 m-20 -53.23 -46.37 69.1 Favored 'General case' 0 N--CA 1.475 0.823 0 C-N-CA 123.603 0.761 . . . . 74.319999999999993 110.548 174.789 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . 0.427 HD11 HD23 ' A' ' 24' ' ' LEU . 64.9 mt -67.14 -28.25 67.98 Favored 'General case' 0 CA--C 1.549 0.94 0 CA-C-N 115.501 -0.772 . . . . 74.219999999999999 111.34 -176.527 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . 0.626 ' HA ' HD22 ' A' ' 21' ' ' LEU . 9.6 mp -68.61 -43.81 75.6 Favored 'General case' 0 N--CA 1.486 1.36 0 C-N-CA 123.122 0.569 . . . . 72.420000000000002 110.116 173.365 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 79.3 mt -64.36 -36.97 85.86 Favored 'General case' 0 CA--C 1.551 0.986 0 CA-C-N 115.324 -0.853 . . . . 73.319999999999993 111.348 178.844 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 35' ' ' GLN . . . . . 0.477 ' HG3' ' O ' ' A' ' 31' ' ' ASP . 90.4 mt-30 -69.74 -51.55 33.23 Favored 'General case' 0 N--CA 1.481 1.119 0 C-N-CA 123.292 0.637 . . . . 74.109999999999999 110.312 177.608 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 36' ' ' GLN . . . . . 0.423 ' HB2' HD23 ' A' ' 21' ' ' LEU . 77.2 mm-40 -70.87 -14.25 62.33 Favored 'General case' 0 N--CA 1.477 0.888 0 CA-C-N 115.248 -0.887 . . . . 73.420000000000002 112.993 -177.73 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 38.3 tt0 -45.31 -51.38 11.07 Favored 'General case' 0 N--CA 1.487 1.377 0 CA-C-N 118.287 0.494 . . . . 74.299999999999997 111.373 174.241 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 81.4 t -61.12 -54.57 33.52 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.793 0 O-C-N 123.877 0.736 . . . . 72.510000000000005 110.74 -179.027 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 21.9 m -65.51 -52.09 55.21 Favored 'General case' 0 CA--C 1.551 1.006 0 C-N-CA 123.525 0.73 . . . . 74.030000000000001 112.507 -173.441 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 44.4 t80 -60.58 -51.53 69.01 Favored 'General case' 0 N--CA 1.478 0.951 0 C-N-CA 124.792 1.237 . . . . 74.109999999999999 111.904 -179.077 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . 0.451 ' HA ' HG23 ' A' ' 44' ' ' ILE . 64.4 mt -77.81 -23.35 49.1 Favored 'General case' 0 CA--C 1.546 0.793 0 CA-C-N 116.317 -0.401 . . . . 75.319999999999993 111.604 -174.688 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 51.8 tt0 -66.54 -44.49 82.24 Favored 'General case' 0 N--CA 1.484 1.255 0 N-CA-C 109.435 -0.579 . . . . 65.450000000000003 109.435 168.7 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 43' ' ' SER . . . . . 0.42 ' O ' HG23 ' A' ' 47' ' ' VAL . 74.3 m -60.79 -43.51 98.0 Favored 'General case' 0 N--CA 1.476 0.859 0 C-N-CA 123.251 0.62 . . . . 71.329999999999998 111.582 179.465 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 44' ' ' ILE . . . . . 0.451 HG23 ' HA ' ' A' ' 41' ' ' LEU . 12.5 tt -69.02 -40.45 80.86 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.972 0 O-C-N 123.121 0.263 . . . . 75.329999999999998 110.464 -178.145 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 14.3 mm-40 -58.81 -42.51 89.34 Favored 'General case' 0 N--CA 1.484 1.251 0 C-N-CA 122.895 0.478 . . . . 70.510000000000005 110.767 172.747 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 99.4 m -62.0 -43.37 98.97 Favored 'General case' 0 N--CA 1.48 1.059 0 C-N-CA 123.919 0.888 . . . . 52.439999999999998 111.578 -179.437 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 47' ' ' VAL . . . . . 0.42 HG23 ' O ' ' A' ' 43' ' ' SER . 58.0 t -67.95 -41.89 85.07 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.012 0 C-N-CA 122.269 0.228 . . . . 75.400000000000006 110.938 178.889 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 48' ' ' MET . . . . . . . . . . . . . 78.4 mtm -68.91 -34.45 75.41 Favored 'General case' 0 N--CA 1.484 1.244 0 N-CA-C 112.479 0.548 . . . . 73.540000000000006 112.479 -177.468 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 13.1 pt-20 -82.33 -24.22 34.7 Favored 'General case' 0 N--CA 1.487 1.407 0 C-N-CA 122.355 0.262 . . . . 72.319999999999993 111.359 179.574 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 13.4 mptt -83.72 143.66 29.87 Favored 'General case' 0 N--CA 1.479 1.021 0 C-N-CA 122.914 0.486 . . . . 75.510000000000005 110.228 177.808 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 51.1 tt0 -74.55 137.48 42.44 Favored 'General case' 0 CA--C 1.542 0.645 0 CA-C-N 114.975 -1.011 . . . . 72.319999999999993 110.581 -178.869 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 17.4 m -62.95 132.76 95.09 Favored Pre-proline 0 CA--C 1.561 1.397 0 O-C-N 123.799 0.687 . . . . 62.240000000000002 110.381 175.637 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 53' ' ' PRO . . . . . 0.446 ' HG3' ' HA ' ' A' ' 4' ' ' THR . 61.0 Cg_endo -70.05 156.26 63.0 Favored 'Trans proline' 0 C--N 1.377 2.072 0 C-N-CA 122.645 2.23 . . . . 74.040000000000006 112.424 177.376 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 35.6 Cg_endo -64.5 -47.57 5.51 Favored 'Trans proline' 0 C--N 1.374 1.891 0 C-N-CA 122.803 2.335 . . . . 71.219999999999999 113.284 175.61 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . -67.14 83.34 0.12 Allowed Glycine 0 C--N 1.347 1.154 0 O-C-N 123.866 0.729 . . . . 72.420000000000002 113.613 -174.115 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 60.5 mt -124.86 103.02 11.71 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.455 0 C-N-CA 124.203 1.001 . . . . 75.319999999999993 108.455 175.164 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 81.9 p -83.67 -178.9 7.17 Favored 'General case' 0 N--CA 1.473 0.712 0 N-CA-C 109.244 -0.65 . . . . 62.340000000000003 109.244 170.547 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 27.1 tpt180 -69.04 -35.53 76.69 Favored 'General case' 0 N--CA 1.472 0.626 0 N-CA-C 110.016 -0.364 . . . . 74.310000000000002 110.016 177.261 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 35.9 m -60.49 -47.9 84.1 Favored 'General case' 0 CA--C 1.546 0.799 0 C-N-CA 123.212 0.605 . . . . 74.540000000000006 110.716 176.508 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 86.1 mt -61.75 -42.73 95.52 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.814 0 CA-C-N 115.097 -0.956 . . . . 74.310000000000002 110.405 176.347 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 64.5 tt0 -65.26 -36.3 83.7 Favored 'General case' 0 N--CA 1.476 0.864 0 C-N-CA 123.754 0.822 . . . . 74.340000000000003 111.597 -178.129 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 37.2 m-20 -75.68 -38.1 59.01 Favored 'General case' 0 N--CA 1.481 1.079 0 C-N-CA 122.831 0.452 . . . . 62.240000000000002 111.786 179.924 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 63' ' ' MET . . . . . . . . . . . . . 72.3 mtm -66.8 -51.55 54.43 Favored 'General case' 0 N--CA 1.482 1.125 0 C-N-CA 122.4 0.28 . . . . 75.450000000000003 110.446 176.649 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 64' ' ' VAL . . . . . 0.481 ' O ' HG13 ' A' ' 68' ' ' ILE . 55.5 t -59.58 -58.97 4.7 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.765 0 C-N-CA 123.524 0.73 . . . . 73.349999999999994 110.768 179.128 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -62.26 -35.94 80.53 Favored 'General case' 0 N--CA 1.488 1.475 0 C-N-CA 122.567 0.347 . . . . 64.230000000000004 111.876 -178.405 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -59.27 -41.68 96.93 Favored Glycine 0 C--N 1.347 1.172 0 N-CA-C 111.776 -0.529 . . . . 72.420000000000002 111.776 175.138 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 67' ' ' TYR . . . . . 0.43 ' CE2' ' HG2' ' A' ' 12' ' ' GLN . 10.7 m-30 -78.86 -29.81 44.75 Favored 'General case' 0 N--CA 1.467 0.422 0 N-CA-C 113.198 0.814 . . . . 74.420000000000002 113.198 -179.902 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 68' ' ' ILE . . . . . 0.481 HG13 ' O ' ' A' ' 64' ' ' VAL . 59.4 mt -64.85 -51.64 64.35 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.095 0 N-CA-C 108.414 -0.958 . . . . 74.109999999999999 108.414 174.702 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 20.2 tptm -55.21 -45.17 75.89 Favored 'General case' 0 N--CA 1.474 0.767 0 O-C-N 123.913 0.758 . . . . 73.530000000000001 110.57 175.119 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 55.4 tt0 -61.38 -45.39 94.55 Favored 'General case' 0 C--N 1.352 0.717 0 O-C-N 123.818 0.699 . . . . 75.349999999999994 110.848 -176.3 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 71' ' ' THR . . . . . 0.64 ' HB ' ' HA ' ' A' ' 15' ' ' ALA . 11.1 t -78.3 -28.1 47.4 Favored 'General case' 0 C--N 1.353 0.752 0 O-C-N 122.999 0.187 . . . . 75.540000000000006 110.999 -173.864 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 72' ' ' LEU . . . . . 0.413 ' O ' ' HB2' ' A' ' 76' ' ' GLN . 36.0 mt -73.64 -29.54 62.4 Favored 'General case' 0 N--CA 1.474 0.748 0 O-C-N 123.407 0.442 . . . . 75.230000000000004 110.658 174.966 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 33.3 t70 -77.22 -43.49 33.4 Favored 'General case' 0 N--CA 1.48 1.055 0 O-C-N 123.907 0.754 . . . . 75.319999999999993 110.678 178.927 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 74' ' ' ASN . . . . . 0.413 ' HA ' HD21 ' A' ' 22' ' ' LEU . 82.7 m-20 -59.66 -49.57 77.25 Favored 'General case' 0 N--CA 1.472 0.638 0 CA-C-N 115.613 -0.721 . . . . 65.5 109.676 176.499 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . 0.412 ' HA ' ' HB2' ' A' ' 78' ' ' LEU . 25.5 tt0 -74.7 -23.1 58.55 Favored 'General case' 0 CA--C 1.552 1.027 0 CA-C-N 115.082 -0.963 . . . . 71.239999999999995 111.494 179.609 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 76' ' ' GLN . . . . . 0.413 ' HB2' ' O ' ' A' ' 72' ' ' LEU . 8.9 tt0 -58.88 -48.31 81.84 Favored 'General case' 0 N--CA 1.488 1.426 0 N-CA-C 109.085 -0.709 . . . . 74.340000000000003 109.085 172.283 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 82.6 mt -67.56 -43.72 79.97 Favored 'General case' 0 CA--C 1.548 0.869 0 CA-C-N 115.169 -0.923 . . . . 73.120000000000005 111.183 177.451 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . 0.661 HD23 ' HA ' ' A' ' 22' ' ' LEU . 61.1 mt -62.18 -58.75 6.61 Favored 'General case' 0 N--CA 1.486 1.343 0 C-N-CA 123.35 0.66 . . . . 75.420000000000002 112.474 -178.421 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 79' ' ' LYS . . . . . 0.401 ' HG3' ' NH2' ' A' ' 98' ' ' ARG . 46.3 mmtm -64.49 -34.47 78.29 Favored 'General case' 0 CA--C 1.553 1.08 0 C-N-CA 123.159 0.584 . . . . 72.510000000000005 110.611 176.794 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -62.5 -28.3 71.01 Favored Glycine 0 C--N 1.346 1.137 0 CA-C-N 116.695 -0.23 . . . . 72.200000000000003 112.928 175.396 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 8.6 tt -86.16 -47.13 9.76 Favored 'General case' 0 CA--C 1.545 0.769 0 C-N-CA 123.871 0.868 . . . . 75.430000000000007 109.728 175.281 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 50.4 mt . . . . . 0 N--CA 1.478 0.938 0 C-N-CA 123.682 0.793 . . . . 74.209999999999994 110.667 -166.415 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 97.7 mt . . . . . 0 N--CA 1.491 1.576 0 N-CA-C 110.863 -0.051 . . . . 73.340000000000003 110.863 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 60.4 mt -59.04 -71.61 0.1 Allowed 'Isoleucine or valine' 0 N--CA 1.482 1.146 0 C-N-CA 124.023 0.929 . . . . 75.409999999999997 111.768 -178.608 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -139.53 -123.26 2.05 Favored Glycine 0 C--N 1.346 1.135 0 N-CA-C 112.099 -0.401 . . . . 52.409999999999997 112.099 -173.949 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -88.46 148.2 24.29 Favored 'General case' 0 N--CA 1.477 0.91 0 C-N-CA 122.896 0.478 . . . . 73.329999999999998 109.881 176.099 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 70.2 p 52.26 -79.88 0.01 OUTLIER 'General case' 0 CA--C 1.559 1.289 0 C-N-CA 125.79 1.636 . . . . 63.130000000000003 111.972 -175.705 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 28.1 m 66.74 -80.35 0.03 OUTLIER 'General case' 0 CA--C 1.555 1.145 0 C-N-CA 125.188 1.395 . . . . 75.530000000000001 111.905 175.779 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 98' ' ' ARG . . . . . 0.417 ' HB2' HD11 ' A' ' 44' ' ' ILE . 0.0 OUTLIER -62.64 -43.9 97.64 Favored 'General case' 0 N--CA 1.488 1.446 0 N-CA-C 112.581 0.586 . . . . 73.409999999999997 112.581 -170.243 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 3.8 pt20 -70.5 -40.06 73.78 Favored 'General case' 0 N--CA 1.477 0.885 0 C-N-CA 122.61 0.364 . . . . 74.329999999999998 110.331 -174.768 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 23.6 tptm -66.9 -46.12 75.85 Favored 'General case' 0 CA--C 1.55 0.96 0 C-N-CA 124.144 0.978 . . . . 75.239999999999995 110.579 -179.498 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 31.4 t -72.68 -39.56 66.97 Favored 'General case' 0 N--CA 1.476 0.835 0 CA-C-N 115.155 -0.93 . . . . 72.120000000000005 111.546 -174.437 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 11.2 mp -78.39 -29.69 47.41 Favored 'General case' 0 N--CA 1.485 1.281 0 C-N-CA 122.684 0.394 . . . . 73.129999999999995 111.54 -179.838 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 50.1 t-20 -64.97 -45.85 83.96 Favored 'General case' 0 N--CA 1.482 1.13 0 N-CA-C 108.563 -0.903 . . . . 65.310000000000002 108.563 172.239 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 40.3 t-20 -59.71 -47.0 87.39 Favored 'General case' 0 N--CA 1.478 0.945 0 CA-C-N 115.269 -0.878 . . . . 72.239999999999995 109.557 176.017 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -63.87 -33.63 76.13 Favored 'General case' 0 CA--C 1.538 0.503 0 CA-C-N 115.112 -0.949 . . . . 73.530000000000001 111.627 -178.488 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 106' ' ' TYR . . . . . . . . . . . . . 3.9 t80 -70.54 -54.23 12.98 Favored 'General case' 0 N--CA 1.476 0.838 0 C-N-CA 122.897 0.479 . . . . 74.310000000000002 110.071 -179.063 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -62.64 -32.03 82.02 Favored Glycine 0 C--N 1.345 1.064 0 CA-C-N 115.512 -0.767 . . . . 74.430000000000007 112.573 -178.781 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 9.7 mpt_? -83.28 -21.5 33.27 Favored 'General case' 0 C--O 1.217 -0.641 0 C-N-CA 122.935 0.494 . . . . 74.239999999999995 110.62 176.463 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 109' ' ' LEU . . . . . 0.517 HD11 ' HB2' ' A' ' 114' ' ' LEU . 43.9 tp -68.79 -31.18 70.0 Favored 'General case' 0 N--CA 1.494 1.728 0 CA-C-N 118.841 0.746 . . . . 74.030000000000001 109.603 170.633 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 25.7 t -72.81 -46.57 52.44 Favored 'General case' 0 CA--C 1.551 1.002 0 CA-C-N 115.382 -0.826 . . . . 60.5 110.205 170.592 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . -89.97 -63.0 1.27 Allowed Glycine 0 C--N 1.358 1.793 0 N-CA-C 115.67 1.028 . . . . 71.209999999999994 115.67 -172.201 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 112' ' ' MET . . . . . . . . . . . . . 54.8 mmm -92.67 -69.51 0.74 Allowed 'General case' 0 N--CA 1.49 1.542 0 CA-C-N 118.277 1.038 . . . . 72.219999999999999 113.683 -175.472 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 15.2 tp 173.27 28.76 0.0 OUTLIER 'General case' 0 N--CA 1.492 1.629 0 C-N-CA 123.34 0.656 . . . . 75.420000000000002 109.673 -169.769 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 114' ' ' LEU . . . . . 0.517 ' HB2' HD11 ' A' ' 109' ' ' LEU . 6.3 tt . . . . . 0 N--CA 1.501 2.115 0 C-N-CA 125.454 1.502 . . . . 73.310000000000002 111.267 -172.394 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 1' ' ' MET . . . . . 0.5 ' SD ' ' HB ' ' A' ' 4' ' ' THR . 13.7 tpt . . . . . 0 N--CA 1.482 1.138 0 CA-C-O 119.272 -0.394 . . . . 71.049999999999997 111.217 . . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 62.5 m -53.94 -47.4 71.29 Favored 'General case' 0 N--CA 1.489 1.498 0 C-N-CA 124.205 1.002 . . . . 75.219999999999999 112.572 -175.388 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 46.9 t -62.69 -38.25 89.68 Favored 'General case' 0 N--CA 1.481 1.124 0 C-N-CA 123.025 0.53 . . . . 72.109999999999999 110.656 177.347 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 4' ' ' THR . . . . . 0.5 ' HB ' ' SD ' ' A' ' 1' ' ' MET . 11.9 m -69.35 -33.39 73.02 Favored 'General case' 0 CA--C 1.547 0.853 0 C-N-CA 123.508 0.723 . . . . 73.409999999999997 111.059 179.552 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 62.9 t -64.58 -48.56 84.39 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.175 0 C-N-CA 123.504 0.722 . . . . 75.349999999999994 109.837 177.376 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 26.7 mm-40 -62.29 -41.03 98.16 Favored 'General case' 0 N--CA 1.477 0.923 0 O-C-N 123.904 0.752 . . . . 74.0 110.896 175.753 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 65.2 t80 -60.99 -46.4 90.9 Favored 'General case' 0 CA--C 1.547 0.855 0 C-N-CA 124.487 1.115 . . . . 73.310000000000002 110.937 -176.608 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 8' ' ' ILE . . . . . 0.428 HG13 ' O ' ' A' ' 4' ' ' THR . 85.0 mt -62.14 -52.62 58.09 Favored 'Isoleucine or valine' 0 C--N 1.356 0.882 0 O-C-N 123.778 0.674 . . . . 74.310000000000002 109.559 175.906 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 28.4 t-20 -58.67 -34.29 71.08 Favored 'General case' 0 N--CA 1.481 1.118 0 O-C-N 124.177 0.923 . . . . 65.400000000000006 111.781 -174.762 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 99.2 mtt180 -78.19 -37.07 46.48 Favored 'General case' 0 N--CA 1.471 0.616 0 C-N-CA 123.039 0.535 . . . . 74.230000000000004 111.021 -179.8 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 11' ' ' TRP . . . . . . . . . . . . . 51.3 m95 -71.59 -25.8 62.33 Favored 'General case' 0 N--CA 1.484 1.226 0 N-CA-C 111.549 0.203 . . . . 74.349999999999994 111.549 172.518 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . 0.492 ' HG2' ' CE2' ' A' ' 67' ' ' TYR . 53.0 mt-30 -67.25 -44.81 78.49 Favored 'General case' 0 C--O 1.208 -1.101 0 N-CA-C 108.163 -1.051 . . . . 73.450000000000003 108.163 170.399 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 15.0 tpt180 -60.48 -44.17 96.19 Favored 'General case' 0 CA--C 1.545 0.762 0 O-C-N 124.152 0.908 . . . . 75.109999999999999 110.816 -177.042 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 58.3 mt -68.32 -45.84 81.89 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.997 0 C-N-CA 122.601 0.36 . . . . 74.299999999999997 110.035 177.916 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . 0.571 ' HA ' ' HB ' ' A' ' 71' ' ' THR . . . -56.87 -49.0 76.81 Favored 'General case' 0 N--CA 1.484 1.251 0 C-N-CA 123.76 0.824 . . . . 71.310000000000002 111.551 -179.976 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 96.8 mt -73.33 -43.71 60.3 Favored 'General case' 0 N--CA 1.475 0.802 0 CA-C-N 114.422 -1.263 . . . . 72.129999999999995 110.675 -173.154 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . 0.483 ' O ' ' HG ' ' A' ' 21' ' ' LEU . 40.7 mt -61.05 -53.53 56.03 Favored 'General case' 0 N--CA 1.481 1.077 0 O-C-N 123.606 0.566 . . . . 74.109999999999999 110.566 178.68 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 87.2 p -65.69 -33.55 76.14 Favored 'General case' 0 N--CA 1.478 0.953 0 O-C-N 123.682 0.614 . . . . 71.430000000000007 111.231 -176.04 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 6.7 tp-100 -69.11 -37.32 78.32 Favored 'General case' 0 N--CA 1.479 0.975 0 C-N-CA 122.845 0.458 . . . . 62.130000000000003 110.836 175.601 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 68.9 m -70.05 -33.24 71.7 Favored 'General case' 0 CA--C 1.539 0.542 0 CA-C-N 115.826 -0.624 . . . . 73.239999999999995 110.66 174.423 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . 0.598 HD22 ' HA ' ' A' ' 33' ' ' LEU . 50.5 mt -73.91 -29.2 61.93 Favored 'General case' 0 N--CA 1.474 0.755 0 C-N-CA 123.146 0.578 . . . . 65.140000000000001 110.044 178.294 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . 0.699 ' HA ' HD23 ' A' ' 78' ' ' LEU . 50.3 tp -67.29 -48.46 67.58 Favored 'General case' 0 N--CA 1.47 0.545 0 C-N-CA 123.366 0.666 . . . . 73.010000000000005 109.357 174.425 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 38.3 mm-40 -51.06 -59.4 4.21 Favored 'General case' 0 N--CA 1.47 0.555 0 C-N-CA 124.169 0.988 . . . . 74.209999999999994 111.374 173.263 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . 0.401 HD22 HD11 ' A' ' 32' ' ' LEU . 93.6 mt -59.09 -46.54 88.02 Favored 'General case' 0 CA--C 1.539 0.548 0 O-C-N 124.233 0.958 . . . . 72.219999999999999 111.358 -175.585 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . 0.472 ' HB2' HD22 ' A' ' 33' ' ' LEU . . . -60.06 -45.24 93.53 Favored 'General case' 0 N--CA 1.48 1.038 0 C-N-CA 123.413 0.685 . . . . 73.120000000000005 112.047 -177.915 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 97.1 mt-30 -67.04 -32.03 72.96 Favored 'General case' 0 N--CA 1.483 1.2 0 C-N-CA 123.169 0.587 . . . . 73.099999999999994 111.269 178.15 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 92.5 mtt-85 -83.97 -2.2 56.13 Favored 'General case' 0 N--CA 1.479 1.005 0 C-N-CA 123.591 0.757 . . . . 72.510000000000005 111.239 176.716 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 92.7 2.33 67.34 Favored Glycine 0 C--N 1.356 1.679 0 C-N-CA 123.37 0.509 . . . . 71.019999999999996 114.2 171.256 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 58.9 mm-40 -83.66 70.01 10.24 Favored 'General case' 0 CA--C 1.548 0.896 0 C-N-CA 124.123 0.969 . . . . 75.349999999999994 111.563 -179.827 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 30' ' ' TRP . . . . . . . . . . . . . 65.3 m95 -69.93 -39.31 76.19 Favored 'General case' 0 N--CA 1.482 1.173 0 C-N-CA 123.983 0.913 . . . . 74.310000000000002 111.628 -176.626 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 18.2 m-20 -62.06 -31.9 72.36 Favored 'General case' 0 N--CA 1.477 0.901 0 CA-C-N 115.517 -0.765 . . . . 74.530000000000001 111.001 -177.616 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . 0.401 HD11 HD22 ' A' ' 24' ' ' LEU . 62.1 mt -70.69 -28.03 64.46 Favored 'General case' 0 CA--C 1.542 0.663 0 C-N-CA 122.569 0.347 . . . . 73.450000000000003 111.021 178.677 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . 0.598 ' HA ' HD22 ' A' ' 21' ' ' LEU . 10.1 mp -66.9 -47.55 71.43 Favored 'General case' 0 N--CA 1.493 1.69 0 C-N-CA 122.799 0.439 . . . . 73.340000000000003 109.913 169.724 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 80.2 mt -61.74 -33.62 74.37 Favored 'General case' 0 N--CA 1.481 1.118 0 O-C-N 124.282 0.989 . . . . 75.439999999999998 111.677 -178.777 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 35' ' ' GLN . . . . . 0.4 HE21 ' N ' ' A' ' 35' ' ' GLN . 0.0 OUTLIER -70.8 -55.9 7.54 Favored 'General case' 0 N--CA 1.477 0.905 0 C-N-CA 123.716 0.806 . . . . 75.409999999999997 109.58 175.396 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 36' ' ' GLN . . . . . 0.421 ' HB2' HD23 ' A' ' 21' ' ' LEU . 89.6 mm-40 -66.03 -12.69 56.99 Favored 'General case' 0 N--CA 1.482 1.128 0 O-C-N 123.84 0.713 . . . . 70.319999999999993 112.742 -176.873 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . 0.522 ' O ' ' HG ' ' A' ' 41' ' ' LEU . 43.3 tt0 -47.87 -40.41 21.47 Favored 'General case' 0 C--O 1.211 -0.95 0 C-N-CA 123.941 0.896 . . . . 74.530000000000001 111.656 172.87 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 43.1 t -58.22 -48.89 83.53 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.521 0 C-N-CA 123.052 0.541 . . . . 74.209999999999994 110.935 178.838 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 23.3 m -66.24 -38.96 89.15 Favored 'General case' 0 N--CA 1.475 0.786 0 CA-C-N 115.139 -0.937 . . . . 73.430000000000007 111.167 178.558 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 36.3 t80 -57.28 -52.05 66.9 Favored 'General case' 0 C--N 1.352 0.69 0 C-N-CA 124.887 1.275 . . . . 75.420000000000002 109.164 178.749 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . 0.522 ' HG ' ' O ' ' A' ' 37' ' ' GLU . 17.2 mt -59.38 -58.29 9.26 Favored 'General case' 0 C--N 1.363 1.193 0 O-C-N 124.702 1.251 . . . . 73.310000000000002 109.629 -178.601 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 48.1 tt0 -52.21 -49.61 63.58 Favored 'General case' 0 N--CA 1.476 0.828 0 O-C-N 123.994 0.809 . . . . 73.0 111.758 -174.094 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 36.9 m -64.85 -54.36 32.23 Favored 'General case' 0 CA--C 1.549 0.917 0 CA-C-N 115.991 -0.55 . . . . 73.010000000000005 111.859 -177.584 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 44' ' ' ILE . . . . . 0.508 HD13 HD12 ' A' ' 102' ' ' LEU . 14.1 tt -65.42 -36.23 77.2 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.105 0 C-N-CA 123.162 0.585 . . . . 64.310000000000002 111.238 -173.328 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 12.5 mm-40 -64.57 -47.36 79.02 Favored 'General case' 0 C--N 1.348 0.508 0 C-N-CA 123.773 0.829 . . . . 73.219999999999999 110.058 174.898 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 87.1 m -62.87 -26.1 68.61 Favored 'General case' 0 N--CA 1.477 0.902 0 O-C-N 123.443 0.464 . . . . 70.150000000000006 111.593 -179.314 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 47' ' ' VAL . . . . . . . . . . . . . 63.0 t -73.64 -54.05 16.29 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.008 0 O-C-N 122.173 -0.329 . . . . 72.5 110.906 172.831 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 48' ' ' MET . . . . . . . . . . . . . 70.4 mtm -72.22 -24.17 61.35 Favored 'General case' 0 N--CA 1.487 1.389 0 C-N-CA 123.104 0.562 . . . . 74.319999999999993 112.215 -171.324 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 32.7 mm-40 -82.34 -24.5 34.52 Favored 'General case' 0 N--CA 1.48 1.043 0 C-N-CA 123.96 0.904 . . . . 73.120000000000005 111.329 176.607 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 13.7 mptt -97.22 165.27 12.12 Favored 'General case' 0 N--CA 1.479 1.004 0 CA-C-O 121.802 0.81 . . . . 70.340000000000003 111.393 -175.663 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 8.5 tt0 -90.76 133.34 35.25 Favored 'General case' 0 C--O 1.24 0.594 0 CA-C-N 113.968 -1.469 . . . . 72.349999999999994 110.529 -172.81 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 89.9 m -78.26 127.94 79.67 Favored Pre-proline 0 CA--C 1.553 1.07 0 N-CA-C 108.755 -0.831 . . . . 71.099999999999994 108.755 169.754 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 57.0 Cg_endo -68.49 156.8 64.34 Favored 'Trans proline' 0 CA--C 1.562 1.901 0 C-N-CA 122.907 2.405 . . . . 65.310000000000002 112.574 176.996 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 7.6 Cg_exo -74.43 -50.06 0.16 Allowed 'Trans proline' 0 C--N 1.374 1.902 0 C-N-CA 122.798 2.332 . . . . 65.310000000000002 112.153 173.607 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . -80.86 72.64 2.68 Favored Glycine 0 C--N 1.349 1.274 0 CA-C-N 115.447 -0.797 . . . . 75.209999999999994 112.389 -177.141 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 56' ' ' ILE . . . . . 0.405 ' O ' HD11 ' A' ' 60' ' ' ILE . 70.0 mt -83.66 -85.01 0.08 OUTLIER 'Isoleucine or valine' 0 CA--C 1.559 1.291 0 N-CA-C 108.574 -0.898 . . . . 74.109999999999999 108.574 178.507 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 57' ' ' THR . . . . . 0.407 ' HG1' HD11 ' A' ' 60' ' ' ILE . 36.8 p 138.18 163.32 0.0 OUTLIER 'General case' 0 N--CA 1.495 1.794 0 C-N-CA 131.201 3.8 . . . . 73.510000000000005 107.165 167.342 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 46.0 tpt85 -60.28 -52.28 65.97 Favored 'General case' 0 CA--C 1.549 0.934 0 C-N-CA 123.82 0.848 . . . . 65.329999999999998 111.996 -174.084 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 43.4 m -63.95 -36.61 84.52 Favored 'General case' 0 N--CA 1.476 0.85 0 C-N-CA 123.426 0.691 . . . . 63.32 112.07 -178.646 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 60' ' ' ILE . . . . . 0.407 HD11 ' HG1' ' A' ' 57' ' ' THR . 78.1 mt -71.15 -35.17 57.48 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.645 0 CA-C-N 116.339 -0.392 . . . . 74.420000000000002 110.06 178.038 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 57.7 tt0 -60.88 -38.77 86.78 Favored 'General case' 0 CA--C 1.543 0.693 0 C-N-CA 123.123 0.569 . . . . 74.200000000000003 109.899 175.05 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 44.4 m-20 -65.35 -42.69 92.56 Favored 'General case' 0 N--CA 1.479 0.987 0 CA-C-N 115.909 -0.587 . . . . 73.430000000000007 112.045 175.088 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 63' ' ' MET . . . . . . . . . . . . . 71.3 mtm -68.18 -49.36 61.4 Favored 'General case' 0 N--CA 1.484 1.259 0 C-N-CA 122.566 0.346 . . . . 73.129999999999995 111.6 -178.933 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 64' ' ' VAL . . . . . 0.442 ' O ' HG13 ' A' ' 68' ' ' ILE . 70.8 t -60.14 -56.91 14.37 Favored 'Isoleucine or valine' 0 C--N 1.35 0.607 0 C-N-CA 123.879 0.872 . . . . 63.109999999999999 110.675 177.518 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -62.38 -28.2 69.61 Favored 'General case' 0 N--CA 1.489 1.498 0 O-C-N 123.405 0.44 . . . . 65.230000000000004 111.282 -179.848 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -63.65 -42.73 98.64 Favored Glycine 0 C--N 1.347 1.154 0 N-CA-C 111.753 -0.539 . . . . 64.140000000000001 111.753 172.608 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 67' ' ' TYR . . . . . 0.492 ' CE2' ' HG2' ' A' ' 12' ' ' GLN . 17.1 m-30 -79.59 -27.24 41.12 Favored 'General case' 0 N--CA 1.48 1.051 0 N-CA-C 112.855 0.687 . . . . 74.030000000000001 112.855 -179.621 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 68' ' ' ILE . . . . . 0.511 ' O ' ' HG ' ' A' ' 72' ' ' LEU . 38.9 mt -66.29 -49.59 74.63 Favored 'Isoleucine or valine' 0 C--N 1.35 0.592 0 N-CA-C 107.405 -1.331 . . . . 74.420000000000002 107.405 171.581 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 69' ' ' LYS . . . . . 0.648 ' HB2' ' HE2' ' A' ' 106' ' ' TYR . 0.3 OUTLIER -54.78 -46.75 74.46 Favored 'General case' 0 C--N 1.356 0.872 0 O-C-N 123.989 0.805 . . . . 74.299999999999997 110.619 177.66 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 62.0 tt0 -57.43 -51.11 70.75 Favored 'General case' 0 C--N 1.349 0.569 0 O-C-N 124.926 1.391 . . . . 71.340000000000003 110.506 -178.843 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 71' ' ' THR . . . . . 0.571 ' HB ' ' HA ' ' A' ' 15' ' ' ALA . 12.8 t -72.57 -19.67 61.45 Favored 'General case' 0 C--O 1.215 -0.757 0 CA-C-O 118.566 -0.731 . . . . 73.109999999999999 111.607 -179.199 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 72' ' ' LEU . . . . . 0.711 HD22 ' HB3' ' A' ' 102' ' ' LEU . 17.0 mt -79.74 -28.78 40.44 Favored 'General case' 0 N--CA 1.49 1.566 0 C-N-CA 122.945 0.498 . . . . 73.219999999999999 111.499 174.559 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 29.8 m-20 -65.53 -53.24 45.07 Favored 'General case' 0 N--CA 1.473 0.719 0 N-CA-C 107.882 -1.155 . . . . 72.319999999999993 107.882 170.519 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 35.0 m-20 -61.54 -33.53 73.99 Favored 'General case' 0 N--CA 1.477 0.879 0 CA-C-N 114.666 -1.152 . . . . 74.439999999999998 110.961 179.553 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . 0.451 ' O ' ' HG2' ' A' ' 79' ' ' LYS . 27.2 tp10 -61.84 -60.63 3.36 Favored 'General case' 0 N--CA 1.474 0.737 0 C-N-CA 124.238 1.015 . . . . 73.030000000000001 109.455 176.876 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 10.3 tt0 -63.5 -36.34 83.45 Favored 'General case' 0 CA--C 1.545 0.787 0 CA-C-N 116.108 -0.496 . . . . 72.230000000000004 111.862 -175.715 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . 0.418 ' O ' ' HB2' ' A' ' 81' ' ' LEU . 93.1 mt -68.22 -54.42 17.92 Favored 'General case' 0 N--CA 1.471 0.594 0 C-N-CA 122.84 0.456 . . . . 72.239999999999995 110.537 -179.281 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . 0.699 HD23 ' HA ' ' A' ' 22' ' ' LEU . 51.0 mt -62.24 -52.66 62.84 Favored 'General case' 0 N--CA 1.484 1.248 0 C-N-CA 122.979 0.512 . . . . 74.129999999999995 112.08 -178.532 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 79' ' ' LYS . . . . . 0.451 ' HG2' ' O ' ' A' ' 75' ' ' GLU . 26.3 mmtp -73.87 -28.08 61.39 Favored 'General case' 0 N--CA 1.476 0.86 0 O-C-N 123.716 0.635 . . . . 73.310000000000002 110.805 -173.81 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -75.42 -24.19 71.38 Favored Glycine 0 C--N 1.344 1.019 0 CA-C-N 116.02 -0.536 . . . . 64.310000000000002 112.287 171.285 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 81' ' ' LEU . . . . . 0.418 ' HB2' ' O ' ' A' ' 77' ' ' LEU . 5.1 tt -80.51 -41.96 23.33 Favored 'General case' 0 N--CA 1.475 0.791 0 C-N-CA 123.662 0.785 . . . . 71.409999999999997 109.829 178.087 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 96.4 mt . . . . . 0 N--CA 1.475 0.799 0 N-CA-C 109.754 -0.461 . . . . 71.209999999999994 109.754 -173.131 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 80.3 mt . . . . . 0 N--CA 1.469 0.516 0 N-CA-C 107.946 -1.131 . . . . 72.25 107.946 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 93' ' ' ILE . . . . . 0.438 HG23 ' HG2' ' A' ' 95' ' ' GLN . 43.8 mt -128.24 138.02 55.82 Favored 'Isoleucine or valine' 0 C--O 1.241 0.625 0 N-CA-C 107.53 -1.285 . . . . 74.519999999999996 107.53 177.383 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -63.08 -30.59 77.94 Favored Glycine 0 C--N 1.353 1.481 0 O-C-N 124.114 0.884 . . . . 64.140000000000001 114.362 -171.671 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 95' ' ' GLN . . . . . 0.438 ' HG2' HG23 ' A' ' 93' ' ' ILE . 30.0 pt20 -73.12 -0.29 13.68 Favored 'General case' 0 N--CA 1.486 1.343 0 C-N-CA 123.338 0.655 . . . . 74.450000000000003 112.407 178.437 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 20.9 m 66.12 30.27 9.48 Favored 'General case' 0 C--N 1.358 0.96 0 C-N-CA 124.987 1.315 . . . . 75.239999999999995 111.978 171.503 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 14.9 t -74.6 14.11 0.52 Allowed 'General case' 0 N--CA 1.481 1.106 0 C-N-CA 123.679 0.792 . . . . 72.239999999999995 112.923 -176.265 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 98' ' ' ARG . . . . . 0.406 ' NH1' ' HZ1' ' A' ' 79' ' ' LYS . 60.6 ttp180 -53.57 -53.09 56.7 Favored 'General case' 0 N--CA 1.476 0.857 0 C-N-CA 124.377 1.071 . . . . 73.329999999999998 111.622 179.145 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 9.7 mm100 -61.94 -47.0 86.87 Favored 'General case' 0 N--CA 1.479 0.997 0 CA-C-O 121.488 0.661 . . . . 73.439999999999998 109.63 -176.76 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 38.9 ttmt -62.36 -40.53 96.73 Favored 'General case' 0 CA--C 1.54 0.584 0 CA-C-N 113.781 -1.554 . . . . 75.299999999999997 111.729 -178.385 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 38.7 t -71.95 -44.37 63.7 Favored 'General case' 0 N--CA 1.474 0.737 0 C-N-CA 123.753 0.821 . . . . 73.329999999999998 110.942 -172.464 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 102' ' ' LEU . . . . . 0.711 ' HB3' HD22 ' A' ' 72' ' ' LEU . 8.9 mp -72.08 -37.57 69.57 Favored 'General case' 0 CA--C 1.546 0.819 0 CA-C-N 115.314 -0.857 . . . . 75.140000000000001 110.682 -179.662 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 9.8 t30 -68.82 -31.9 71.21 Favored 'General case' 0 N--CA 1.48 1.051 0 CA-C-N 115.698 -0.683 . . . . 74.519999999999996 110.503 176.176 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 49.0 t30 -74.47 -36.11 63.3 Favored 'General case' 0 N--CA 1.482 1.173 0 C-N-CA 123.596 0.759 . . . . 75.230000000000004 110.017 176.947 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -61.21 -49.59 76.52 Favored 'General case' 0 N--CA 1.475 0.794 0 C-N-CA 123.057 0.543 . . . . 61.509999999999998 110.134 177.4 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 106' ' ' TYR . . . . . 0.648 ' HE2' ' HB2' ' A' ' 69' ' ' LYS . 1.7 t80 -63.85 -48.88 74.97 Favored 'General case' 0 C--N 1.354 0.795 0 O-C-N 123.993 0.808 . . . . 73.030000000000001 109.472 175.62 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -56.93 -38.3 83.91 Favored Glycine 0 C--N 1.35 1.31 0 O-C-N 124.017 0.823 . . . . 74.239999999999995 113.772 -173.691 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 108' ' ' ARG . . . . . 0.513 ' HB3' ' HE2' ' A' ' 112' ' ' MET . 70.8 mtm180 -75.63 -42.82 50.61 Favored 'General case' 0 C--O 1.239 0.545 0 C-N-CA 123.386 0.674 . . . . 75.030000000000001 110.533 176.767 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 109' ' ' LEU . . . . . 0.406 ' HA ' ' N ' ' A' ' 114' ' ' LEU . 32.7 tp -61.82 -28.27 69.35 Favored 'General case' 0 N--CA 1.491 1.578 0 C-N-CA 123.141 0.576 . . . . 75.430000000000007 110.894 177.251 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 39.5 t -83.08 -38.62 22.26 Favored 'General case' 0 N--CA 1.452 -0.363 0 CA-C-N 114.711 -1.131 . . . . 63.219999999999999 109.449 178.144 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . -79.09 -64.99 1.85 Allowed Glycine 0 C--N 1.356 1.643 0 CA-C-O 119.214 -0.77 . . . . 74.010000000000005 113.558 -173.228 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 112' ' ' MET . . . . . 0.513 ' HE2' ' HB3' ' A' ' 108' ' ' ARG . 0.0 OUTLIER -99.32 -66.53 0.9 Allowed 'General case' 0 N--CA 1.485 1.3 0 CA-C-N 118.793 1.297 . . . . 74.540000000000006 109.525 172.637 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER 170.43 27.31 0.0 OUTLIER 'General case' 0 CA--C 1.573 1.831 0 O-C-N 124.712 1.258 . . . . 74.019999999999996 109.626 -171.633 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 114' ' ' LEU . . . . . 0.406 ' N ' ' HA ' ' A' ' 109' ' ' LEU . 0.9 OUTLIER . . . . . 0 N--CA 1.501 2.109 0 C-N-CA 125.92 1.688 . . . . 72.040000000000006 111.368 -178.324 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 25.9 ttt . . . . . 0 CA--C 1.555 1.162 0 CA-C-O 119.621 -0.228 . . . . 73.5 110.906 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 4.6 p -53.85 -35.33 61.39 Favored 'General case' 0 N--CA 1.489 1.477 0 C-N-CA 123.501 0.72 . . . . 70.439999999999998 112.471 -178.957 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 63.5 p -62.22 -48.07 81.62 Favored 'General case' 0 N--CA 1.48 1.069 0 C-N-CA 123.701 0.8 . . . . 75.219999999999999 110.555 176.524 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 22.1 m -66.26 -37.63 85.93 Favored 'General case' 0 CA--C 1.54 0.594 0 CA-C-N 115.023 -0.99 . . . . 75.129999999999995 111.194 -179.876 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 78.1 t -65.75 -44.63 93.11 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.936 0 C-N-CA 123.192 0.597 . . . . 75.230000000000004 110.433 -179.175 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 11.7 mm-40 -61.54 -41.57 97.54 Favored 'General case' 0 C--N 1.353 0.761 0 O-C-N 123.581 0.551 . . . . 74.430000000000007 110.703 173.782 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 44.6 t80 -63.05 -47.85 81.18 Favored 'General case' 0 N--CA 1.481 1.101 0 C-N-CA 123.852 0.861 . . . . 75.439999999999998 111.439 -176.958 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 8' ' ' ILE . . . . . 0.417 ' O ' ' HG3' ' A' ' 12' ' ' GLN . 73.1 mt -65.0 -41.54 92.37 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.033 0 C-N-CA 123.682 0.793 . . . . 75.25 109.541 177.472 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 4.0 t-20 -65.76 -29.15 69.62 Favored 'General case' 0 N--CA 1.479 1.022 0 C-N-CA 123.756 0.822 . . . . 72.510000000000005 111.104 179.23 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . 0.729 ' HB3' HG21 ' A' ' 47' ' ' VAL . 57.6 mtt180 -78.55 -30.64 46.99 Favored 'General case' 0 N--CA 1.469 0.477 0 C-N-CA 123.689 0.796 . . . . 74.129999999999995 110.381 177.431 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 11' ' ' TRP . . . . . 0.492 ' HH2' ' HG ' ' A' ' 102' ' ' LEU . 76.8 m95 -74.98 -27.57 60.21 Favored 'General case' 0 N--CA 1.477 0.902 0 CA-C-O 119.492 -0.29 . . . . 61.130000000000003 110.945 170.381 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . 0.417 ' HG3' ' O ' ' A' ' 8' ' ' ILE . 51.5 mt-30 -64.49 -44.18 91.8 Favored 'General case' 0 C--O 1.212 -0.896 0 N-CA-C 107.744 -1.206 . . . . 64.140000000000001 107.744 168.959 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 30.9 tpt180 -59.04 -50.98 72.02 Favored 'General case' 0 CA--C 1.547 0.862 0 O-C-N 124.087 0.867 . . . . 74.349999999999994 110.689 -177.222 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 56.4 mt -63.97 -49.53 81.26 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.313 0 C-N-CA 122.666 0.387 . . . . 72.239999999999995 110.335 179.187 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . 0.577 ' HA ' ' HB ' ' A' ' 71' ' ' THR . . . -59.06 -43.51 91.72 Favored 'General case' 0 N--CA 1.485 1.31 0 C-N-CA 123.864 0.865 . . . . 71.019999999999996 112.115 -176.373 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 95.1 mt -77.41 -39.6 46.49 Favored 'General case' 0 N--CA 1.481 1.082 0 CA-C-N 115.248 -0.887 . . . . 75.340000000000003 110.658 -174.848 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . 0.494 ' O ' ' HG ' ' A' ' 21' ' ' LEU . 53.9 mt -64.45 -47.04 80.55 Favored 'General case' 0 N--CA 1.483 1.186 0 O-C-N 123.302 0.377 . . . . 75.230000000000004 110.511 179.718 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 18' ' ' SER . . . . . 0.416 ' HB3' ' CE1' ' A' ' 40' ' ' TYR . 71.7 p -68.65 -35.5 77.34 Favored 'General case' 0 N--CA 1.477 0.882 0 O-C-N 123.768 0.667 . . . . 71.510000000000005 111.143 178.592 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 19' ' ' GLN . . . . . 0.488 ' O ' ' HG2' ' A' ' 23' ' ' GLU . 6.3 tp-100 -62.41 -41.17 98.48 Favored 'General case' 0 C--N 1.357 0.913 0 O-C-N 123.586 0.554 . . . . 74.409999999999997 109.878 174.702 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 68.6 m -63.37 -49.19 74.81 Favored 'General case' 0 C--N 1.352 0.702 0 O-C-N 123.818 0.699 . . . . 71.340000000000003 109.288 175.564 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . 0.494 ' HG ' ' O ' ' A' ' 17' ' ' LEU . 83.8 mt -57.22 -31.53 65.59 Favored 'General case' 0 N--CA 1.479 1.016 0 C-N-CA 123.811 0.844 . . . . 72.340000000000003 110.665 179.995 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . 0.553 ' HA ' HD21 ' A' ' 78' ' ' LEU . 37.9 tp -73.33 -52.45 13.84 Favored 'General case' 0 CA--C 1.543 0.674 0 O-C-N 123.862 0.727 . . . . 75.25 110.727 178.491 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . 0.568 ' HB3' ' NH1' ' A' ' 27' ' ' ARG . 46.5 mm-40 -51.79 -55.2 21.21 Favored 'General case' 0 N--CA 1.491 1.586 0 CA-C-O 122.159 0.981 . . . . 72.420000000000002 110.454 177.734 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . 0.422 HD23 HD12 ' A' ' 32' ' ' LEU . 70.4 mt -56.36 -51.36 68.59 Favored 'General case' 0 CA--C 1.545 0.77 0 CA-C-N 112.878 -1.965 . . . . 74.430000000000007 110.425 179.79 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . 0.461 ' HB3' HD23 ' A' ' 33' ' ' LEU . . . -60.91 -41.52 96.26 Favored 'General case' 0 N--CA 1.49 1.527 0 C-N-CA 123.396 0.679 . . . . 75.219999999999999 112.68 -175.962 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 94.6 mt-30 -64.51 -38.22 90.27 Favored 'General case' 0 N--CA 1.478 0.943 0 C-N-CA 123.537 0.735 . . . . 74.430000000000007 110.264 179.265 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 27' ' ' ARG . . . . . 0.568 ' NH1' ' HB3' ' A' ' 23' ' ' GLU . 58.0 mtt180 -81.65 -15.66 53.85 Favored 'General case' 0 N--CA 1.488 1.453 0 N-CA-C 112.306 0.484 . . . . 73.049999999999997 112.306 175.517 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 88.79 24.93 31.21 Favored Glycine 0 C--N 1.349 1.305 0 N-CA-C 114.527 0.571 . . . . 74.549999999999997 114.527 177.417 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 49.7 mm-40 -84.33 60.55 6.05 Favored 'General case' 0 N--CA 1.477 0.895 0 C-N-CA 124.239 1.016 . . . . 65.409999999999997 110.699 175.491 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 30' ' ' TRP . . . . . 0.46 ' O ' ' HG ' ' A' ' 34' ' ' LEU . 88.5 m95 -66.17 -30.57 71.07 Favored 'General case' 0 N--CA 1.477 0.88 0 C-N-CA 123.911 0.884 . . . . 74.540000000000006 112.575 -171.952 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 4.8 m-20 -61.18 -40.64 94.65 Favored 'General case' 0 N--CA 1.483 1.197 0 C-N-CA 123.332 0.653 . . . . 74.409999999999997 110.563 175.642 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . 0.422 HD12 HD23 ' A' ' 24' ' ' LEU . 64.2 mt -71.6 -26.54 62.63 Favored 'General case' 0 CA--C 1.543 0.683 0 CA-C-N 115.211 -0.904 . . . . 72.319999999999993 110.396 179.842 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . 0.461 HD23 ' HB3' ' A' ' 25' ' ' ALA . 7.6 mp -66.29 -44.59 83.11 Favored 'General case' 0 N--CA 1.489 1.492 0 N-CA-C 110.476 -0.194 . . . . 73.430000000000007 110.476 169.039 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . 0.46 ' HG ' ' O ' ' A' ' 30' ' ' TRP . 83.0 mt -63.63 -34.53 78.04 Favored 'General case' 0 N--CA 1.48 1.058 0 O-C-N 123.896 0.747 . . . . 75.340000000000003 111.124 -178.548 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 96.8 mt-30 -65.71 -58.04 6.62 Favored 'General case' 0 N--CA 1.483 1.186 0 CA-C-O 121.168 0.508 . . . . 74.319999999999993 110.033 174.687 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 36' ' ' GLN . . . . . 0.402 ' HB2' HD22 ' A' ' 21' ' ' LEU . 80.1 mm-40 -73.82 -10.39 59.62 Favored 'General case' 0 N--CA 1.477 0.896 0 CA-C-N 114.885 -1.052 . . . . 74.299999999999997 112.654 -174.207 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 37.1 tt0 -53.38 -52.31 59.7 Favored 'General case' 0 N--CA 1.475 0.79 0 C-N-CA 124.591 1.156 . . . . 73.439999999999998 110.692 175.224 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 46.8 t -58.7 -43.97 88.89 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.141 0 O-C-N 123.76 0.662 . . . . 75.230000000000004 110.179 -179.18 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 42.7 m -56.95 -53.23 60.4 Favored 'General case' 0 CA--C 1.546 0.809 0 CA-C-N 115.403 -0.817 . . . . 74.200000000000003 111.631 176.211 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 40' ' ' TYR . . . . . 0.416 ' CE1' ' HB3' ' A' ' 18' ' ' SER . 58.2 t80 -63.0 -49.62 73.94 Favored 'General case' 0 N--CA 1.474 0.758 0 C-N-CA 123.797 0.839 . . . . 71.549999999999997 111.159 -173.502 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . 0.671 ' HB3' HD23 ' A' ' 92' ' ' LEU . 72.2 mt -60.23 -48.34 82.15 Favored 'General case' 0 C--O 1.257 1.486 0 C-N-CA 124.48 1.112 . . . . 73.450000000000003 111.285 -178.022 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 49.8 tt0 -61.07 -44.03 98.0 Favored 'General case' 0 N--CA 1.475 0.786 0 CA-C-N 115.557 -0.747 . . . . 73.150000000000006 110.43 -179.85 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 43' ' ' SER . . . . . 0.508 ' O ' HG23 ' A' ' 47' ' ' VAL . 69.4 m -60.94 -57.7 11.56 Favored 'General case' 0 C--N 1.354 0.767 0 CA-C-N 115.378 -0.828 . . . . 73.420000000000002 111.442 -178.511 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 44' ' ' ILE . . . . . 0.677 HG12 ' HE1' ' A' ' 48' ' ' MET . 3.9 tt -58.38 -41.22 80.84 Favored 'Isoleucine or valine' 0 C--O 1.251 1.156 0 C-N-CA 123.266 0.626 . . . . 72.150000000000006 111.375 -174.682 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 40.9 mm-40 -59.19 -49.8 76.47 Favored 'General case' 0 C--N 1.367 1.333 0 N-CA-C 111.542 0.201 . . . . 75.109999999999999 111.542 173.442 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 46' ' ' THR . . . . . 0.48 ' O ' ' HD3' ' A' ' 50' ' ' LYS . 97.3 m -55.72 -41.78 74.36 Favored 'General case' 0 N--CA 1.482 1.155 0 O-C-N 123.958 0.786 . . . . 70.340000000000003 111.617 -178.292 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 47' ' ' VAL . . . . . 0.729 HG21 ' HB3' ' A' ' 10' ' ' ARG . 26.2 t -70.05 -37.71 73.04 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.997 0 C-N-CA 122.884 0.474 . . . . 73.329999999999998 110.623 -177.94 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 48' ' ' MET . . . . . 0.677 ' HE1' HG12 ' A' ' 44' ' ' ILE . 79.1 mtm -72.22 -19.93 61.64 Favored 'General case' 0 N--CA 1.481 1.113 0 CA-C-N 116.183 -0.462 . . . . 75.120000000000005 111.76 175.375 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 48.2 mt-10 -83.02 -7.47 59.66 Favored 'General case' 0 N--CA 1.49 1.57 0 C-N-CA 123.285 0.634 . . . . 74.109999999999999 111.759 172.918 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . 0.48 ' HD3' ' O ' ' A' ' 46' ' ' THR . 12.7 mptt -95.44 132.0 40.98 Favored 'General case' 0 N--CA 1.482 1.169 0 C-N-CA 123.485 0.714 . . . . 75.329999999999998 110.235 177.691 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 34.2 tt0 -68.57 151.99 45.99 Favored 'General case' 0 C--O 1.247 0.923 0 C-N-CA 123.524 0.729 . . . . 74.5 109.389 172.787 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 20.0 m -59.69 118.85 35.3 Favored Pre-proline 0 CA--C 1.556 1.185 0 CA-C-O 118.744 -0.646 . . . . 73.319999999999993 109.792 173.471 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 53' ' ' PRO . . . . . 0.529 ' HD2' HD11 ' A' ' 56' ' ' ILE . 31.6 Cg_exo -62.72 153.62 71.1 Favored 'Trans proline' 0 C--N 1.377 2.075 0 C-N-CA 122.602 2.202 . . . . 60.539999999999999 112.79 177.844 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 22.7 Cg_exo -66.98 -47.98 2.14 Favored 'Trans proline' 0 C--N 1.373 1.861 0 C-N-CA 123.199 2.599 . . . . 73.349999999999994 112.506 177.591 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . -83.94 59.86 4.91 Favored Glycine 0 C--N 1.346 1.092 0 CA-C-N 115.966 -0.561 . . . . 65.129999999999995 114.07 -173.233 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 56' ' ' ILE . . . . . 0.529 HD11 ' HD2' ' A' ' 53' ' ' PRO . 56.1 mt -100.72 116.23 43.79 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.763 0 N-CA-C 108.133 -1.062 . . . . 63.130000000000003 108.133 169.971 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 71.6 p -101.73 -166.88 1.34 Allowed 'General case' 0 CA--C 1.545 0.763 0 C-N-CA 124.178 0.991 . . . . 73.310000000000002 109.523 177.634 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 16.6 tpt85 -61.25 -63.42 1.29 Allowed 'General case' 0 N--CA 1.474 0.773 0 C-N-CA 123.715 0.806 . . . . 75.109999999999999 111.017 -179.828 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 26.0 m -54.73 -38.0 66.6 Favored 'General case' 0 N--CA 1.482 1.142 0 C-N-CA 123.482 0.713 . . . . 62.020000000000003 111.778 -178.41 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 60' ' ' ILE . . . . . 0.4 HG21 HD13 ' A' ' 8' ' ' ILE . 80.2 mt -63.51 -46.72 94.35 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.703 0 C-N-CA 123.481 0.712 . . . . 73.349999999999994 110.655 178.079 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 61' ' ' GLN . . . . . 0.537 ' HG3' ' HG ' ' A' ' 109' ' ' LEU . 50.9 tt0 -61.77 -39.35 91.36 Favored 'General case' 0 N--CA 1.476 0.849 0 C-N-CA 123.073 0.549 . . . . 73.510000000000005 111.106 179.896 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 9.0 m-20 -69.15 -37.42 78.23 Favored 'General case' 0 N--CA 1.479 1.002 0 C-N-CA 123.175 0.59 . . . . 74.019999999999996 111.944 179.298 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 63' ' ' MET . . . . . . . . . . . . . 72.1 mtm -68.42 -49.79 57.46 Favored 'General case' 0 N--CA 1.48 1.029 0 C-N-CA 122.41 0.284 . . . . 74.049999999999997 110.564 177.477 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 64' ' ' VAL . . . . . 0.501 ' O ' HG13 ' A' ' 68' ' ' ILE . 60.6 t -60.49 -59.76 3.65 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.664 0 C-N-CA 123.873 0.869 . . . . 72.319999999999993 110.216 -179.87 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . 0.554 ' HB3' HD22 ' A' ' 109' ' ' LEU . . . -60.36 -38.56 84.23 Favored 'General case' 0 N--CA 1.483 1.179 0 O-C-N 123.635 0.584 . . . . 74.530000000000001 111.571 -179.24 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -58.59 -42.36 96.06 Favored Glycine 0 C--N 1.35 1.307 0 O-C-N 123.218 0.324 . . . . 70.030000000000001 112.457 175.961 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 12.3 m-85 -70.35 -36.26 74.08 Favored 'General case' 0 N--CA 1.473 0.702 0 C-N-CA 123.083 0.553 . . . . 72.120000000000005 111.681 177.007 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 68' ' ' ILE . . . . . 0.502 ' O ' ' HG ' ' A' ' 72' ' ' LEU . 65.0 mt -60.02 -56.61 16.31 Favored 'Isoleucine or valine' 0 C--N 1.361 1.072 0 N-CA-C 108.852 -0.796 . . . . 75.230000000000004 108.852 177.785 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 69' ' ' LYS . . . . . 0.487 ' HB2' ' CE2' ' A' ' 106' ' ' TYR . 28.3 tptp -53.69 -47.27 70.63 Favored 'General case' 0 C--N 1.354 0.771 0 O-C-N 124.283 0.989 . . . . 75.420000000000002 110.001 179.997 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 59.8 tt0 -58.93 -48.04 82.89 Favored 'General case' 0 C--N 1.35 0.603 0 O-C-N 124.653 1.221 . . . . 75.349999999999994 111.364 -176.292 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 71' ' ' THR . . . . . 0.577 ' HB ' ' HA ' ' A' ' 15' ' ' ALA . 10.5 t -76.99 -22.68 52.79 Favored 'General case' 0 N--CA 1.475 0.805 0 O-C-N 123.433 0.458 . . . . 74.209999999999994 111.234 -175.949 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 72' ' ' LEU . . . . . 0.502 ' HG ' ' O ' ' A' ' 68' ' ' ILE . 21.1 mt -74.08 -34.81 64.12 Favored 'General case' 0 N--CA 1.476 0.845 0 O-C-N 123.261 0.351 . . . . 73.400000000000006 110.261 173.756 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 73.4 m-20 -75.39 -38.44 59.94 Favored 'General case' 0 N--CA 1.473 0.679 0 O-C-N 124.092 0.87 . . . . 75.349999999999994 110.535 176.492 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 74' ' ' ASN . . . . . 0.41 ' O ' ' HG ' ' A' ' 78' ' ' LEU . 92.4 m-20 -60.25 -51.87 67.71 Favored 'General case' 0 N--CA 1.48 1.068 0 N-CA-C 109.112 -0.699 . . . . 75.299999999999997 109.112 176.819 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . 0.662 ' HG3' ' HZ3' ' A' ' 79' ' ' LYS . 5.4 tt0 -59.95 -42.83 94.9 Favored 'General case' 0 C--N 1.356 0.872 0 CA-C-N 115.518 -0.764 . . . . 75.230000000000004 110.869 176.031 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 7.8 tt0 -57.09 -43.84 82.6 Favored 'General case' 0 N--CA 1.486 1.337 0 C-N-CA 123.985 0.914 . . . . 72.150000000000006 111.415 -179.201 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 94.5 mt -70.6 -37.32 73.88 Favored 'General case' 0 CA--C 1.536 0.412 0 CA-C-N 115.112 -0.949 . . . . 64.310000000000002 110.814 -179.473 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . 0.553 HD21 ' HA ' ' A' ' 22' ' ' LEU . 72.2 mt -64.84 -42.21 95.11 Favored 'General case' 0 N--CA 1.481 1.106 0 O-C-N 123.699 0.625 . . . . 75.140000000000001 111.419 174.928 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 79' ' ' LYS . . . . . 0.662 ' HZ3' ' HG3' ' A' ' 75' ' ' GLU . 47.3 mmtm -74.24 -34.84 63.77 Favored 'General case' 0 N--CA 1.476 0.865 0 C-N-CA 123.139 0.576 . . . . 74.439999999999998 110.674 -176.148 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -70.71 -37.11 67.08 Favored Glycine 0 C--N 1.347 1.194 0 O-C-N 123.91 0.756 . . . . 72.109999999999999 111.672 175.828 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 6.7 tt -65.57 -56.83 10.15 Favored 'General case' 0 N--CA 1.481 1.109 0 C-N-CA 123.839 0.855 . . . . 71.530000000000001 108.881 177.373 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 80.7 mt . . . . . 0 CA--C 1.543 0.696 0 C-N-CA 124.248 1.019 . . . . 72.430000000000007 111.934 -178.44 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 92' ' ' LEU . . . . . 0.671 HD23 ' HB3' ' A' ' 41' ' ' LEU . 89.7 mt . . . . . 0 N--CA 1.473 0.681 0 N-CA-C 108.493 -0.929 . . . . 73.530000000000001 108.493 . . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 38.3 mt -112.72 -20.32 6.28 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.872 0 C-N-CA 124.852 1.261 . . . . 74.099999999999994 108.449 175.434 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 102.35 -62.76 0.48 Allowed Glycine 0 C--N 1.353 1.473 0 CA-C-N 115.962 -0.563 . . . . 72.109999999999999 111.915 173.972 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 9.9 pt20 -77.25 -171.81 2.2 Favored 'General case' 0 N--CA 1.482 1.165 0 C-N-CA 123.255 0.622 . . . . 61.520000000000003 111.935 -176.942 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 71.7 p -74.81 11.67 1.01 Allowed 'General case' 0 N--CA 1.472 0.647 0 CA-C-O 117.847 -1.073 . . . . 74.099999999999994 113.797 -174.944 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 96.0 m -48.58 -42.19 33.0 Favored 'General case' 0 N--CA 1.483 1.199 0 C-N-CA 124.173 0.989 . . . . 74.230000000000004 112.397 177.528 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 98' ' ' ARG . . . . . 0.548 ' HD2' HD12 ' A' ' 92' ' ' LEU . 18.5 mtm105 -68.11 -53.65 23.81 Favored 'General case' 0 N--CA 1.475 0.815 0 C-N-CA 124.074 0.95 . . . . 75.329999999999998 109.696 -176.687 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 7.7 tp-100 -61.93 -35.16 77.57 Favored 'General case' 0 N--CA 1.477 0.913 0 C-N-CA 124.605 1.162 . . . . 74.409999999999997 110.617 -178.226 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -72.75 -39.44 66.83 Favored 'General case' 0 N--CA 1.472 0.656 0 C-N-CA 124.645 1.178 . . . . 73.439999999999998 108.966 179.734 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 42.6 t -69.65 -38.3 77.07 Favored 'General case' 0 C--N 1.352 0.678 0 C-N-CA 124.008 0.923 . . . . 75.209999999999994 111.585 -176.265 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 102' ' ' LEU . . . . . 0.492 ' HG ' ' HH2' ' A' ' 11' ' ' TRP . 10.8 mp -80.8 -32.7 35.2 Favored 'General case' 0 N--CA 1.472 0.628 0 O-C-N 123.551 0.532 . . . . 75.150000000000006 110.649 -179.838 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 25.0 t-20 -68.61 -37.34 79.7 Favored 'General case' 0 N--CA 1.486 1.325 0 CA-C-O 120.975 0.416 . . . . 71.430000000000007 109.958 172.852 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 104' ' ' ASN . . . . . 0.668 ' HA ' HH21 ' A' ' 108' ' ' ARG . 28.4 t-20 -65.92 -44.84 83.95 Favored 'General case' 0 C--N 1.356 0.89 0 N-CA-C 108.812 -0.811 . . . . 74.540000000000006 108.812 174.661 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -56.5 -41.8 77.29 Favored 'General case' 0 C--N 1.346 0.433 0 O-C-N 124.052 0.845 . . . . 75.430000000000007 110.973 178.164 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 106' ' ' TYR . . . . . 0.487 ' CE2' ' HB2' ' A' ' 69' ' ' LYS . 17.2 t80 -68.02 -58.32 4.71 Favored 'General case' 0 CA--C 1.547 0.83 0 C-N-CA 123.339 0.656 . . . . 73.230000000000004 110.973 -176.642 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -65.34 -37.04 93.45 Favored Glycine 0 C--N 1.353 1.478 0 CA-C-N 115.797 -0.638 . . . . 74.299999999999997 112.413 -173.232 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 108' ' ' ARG . . . . . 0.668 HH21 ' HA ' ' A' ' 104' ' ' ASN . 0.0 OUTLIER -80.34 -22.73 41.14 Favored 'General case' 0 CA--C 1.538 0.507 0 C-N-CA 123.514 0.726 . . . . 75.530000000000001 110.673 179.422 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 109' ' ' LEU . . . . . 0.554 HD22 ' HB3' ' A' ' 65' ' ' ALA . 41.0 tp -67.15 -37.24 83.45 Favored 'General case' 0 N--CA 1.498 1.974 0 CA-C-O 121.402 0.62 . . . . 74.329999999999998 109.543 170.55 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 30.4 t -70.7 -36.15 73.12 Favored 'General case' 0 CA--C 1.55 0.976 0 CA-C-N 114.418 -1.265 . . . . 63.229999999999997 110.295 173.529 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . -90.33 -68.25 1.2 Allowed Glycine 0 C--N 1.371 2.509 0 N-CA-C 115.759 1.064 . . . . 74.430000000000007 115.759 -176.511 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 112' ' ' MET . . . . . . . . . . . . . 5.5 tmm? -95.97 -62.99 1.2 Allowed 'General case' 0 N--CA 1.498 1.967 0 CA-C-N 118.911 1.356 . . . . 74.329999999999998 111.078 -177.49 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 5.8 mt 157.47 66.38 0.0 OUTLIER 'General case' 0 N--CA 1.494 1.749 0 C-N-CA 128.141 2.576 . . . . 71.230000000000004 107.198 179.526 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 114' ' ' LEU . . . . . 0.434 ' H ' ' HA ' ' A' ' 109' ' ' LEU . 7.1 tt . . . . . 0 N--CA 1.483 1.211 0 C-N-CA 126.958 2.103 . . . . 72.310000000000002 112.698 171.12 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 18.5 ptt? . . . . . 0 N--CA 1.479 1.001 0 CA-C-O 120.923 0.392 . . . . 74.310000000000002 110.739 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 8.8 t -55.52 -36.22 66.49 Favored 'General case' 0 N--CA 1.487 1.412 0 C-N-CA 123.268 0.627 . . . . 75.319999999999993 111.27 -178.205 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 18.4 m -55.11 -50.07 70.16 Favored 'General case' 0 C--N 1.356 0.855 0 C-N-CA 124.382 1.073 . . . . 72.230000000000004 110.85 174.416 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 4' ' ' THR . . . . . 0.457 HG22 HD12 ' A' ' 60' ' ' ILE . 24.2 m -69.14 -39.09 79.04 Favored 'General case' 0 C--O 1.217 -0.616 0 CA-C-N 115.19 -0.914 . . . . 74.109999999999999 111.741 -177.508 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 74.6 t -61.91 -47.37 93.52 Favored 'Isoleucine or valine' 0 C--O 1.255 1.378 0 C-N-CA 122.698 0.399 . . . . 72.329999999999998 110.143 -177.276 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 27.6 mm-40 -61.43 -48.35 81.6 Favored 'General case' 0 C--N 1.351 0.639 0 CA-C-N 115.669 -0.696 . . . . 73.329999999999998 110.114 174.862 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 38.4 t80 -54.18 -49.88 68.31 Favored 'General case' 0 N--CA 1.485 1.31 0 C-N-CA 124.633 1.173 . . . . 75.219999999999999 111.472 -176.568 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 8' ' ' ILE . . . . . 0.449 HG13 ' O ' ' A' ' 4' ' ' THR . 64.0 mt -64.02 -47.33 90.87 Favored 'Isoleucine or valine' 0 C--N 1.359 0.988 0 C-N-CA 123.506 0.722 . . . . 74.219999999999999 110.123 179.624 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 2.9 t-20 -62.15 -28.94 70.0 Favored 'General case' 0 N--CA 1.484 1.251 0 O-C-N 123.559 0.537 . . . . 74.400000000000006 111.272 -176.811 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 96.9 mtt180 -72.82 -40.27 65.95 Favored 'General case' 0 CA--C 1.543 0.692 0 C-N-CA 123.803 0.841 . . . . 74.109999999999999 110.584 174.347 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 11' ' ' TRP . . . . . . . . . . . . . 84.0 m95 -65.8 -29.96 70.52 Favored 'General case' 0 N--CA 1.486 1.328 0 C-N-CA 122.801 0.441 . . . . 74.200000000000003 111.591 172.99 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . 0.444 ' HG2' ' CE2' ' A' ' 67' ' ' TYR . 38.2 mt-30 -65.21 -46.29 81.31 Favored 'General case' 0 C--O 1.211 -0.953 0 N-CA-C 107.796 -1.187 . . . . 72.310000000000002 107.796 173.352 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 61.6 ttt180 -59.62 -41.27 90.03 Favored 'General case' 0 CA--C 1.547 0.851 0 O-C-N 124.034 0.834 . . . . 75.340000000000003 111.71 -179.767 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 77.9 mt -64.41 -49.91 78.65 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.478 0 C-N-CA 123.098 0.559 . . . . 75.409999999999997 110.094 178.537 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . 0.46 ' HA ' ' HB ' ' A' ' 71' ' ' THR . . . -57.36 -46.55 83.22 Favored 'General case' 0 N--CA 1.478 0.933 0 C-N-CA 124.629 1.172 . . . . 74.299999999999997 111.656 178.869 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 89.5 mt -80.17 -34.33 37.63 Favored 'General case' 0 N--CA 1.477 0.896 0 CA-C-N 114.579 -1.191 . . . . 72.329999999999998 111.402 -171.968 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . 0.496 ' O ' ' HG ' ' A' ' 21' ' ' LEU . 21.0 mt -67.71 -49.46 62.54 Favored 'General case' 0 N--CA 1.481 1.092 0 N-CA-C 109.642 -0.503 . . . . 74.430000000000007 109.642 177.542 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 85.0 p -62.56 -37.72 87.25 Favored 'General case' 0 N--CA 1.478 0.953 0 O-C-N 123.513 0.508 . . . . 72.409999999999997 111.052 178.588 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 6.2 tp-100 -56.95 -46.92 81.78 Favored 'General case' 0 C--N 1.358 0.951 0 C-N-CA 123.497 0.719 . . . . 74.120000000000005 110.159 172.163 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 63.9 m -65.7 -42.11 91.56 Favored 'General case' 0 C--O 1.213 -0.819 0 O-C-N 123.707 0.629 . . . . 75.430000000000007 110.688 179.018 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . 0.496 ' HG ' ' O ' ' A' ' 17' ' ' LEU . 87.1 mt -63.43 -34.23 77.3 Favored 'General case' 0 N--CA 1.476 0.832 0 C-N-CA 123.56 0.744 . . . . 65.329999999999998 109.882 -178.032 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . 0.57 ' HA ' HD21 ' A' ' 78' ' ' LEU . 56.1 tp -66.97 -54.72 19.16 Favored 'General case' 0 C--N 1.352 0.682 0 C-N-CA 123.535 0.734 . . . . 75.450000000000003 110.12 176.026 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 9.5 mm-40 -50.82 -52.58 39.82 Favored 'General case' 0 N--CA 1.479 1.01 0 C-N-CA 124.341 1.056 . . . . 75.239999999999995 111.439 178.15 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . 0.475 HD21 HD11 ' A' ' 32' ' ' LEU . 62.4 mt -70.15 -34.54 73.15 Favored 'General case' 0 CA--C 1.539 0.557 0 C-N-CA 124.602 1.161 . . . . 74.019999999999996 111.078 -173.334 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . 0.406 ' HB3' HD22 ' A' ' 33' ' ' LEU . . . -60.64 -44.01 96.89 Favored 'General case' 0 N--CA 1.479 1.012 0 CA-C-O 120.902 0.382 . . . . 63.25 110.65 173.754 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 95.1 mt-30 -69.48 -31.79 70.29 Favored 'General case' 0 CA--C 1.549 0.918 0 CA-C-N 115.303 -0.862 . . . . 55.240000000000002 111.518 179.016 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 78.3 mtt180 -90.48 -2.57 57.93 Favored 'General case' 0 N--CA 1.483 1.198 0 C-N-CA 123.756 0.822 . . . . 71.239999999999995 112.315 -177.834 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 85.38 10.04 78.12 Favored Glycine 0 N--CA 1.479 1.566 0 N-CA-C 114.433 0.533 . . . . 74.109999999999999 114.433 174.891 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 29' ' ' GLU . . . . . 0.405 ' HB2' ' HB3' ' A' ' 24' ' ' LEU . 15.3 mm-40 -90.37 55.08 2.93 Favored 'General case' 0 N--CA 1.478 0.942 0 C-N-CA 124.79 1.236 . . . . 71.439999999999998 111.126 178.261 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 30' ' ' TRP . . . . . 0.459 ' HA ' HD11 ' A' ' 33' ' ' LEU . 83.5 m95 -63.02 -23.38 67.43 Favored 'General case' 0 N--CA 1.491 1.58 0 C-N-CA 123.875 0.87 . . . . 74.430000000000007 111.6 179.441 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 4.1 m-20 -55.61 -47.83 75.89 Favored 'General case' 0 N--CA 1.473 0.702 0 C-N-CA 124.984 1.314 . . . . 74.310000000000002 110.18 175.22 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . 0.475 HD11 HD21 ' A' ' 24' ' ' LEU . 82.0 mt -72.3 -24.33 61.31 Favored 'General case' 0 CA--C 1.544 0.723 0 CA-C-N 114.306 -1.315 . . . . 64.420000000000002 110.954 -177.872 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . 0.47 ' HA ' HD23 ' A' ' 21' ' ' LEU . 9.4 mp -66.23 -45.18 81.57 Favored 'General case' 0 C--N 1.363 1.184 0 N-CA-C 110.101 -0.333 . . . . 73.230000000000004 110.101 171.228 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 88.8 mt -65.54 -38.63 90.17 Favored 'General case' 0 N--CA 1.482 1.136 0 C-N-CA 123.325 0.65 . . . . 75.239999999999995 111.784 -178.677 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 95.7 mt-30 -71.09 -49.68 41.81 Favored 'General case' 0 N--CA 1.478 0.938 0 C-N-CA 122.588 0.355 . . . . 74.5 110.681 179.211 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 85.2 mm-40 -73.95 -14.2 61.01 Favored 'General case' 0 N--CA 1.483 1.182 0 C-N-CA 123.102 0.561 . . . . 71.450000000000003 112.464 179.314 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . 0.437 ' O ' ' HG ' ' A' ' 41' ' ' LEU . 42.9 tt0 -51.92 -52.13 52.1 Favored 'General case' 0 N--CA 1.484 1.236 0 C-N-CA 123.94 0.896 . . . . 73.420000000000002 111.32 176.485 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 62.9 t -56.63 -47.84 81.59 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.755 0 O-C-N 123.889 0.743 . . . . 74.430000000000007 110.661 -178.856 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 32.0 m -67.04 -37.0 83.31 Favored 'General case' 0 CA--C 1.538 0.508 0 CA-C-N 115.455 -0.793 . . . . 75.549999999999997 111.801 -177.695 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 43.8 t80 -70.69 -49.47 46.77 Favored 'General case' 0 N--CA 1.47 0.541 0 C-N-CA 123.248 0.619 . . . . 72.140000000000001 110.65 -176.875 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . 0.529 HD22 HD22 ' A' ' 92' ' ' LEU . 22.2 mt -68.36 -41.88 80.03 Favored 'General case' 0 N--CA 1.478 0.939 0 O-C-N 123.851 0.719 . . . . 74.129999999999995 110.144 -176.749 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 41.1 tt0 -57.43 -56.03 27.16 Favored 'General case' 0 C--N 1.358 0.965 0 O-C-N 123.924 0.765 . . . . 75.319999999999993 110.788 176.119 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 43' ' ' SER . . . . . 0.501 ' O ' HG23 ' A' ' 47' ' ' VAL . 73.0 m -57.54 -56.98 14.93 Favored 'General case' 0 C--N 1.352 0.704 0 O-C-N 124.046 0.841 . . . . 74.209999999999994 110.692 -177.587 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 14.6 tt -59.2 -40.8 82.01 Favored 'Isoleucine or valine' 0 C--N 1.354 0.803 0 O-C-N 123.799 0.687 . . . . 72.540000000000006 111.39 -172.139 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 38.1 mm-40 -64.07 -47.55 79.65 Favored 'General case' 0 C--N 1.358 0.964 0 CA-C-O 119.435 -0.317 . . . . 71.439999999999998 111.412 176.429 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 18.3 m -66.53 -27.6 67.89 Favored 'General case' 0 CA--C 1.551 0.983 0 O-C-N 123.457 0.473 . . . . 73.510000000000005 111.849 -177.222 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 47' ' ' VAL . . . . . 0.501 HG23 ' O ' ' A' ' 43' ' ' SER . 59.1 t -80.97 -38.37 16.81 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.384 0 C-N-CA 123.335 0.654 . . . . 72.239999999999995 110.612 -179.194 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 48' ' ' MET . . . . . . . . . . . . . 68.5 mtm -73.13 -21.9 60.63 Favored 'General case' 0 N--CA 1.486 1.374 0 C-N-CA 122.755 0.422 . . . . 74.129999999999995 110.407 172.894 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 17.2 tp10 -88.0 -18.74 28.34 Favored 'General case' 0 N--CA 1.481 1.096 0 C-N-CA 124.251 1.02 . . . . 73.200000000000003 110.167 174.793 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 14.2 tppt? -78.36 138.76 38.7 Favored 'General case' 0 C--O 1.24 0.581 0 N-CA-C 109.27 -0.641 . . . . 73.230000000000004 109.27 -179.852 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 8.6 tt0 -68.5 124.99 25.08 Favored 'General case' 0 C--O 1.241 0.639 0 CA-C-N 115.423 -0.808 . . . . 71.310000000000002 109.558 -177.899 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 52' ' ' THR . . . . . 0.444 HG22 ' HB3' ' A' ' 114' ' ' LEU . 29.7 m -61.08 121.34 61.82 Favored Pre-proline 0 CA--C 1.555 1.155 0 C-N-CA 123.672 0.789 . . . . 73.209999999999994 110.612 178.686 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 55.7 Cg_endo -67.19 155.88 68.69 Favored 'Trans proline' 0 C--N 1.376 1.988 0 C-N-CA 122.414 2.076 . . . . 72.109999999999999 111.764 176.484 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 18.1 Cg_exo -67.08 -52.87 0.56 Allowed 'Trans proline' 0 C--N 1.376 1.992 0 C-N-CA 122.399 2.066 . . . . 75.319999999999993 111.72 177.574 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . -70.11 86.8 0.31 Allowed Glycine 0 C--N 1.349 1.251 0 O-C-N 124.09 0.869 . . . . 63.240000000000002 112.912 -175.618 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 56' ' ' ILE . . . . . 0.484 ' O ' ' HB ' ' A' ' 60' ' ' ILE . 71.9 mt -115.5 -50.28 4.82 Favored 'Isoleucine or valine' 0 C--O 1.209 -1.044 0 C-N-CA 124.646 1.178 . . . . 75.040000000000006 108.99 176.416 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 10.4 p 60.43 -177.37 0.1 Allowed 'General case' 0 CA--C 1.557 1.23 0 C-N-CA 125.872 1.669 . . . . 64.010000000000005 111.077 -178.2 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -55.57 -42.85 75.3 Favored 'General case' 0 N--CA 1.479 1.011 0 C-N-CA 124.345 1.058 . . . . 71.439999999999998 110.144 176.168 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 49.3 m -61.76 -53.97 48.83 Favored 'General case' 0 CA--C 1.545 0.788 0 CA-C-N 115.697 -0.683 . . . . 32.149999999999999 112.759 -173.264 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 60' ' ' ILE . . . . . 0.484 ' HB ' ' O ' ' A' ' 56' ' ' ILE . 26.1 mt -79.28 -23.74 12.52 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.182 0 N-CA-C 109.631 -0.507 . . . . 75.409999999999997 109.631 -174.648 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 61' ' ' GLN . . . . . 0.446 ' HG3' ' HG ' ' A' ' 109' ' ' LEU . 53.2 tt0 -58.75 -48.23 81.92 Favored 'General case' 0 C--N 1.358 0.942 0 N-CA-C 109.866 -0.42 . . . . 75.349999999999994 109.866 172.005 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 3.4 m-20 -71.56 -37.68 71.05 Favored 'General case' 0 CA--C 1.547 0.842 0 CA-C-N 115.973 -0.558 . . . . 72.219999999999999 112.416 178.616 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 63' ' ' MET . . . . . . . . . . . . . 69.2 mtm -64.93 -59.79 3.78 Favored 'General case' 0 N--CA 1.488 1.466 0 CA-C-N 117.775 0.261 . . . . 74.349999999999994 111.284 179.172 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 64' ' ' VAL . . . . . 0.453 ' O ' HG13 ' A' ' 68' ' ' ILE . 55.5 t -57.64 -49.44 80.64 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.033 0 C-N-CA 123.516 0.726 . . . . 74.230000000000004 111.984 178.263 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . 0.473 ' HB3' HD21 ' A' ' 109' ' ' LEU . . . -64.7 -33.21 75.41 Favored 'General case' 0 N--CA 1.495 1.795 0 CA-C-N 118.977 0.808 . . . . 50.200000000000003 111.279 -179.638 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -64.36 -39.02 96.61 Favored Glycine 0 C--N 1.347 1.19 0 N-CA-C 112.182 -0.367 . . . . 52.439999999999998 112.182 174.795 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 67' ' ' TYR . . . . . 0.454 ' HB3' ' HB3' ' A' ' 15' ' ' ALA . 14.2 m-30 -65.48 -42.6 92.06 Favored 'General case' 0 N--CA 1.471 0.61 0 C-N-CA 123.636 0.774 . . . . 74.219999999999999 110.752 175.306 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 68' ' ' ILE . . . . . 0.524 ' O ' ' HG ' ' A' ' 72' ' ' LEU . 78.5 mt -59.34 -49.97 81.57 Favored 'Isoleucine or valine' 0 C--N 1.355 0.836 0 O-C-N 124.619 1.199 . . . . 74.230000000000004 109.38 178.689 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 69' ' ' LYS . . . . . 0.568 ' HB2' ' HE2' ' A' ' 106' ' ' TYR . 27.9 tptp -57.37 -46.09 83.76 Favored 'General case' 0 N--CA 1.472 0.666 0 C-N-CA 124.013 0.925 . . . . 74.239999999999995 110.393 -179.26 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 53.5 tt0 -59.35 -48.21 82.49 Favored 'General case' 0 C--N 1.354 0.802 0 CA-C-N 115.306 -0.861 . . . . 72.319999999999993 111.058 -179.411 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 71' ' ' THR . . . . . 0.46 ' HB ' ' HA ' ' A' ' 15' ' ' ALA . 9.2 t -76.08 -23.74 55.03 Favored 'General case' 0 C--O 1.24 0.584 0 O-C-N 123.401 0.438 . . . . 74.120000000000005 110.227 -174.438 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 72' ' ' LEU . . . . . 0.623 ' HA ' HH12 ' A' ' 98' ' ' ARG . 39.5 mt -61.37 -51.73 67.56 Favored 'General case' 0 C--N 1.363 1.158 0 N-CA-C 108.648 -0.871 . . . . 74.209999999999994 108.648 171.796 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 28.6 m-20 -64.51 -48.57 74.65 Favored 'General case' 0 N--CA 1.484 1.231 0 O-C-N 123.945 0.778 . . . . 75.510000000000005 112.429 179.716 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 94.6 m-20 -52.02 -56.63 13.09 Favored 'General case' 0 N--CA 1.491 1.593 0 C-N-CA 124.03 0.932 . . . . 63.200000000000003 110.729 -179.989 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 15.6 tt0 -70.49 -30.52 67.32 Favored 'General case' 0 CA--C 1.551 1.014 0 CA-C-N 114.787 -1.097 . . . . 74.239999999999995 110.762 -176.527 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 8.4 tt0 -64.22 -41.26 97.11 Favored 'General case' 0 N--CA 1.487 1.419 0 C-N-CA 123.49 0.716 . . . . 75.340000000000003 110.77 176.744 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 95.2 mt -67.26 -38.99 86.03 Favored 'General case' 0 N--CA 1.47 0.57 0 CA-C-N 115.7 -0.682 . . . . 73.420000000000002 109.929 178.085 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . 0.57 HD21 ' HA ' ' A' ' 22' ' ' LEU . 74.9 mt -58.78 -51.25 70.8 Favored 'General case' 0 C--N 1.357 0.898 0 CA-C-N 115.867 -0.606 . . . . 74.5 111.454 172.042 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 2.9 mptm? -61.33 -38.97 88.81 Favored 'General case' 0 N--CA 1.481 1.122 0 C-N-CA 123.956 0.902 . . . . 73.150000000000006 111.313 -179.442 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -67.94 -29.83 73.82 Favored Glycine 0 C--N 1.341 0.857 0 O-C-N 123.738 0.649 . . . . 62.130000000000003 112.204 177.429 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 81' ' ' LEU . . . . . 0.417 HD21 ' HH2' ' A' ' 30' ' ' TRP . 4.3 tt -78.2 -39.28 41.13 Favored 'General case' 0 CA--C 1.554 1.115 0 C-N-CA 123.5 0.72 . . . . 72.319999999999993 109.582 176.088 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 82' ' ' LEU . . . . . 0.42 ' HG ' ' O ' ' A' ' 78' ' ' LEU . 94.0 mt . . . . . 0 N--CA 1.48 1.073 0 C-N-CA 123.184 0.594 . . . . 74.129999999999995 111.057 -171.997 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 92' ' ' LEU . . . . . 0.529 HD22 HD22 ' A' ' 41' ' ' LEU . 11.9 mt . . . . . 0 N--CA 1.476 0.875 0 N-CA-C 110.552 -0.166 . . . . 70.0 110.552 . . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 49.4 mt -77.24 -43.52 31.13 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.244 0 N-CA-C 109.076 -0.713 . . . . 75.420000000000002 109.076 173.14 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -171.62 -29.41 0.02 OUTLIER Glycine 0 C--N 1.346 1.115 0 CA-C-N 115.14 -0.936 . . . . 75.430000000000007 112.289 -179.226 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 14.1 pt20 -140.99 -177.41 5.08 Favored 'General case' 0 N--CA 1.481 1.102 0 C-N-CA 123.61 0.764 . . . . 73.519999999999996 110.112 179.544 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 50.2 m -66.91 83.01 0.11 Allowed 'General case' 0 CA--C 1.541 0.615 0 C-N-CA 124.233 1.013 . . . . 74.329999999999998 112.249 -174.618 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 89.7 m -88.12 -41.85 12.75 Favored 'General case' 0 CA--C 1.54 0.558 0 C-N-CA 123.744 0.818 . . . . 65.239999999999995 110.075 176.526 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 98' ' ' ARG . . . . . 0.623 HH12 ' HA ' ' A' ' 72' ' ' LEU . 1.7 tmt_? -49.88 -57.65 6.99 Favored 'General case' 0 N--CA 1.478 0.948 0 C-N-CA 125.075 1.35 . . . . 72.310000000000002 112.929 -165.57 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 8.9 tt0 -60.51 -52.4 65.35 Favored 'General case' 0 N--CA 1.477 0.916 0 O-C-N 123.789 0.681 . . . . 64.430000000000007 110.861 -170.318 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 65.5 tttp -64.78 -42.99 94.65 Favored 'General case' 0 CA--C 1.542 0.673 0 O-C-N 124.15 0.906 . . . . 73.329999999999998 111.473 -178.397 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 26.5 t -69.37 -40.24 77.55 Favored 'General case' 0 N--CA 1.467 0.419 0 C-N-CA 123.426 0.691 . . . . 71.109999999999999 111.613 -173.122 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 102' ' ' LEU . . . . . 0.464 ' HG ' HG23 ' A' ' 68' ' ' ILE . 3.4 tp -80.38 -34.65 36.19 Favored 'General case' 0 N--CA 1.471 0.6 0 C-N-CA 122.787 0.435 . . . . 72.409999999999997 110.47 -176.372 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 7.6 t30 -63.41 -40.03 96.11 Favored 'General case' 0 N--CA 1.479 1.016 0 C-N-CA 122.933 0.493 . . . . 64.340000000000003 109.907 172.902 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 12.0 t30 -67.07 -41.28 86.69 Favored 'General case' 0 N--CA 1.473 0.722 0 CA-C-N 115.651 -0.704 . . . . 71.519999999999996 110.126 177.188 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -59.14 -45.17 91.66 Favored 'General case' 0 N--CA 1.47 0.566 0 O-C-N 123.598 0.561 . . . . 55.329999999999998 110.402 177.44 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 106' ' ' TYR . . . . . 0.568 ' HE2' ' HB2' ' A' ' 69' ' ' LYS . 19.9 t80 -60.71 -55.4 33.67 Favored 'General case' 0 C--N 1.355 0.821 0 O-C-N 124.046 0.841 . . . . 74.409999999999997 110.477 178.999 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -66.09 -44.04 92.13 Favored Glycine 0 C--N 1.349 1.302 0 O-C-N 124.318 1.011 . . . . 43.140000000000001 112.494 -171.058 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 20.4 mmm180 -67.1 -33.3 75.18 Favored 'General case' 0 CA--C 1.541 0.633 0 C-N-CA 123.258 0.623 . . . . 75.5 111.048 177.512 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 109' ' ' LEU . . . . . 0.545 ' HA ' ' N ' ' A' ' 114' ' ' LEU . 35.6 tp -68.33 -43.43 77.57 Favored 'General case' 0 N--CA 1.485 1.287 0 C-N-CA 122.819 0.448 . . . . 62.100000000000001 110.359 176.327 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 33.2 t -68.06 -31.73 71.57 Favored 'General case' 0 CA--C 1.54 0.595 0 CA-C-N 114.701 -1.136 . . . . 72.109999999999999 110.296 -178.326 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . -89.64 -65.18 1.25 Allowed Glycine 0 C--N 1.36 1.898 0 CA-C-O 119.109 -0.828 . . . . 73.239999999999995 113.941 -179.502 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 112' ' ' MET . . . . . 0.465 ' O ' ' HG ' ' A' ' 113' ' ' LEU . 10.0 tpt -98.1 -72.52 0.65 Allowed 'General case' 0 N--CA 1.486 1.347 0 CA-C-N 118.609 1.204 . . . . 74.109999999999999 112.273 174.637 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 113' ' ' LEU . . . . . 0.465 ' HG ' ' O ' ' A' ' 112' ' ' MET . 12.2 mt 171.25 45.88 0.0 OUTLIER 'General case' 0 N--CA 1.505 2.305 0 C-N-CA 125.445 1.498 . . . . 73.230000000000004 109.561 -174.406 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 114' ' ' LEU . . . . . 0.545 ' N ' ' HA ' ' A' ' 109' ' ' LEU . 2.1 tt . . . . . 0 N--CA 1.507 2.388 0 C-N-CA 126.633 1.973 . . . . 71.049999999999997 111.343 172.075 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 24.6 ptm . . . . . 0 N--CA 1.483 1.221 0 CA-C-O 119.706 -0.188 . . . . 71.349999999999994 111.327 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 26.2 p -56.05 -39.65 72.35 Favored 'General case' 0 N--CA 1.484 1.267 0 C-N-CA 123.286 0.634 . . . . 75.239999999999995 111.739 -179.934 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 48.3 m -68.46 -30.76 69.7 Favored 'General case' 0 CA--C 1.54 0.593 0 C-N-CA 123.375 0.67 . . . . 74.420000000000002 111.637 177.124 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' THR . . . . . 0.493 ' HA ' ' HG3' ' A' ' 53' ' ' PRO . 12.4 m -74.42 -35.99 63.43 Favored 'General case' 0 C--N 1.351 0.668 0 C-N-CA 123.04 0.536 . . . . 73.120000000000005 111.226 177.207 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 48.7 t -66.27 -40.29 86.47 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.745 0 N-CA-C 109.248 -0.649 . . . . 74.140000000000001 109.248 175.478 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . 0.503 ' O ' ' HG3' ' A' ' 10' ' ' ARG . 5.0 tm-20 -65.34 -37.21 86.37 Favored 'General case' 0 CA--C 1.542 0.652 0 CA-C-N 114.466 -1.243 . . . . 65.109999999999999 110.062 176.157 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' PHE . . . . . 0.417 ' O ' ' HB2' ' A' ' 10' ' ' ARG . 69.0 t80 -67.88 -44.62 76.63 Favored 'General case' 0 N--CA 1.48 1.069 0 C-N-CA 124.516 1.126 . . . . 65.120000000000005 112.103 178.4 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . 0.474 HD12 HG22 ' A' ' 60' ' ' ILE . 83.9 mt -65.49 -37.68 80.63 Favored 'Isoleucine or valine' 0 C--O 1.214 -0.813 0 N-CA-C 108.752 -0.832 . . . . 74.450000000000003 108.752 175.611 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 28.4 t-20 -65.2 -28.87 69.69 Favored 'General case' 0 N--CA 1.482 1.131 0 C-N-CA 124.594 1.157 . . . . 75.349999999999994 110.937 175.762 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . 0.595 ' HB3' HG23 ' A' ' 47' ' ' VAL . 65.4 mtt180 -62.56 -53.78 49.53 Favored 'General case' 0 N--CA 1.484 1.251 0 CA-C-O 121.766 0.793 . . . . 74.239999999999995 109.216 172.408 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' TRP . . . . . . . . . . . . . 98.3 m95 -73.89 -20.62 60.35 Favored 'General case' 0 N--CA 1.475 0.801 0 CA-C-N 114.927 -1.033 . . . . 74.230000000000004 112.741 -177.963 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . 0.441 ' HG3' ' O ' ' A' ' 8' ' ' ILE . 58.7 mt-30 -72.18 -38.86 69.01 Favored 'General case' 0 C--O 1.214 -0.813 0 N-CA-C 108.795 -0.817 . . . . 63.32 108.795 170.117 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 16.5 tpt180 -58.57 -52.34 66.07 Favored 'General case' 0 CA--C 1.54 0.563 0 O-C-N 123.812 0.695 . . . . 74.030000000000001 109.702 178.996 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' ILE . . . . . 0.445 HG23 ' OG1' ' A' ' 71' ' ' THR . 22.8 mt -65.04 -46.83 90.21 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.24 0 O-C-N 123.459 0.474 . . . . 72.450000000000003 111.03 179.507 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . 0.602 ' HA ' ' HB ' ' A' ' 71' ' ' THR . . . -58.54 -46.78 86.1 Favored 'General case' 0 N--CA 1.491 1.604 0 C-N-CA 123.703 0.801 . . . . 63.450000000000003 111.919 -177.278 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 82.7 mt -70.26 -44.6 68.11 Favored 'General case' 0 N--CA 1.479 1.014 0 CA-C-N 114.891 -1.049 . . . . 75.129999999999995 111.101 -176.445 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . 0.482 ' O ' ' HG ' ' A' ' 21' ' ' LEU . 74.3 mt -64.83 -45.29 86.78 Favored 'General case' 0 CA--C 1.544 0.717 0 O-C-N 123.607 0.567 . . . . 74.040000000000006 111.092 -179.531 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 80.4 p -64.68 -39.01 92.93 Favored 'General case' 0 N--CA 1.484 1.248 0 C-N-CA 123.159 0.584 . . . . 74.450000000000003 111.392 -179.36 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 6.0 tp-100 -58.98 -48.3 82.04 Favored 'General case' 0 C--N 1.354 0.777 0 O-C-N 123.972 0.795 . . . . 74.25 110.079 175.045 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 38.4 m -56.74 -50.97 70.65 Favored 'General case' 0 C--N 1.354 0.793 0 O-C-N 124.14 0.9 . . . . 74.349999999999994 110.188 177.517 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . 0.491 HD21 ' HA ' ' A' ' 33' ' ' LEU . 81.1 mt -65.32 -30.23 71.06 Favored 'General case' 0 CA--C 1.538 0.507 0 C-N-CA 123.754 0.822 . . . . 73.409999999999997 111.163 -175.497 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . 0.682 ' HA ' HD21 ' A' ' 78' ' ' LEU . 63.9 tp -64.72 -58.13 7.09 Favored 'General case' 0 C--N 1.353 0.752 0 N-CA-C 109.534 -0.543 . . . . 75.340000000000003 109.534 176.989 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 39.3 mt-10 -57.12 -47.28 81.49 Favored 'General case' 0 N--CA 1.475 0.779 0 O-C-N 124.396 1.06 . . . . 73.150000000000006 110.991 -178.015 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 95.9 mt -64.33 -40.33 95.68 Favored 'General case' 0 N--CA 1.473 0.714 0 C-N-CA 123.899 0.88 . . . . 74.150000000000006 111.442 -177.372 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . 0.442 ' HB1' HD23 ' A' ' 33' ' ' LEU . . . -61.42 -44.73 96.62 Favored 'General case' 0 N--CA 1.476 0.863 0 C-N-CA 122.895 0.478 . . . . 73.519999999999996 110.847 178.195 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 89.6 mt-30 -64.84 -30.81 71.83 Favored 'General case' 0 N--CA 1.477 0.883 0 O-C-N 124.088 0.868 . . . . 62.43 111.2 178.351 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 53.6 mtt180 -83.16 -5.79 59.25 Favored 'General case' 0 N--CA 1.481 1.106 0 C-N-CA 123.568 0.747 . . . . 73.200000000000003 112.071 177.271 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 86.67 7.65 78.21 Favored Glycine 0 C--N 1.349 1.271 0 N-CA-C 114.027 0.371 . . . . 63.450000000000003 114.027 178.144 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 11.2 mm-40 -82.37 57.63 3.74 Favored 'General case' 0 CA--C 1.546 0.791 0 C-N-CA 124.281 1.032 . . . . 71.340000000000003 111.251 178.382 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' TRP . . . . . . . . . . . . . 84.7 m95 -63.43 -32.04 73.37 Favored 'General case' 0 N--CA 1.477 0.917 0 C-N-CA 123.656 0.782 . . . . 72.129999999999995 110.942 -178.769 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 10.1 m-20 -56.66 -42.17 78.52 Favored 'General case' 0 N--CA 1.476 0.846 0 C-N-CA 124.032 0.933 . . . . 75.549999999999997 110.706 177.846 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 83.3 mt -66.12 -34.51 78.21 Favored 'General case' 0 N--CA 1.474 0.742 0 C-N-CA 123.395 0.678 . . . . 72.109999999999999 111.199 179.743 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . 0.491 ' HA ' HD21 ' A' ' 21' ' ' LEU . 9.9 mp -66.22 -39.61 89.71 Favored 'General case' 0 N--CA 1.481 1.101 0 C-N-CA 122.563 0.345 . . . . 74.420000000000002 110.299 173.023 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 84.9 mt -73.66 -22.94 59.81 Favored 'General case' 0 N--CA 1.478 0.945 0 C-N-CA 123.504 0.722 . . . . 73.329999999999998 111.661 -179.091 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 48.7 mt-30 -85.98 -32.73 21.37 Favored 'General case' 0 N--CA 1.486 1.372 0 C-N-CA 123.515 0.726 . . . . 70.019999999999996 110.774 176.09 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 25.5 mm-40 -86.19 -12.66 49.2 Favored 'General case' 0 N--CA 1.479 1.02 0 C-N-CA 124.017 0.927 . . . . 72.5 111.521 176.136 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . 0.739 ' HG3' ' HB3' ' A' ' 89' ' ' LEU . 36.3 tt0 -44.57 -65.0 0.58 Allowed 'General case' 0 N--CA 1.477 0.889 0 C-N-CA 124.543 1.137 . . . . 72.510000000000005 113.055 -178.531 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 93.2 t -65.49 -33.26 62.44 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.692 0 C-N-CA 122.955 0.502 . . . . 72.510000000000005 110.866 -175.911 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 57.7 m -63.85 -38.31 90.62 Favored 'General case' 0 N--CA 1.476 0.831 0 C-N-CA 123.069 0.548 . . . . 75.540000000000006 111.415 175.406 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 42.4 t80 -78.11 -43.04 30.09 Favored 'General case' 0 C--N 1.344 0.348 0 C-N-CA 123.326 0.65 . . . . 75.200000000000003 110.547 -174.705 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . 0.464 ' HG ' ' O ' ' A' ' 37' ' ' GLU . 63.2 mt -64.95 -41.52 95.42 Favored 'General case' 0 C--O 1.245 0.854 0 O-C-N 123.955 0.785 . . . . 74.430000000000007 109.554 178.529 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 53.9 tt0 -56.71 -53.4 58.22 Favored 'General case' 0 C--N 1.358 0.962 0 CA-C-N 115.157 -0.929 . . . . 72.420000000000002 110.014 173.713 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 43' ' ' SER . . . . . 0.546 ' O ' HG22 ' A' ' 47' ' ' VAL . 71.5 m -56.45 -57.16 13.51 Favored 'General case' 0 C--N 1.35 0.607 0 O-C-N 124.216 0.947 . . . . 73.519999999999996 111.658 -178.606 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 16.8 tt -61.03 -41.03 87.64 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.812 0 O-C-N 123.728 0.642 . . . . 73.219999999999999 111.335 -172.328 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 30.6 mt-10 -72.24 -37.07 69.23 Favored 'General case' 0 N--CA 1.477 0.89 0 N-CA-C 111.975 0.361 . . . . 74.510000000000005 111.975 178.824 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 46' ' ' THR . . . . . 0.494 ' O ' ' HB2' ' A' ' 50' ' ' LYS . 96.0 m -57.65 -40.2 78.74 Favored 'General case' 0 N--CA 1.486 1.36 0 C-N-CA 123.008 0.523 . . . . 71.239999999999995 110.589 174.424 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 47' ' ' VAL . . . . . 0.595 HG23 ' HB3' ' A' ' 10' ' ' ARG . 87.3 t -68.69 -49.56 63.49 Favored 'Isoleucine or valine' 0 C--O 1.243 0.724 0 C-N-CA 124.201 1.001 . . . . 74.409999999999997 111.371 -179.517 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 48' ' ' MET . . . . . . . . . . . . . 78.6 mtm -62.12 -43.74 98.18 Favored 'General case' 0 N--CA 1.482 1.165 0 O-C-N 123.877 0.735 . . . . 72.400000000000006 111.399 -176.608 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 46.0 mt-10 -85.02 4.12 35.36 Favored 'General case' 0 N--CA 1.476 0.84 0 C-N-CA 123.721 0.808 . . . . 72.450000000000003 111.944 -174.779 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . 0.494 ' HB2' ' O ' ' A' ' 46' ' ' THR . 1.5 tppt? -103.62 135.82 44.49 Favored 'General case' 0 N--CA 1.476 0.834 0 N-CA-C 109.56 -0.533 . . . . 74.150000000000006 109.56 179.117 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 9.0 tt0 -69.42 148.61 49.35 Favored 'General case' 0 CA--C 1.547 0.831 0 C-N-CA 123.653 0.781 . . . . 75.040000000000006 111.856 -169.615 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 15.9 m -68.68 130.58 91.78 Favored Pre-proline 0 CA--C 1.554 1.104 0 C-N-CA 124.511 1.124 . . . . 73.219999999999999 110.461 176.548 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 53' ' ' PRO . . . . . 0.493 ' HG3' ' HA ' ' A' ' 4' ' ' THR . 94.7 Cg_endo -75.38 155.89 41.25 Favored 'Trans proline' 0 CA--C 1.557 1.662 0 C-N-CA 122.591 2.194 . . . . 75.310000000000002 112.289 178.0 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_endo -70.03 -46.86 0.97 Allowed 'Trans proline' 0 C--N 1.369 1.643 0 C-N-CA 122.764 2.31 . . . . 75.420000000000002 113.413 179.029 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . -79.92 70.74 2.85 Favored Glycine 0 C--N 1.348 1.227 0 N-CA-C 114.336 0.495 . . . . 75.439999999999998 114.336 -170.179 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 56' ' ' ILE . . . . . 0.711 HG21 HD11 ' A' ' 113' ' ' LEU . 8.3 mm -101.75 142.86 15.5 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.906 0 C-N-CA 124.012 0.925 . . . . 75.430000000000007 108.781 175.518 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 72.9 p -113.18 174.32 5.96 Favored 'General case' 0 N--CA 1.478 0.93 0 N-CA-C 109.005 -0.739 . . . . 74.409999999999997 109.005 170.134 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 16.0 tpt180 -59.13 -42.74 91.36 Favored 'General case' 0 N--CA 1.478 0.934 0 C-N-CA 123.128 0.571 . . . . 72.120000000000005 109.584 176.197 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 19.8 m -56.64 -50.61 71.54 Favored 'General case' 0 C--N 1.356 0.88 0 C-N-CA 123.972 0.909 . . . . 75.420000000000002 111.082 176.733 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 60' ' ' ILE . . . . . 0.474 HG22 HD12 ' A' ' 8' ' ' ILE . 99.1 mt -60.28 -42.17 89.61 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.809 0 O-C-N 123.972 0.795 . . . . 75.230000000000004 110.985 179.483 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 54.7 tt0 -58.73 -47.34 84.93 Favored 'General case' 0 CA--C 1.542 0.656 0 C-N-CA 123.51 0.724 . . . . 72.310000000000002 110.785 -179.715 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 14.4 m-20 -72.77 -32.82 65.89 Favored 'General case' 0 N--CA 1.48 1.027 0 N-CA-C 112.827 0.677 . . . . 71.010000000000005 112.827 -178.077 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 63' ' ' MET . . . . . . . . . . . . . 58.7 mtm -74.48 -41.82 60.08 Favored 'General case' 0 N--CA 1.485 1.317 0 CA-C-N 117.568 0.167 . . . . 74.439999999999998 110.938 179.673 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 64' ' ' VAL . . . . . 0.492 ' O ' HG13 ' A' ' 68' ' ' ILE . 56.1 t -64.0 -54.14 35.21 Favored 'Isoleucine or valine' 0 C--N 1.352 0.71 0 C-N-CA 123.492 0.717 . . . . 74.329999999999998 109.616 176.253 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -62.04 -32.7 73.24 Favored 'General case' 0 N--CA 1.477 0.923 0 O-C-N 123.639 0.587 . . . . 75.310000000000002 111.129 178.306 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -63.26 -40.2 98.75 Favored Glycine 0 C--N 1.348 1.205 0 N-CA-C 111.689 -0.564 . . . . 53.32 111.689 174.627 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 16.8 m-30 -75.21 -32.3 61.13 Favored 'General case' 0 C--N 1.352 0.685 0 C-N-CA 123.573 0.749 . . . . 73.340000000000003 111.722 178.702 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 68' ' ' ILE . . . . . 0.497 ' O ' ' HG ' ' A' ' 72' ' ' LEU . 62.1 mt -63.17 -56.15 19.05 Favored 'Isoleucine or valine' 0 C--N 1.357 0.903 0 N-CA-C 107.979 -1.119 . . . . 75.049999999999997 107.979 175.345 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 51.7 tptt -53.11 -43.51 66.94 Favored 'General case' 0 N--CA 1.477 0.896 0 C-N-CA 124.622 1.169 . . . . 75.209999999999994 111.527 177.481 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 61.5 tt0 -59.9 -52.39 65.63 Favored 'General case' 0 N--CA 1.472 0.629 0 CA-C-N 115.731 -0.668 . . . . 75.329999999999998 111.249 179.982 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 71' ' ' THR . . . . . 0.602 ' HB ' ' HA ' ' A' ' 15' ' ' ALA . 11.4 t -74.95 -27.07 60.03 Favored 'General case' 0 C--N 1.35 0.619 0 O-C-N 123.285 0.366 . . . . 73.340000000000003 110.275 -173.703 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 72' ' ' LEU . . . . . 0.497 ' HG ' ' O ' ' A' ' 68' ' ' ILE . 19.4 mt -61.78 -55.41 30.39 Favored 'General case' 0 C--N 1.358 0.949 0 N-CA-C 108.872 -0.788 . . . . 75.150000000000006 108.872 175.19 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -67.83 -41.95 82.24 Favored 'General case' 0 N--CA 1.479 0.982 0 N-CA-C 113.937 1.088 . . . . 74.209999999999994 113.937 -175.916 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 94.7 m-20 -60.88 -55.41 33.32 Favored 'General case' 0 N--CA 1.493 1.714 0 CA-C-O 121.869 0.842 . . . . 74.209999999999994 110.121 177.299 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . 0.507 ' O ' ' HG2' ' A' ' 79' ' ' LYS . 62.5 tt0 -70.08 -19.9 63.24 Favored 'General case' 0 CA--C 1.549 0.936 0 CA-C-N 114.516 -1.22 . . . . 64.010000000000005 110.801 -178.876 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 76' ' ' GLN . . . . . 0.408 ' HB2' ' O ' ' A' ' 72' ' ' LEU . 10.0 tt0 -72.92 -41.12 64.89 Favored 'General case' 0 N--CA 1.489 1.512 0 C-N-CA 123.127 0.571 . . . . 64.030000000000001 109.879 176.602 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 93.3 mt -59.58 -41.4 90.15 Favored 'General case' 0 N--CA 1.474 0.77 0 O-C-N 123.938 0.774 . . . . 73.420000000000002 109.467 172.926 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . 0.682 HD21 ' HA ' ' A' ' 22' ' ' LEU . 70.1 mt -58.16 -51.25 70.49 Favored 'General case' 0 N--CA 1.478 0.947 0 CA-C-N 115.611 -0.722 . . . . 74.340000000000003 111.972 170.87 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 79' ' ' LYS . . . . . 0.507 ' HG2' ' O ' ' A' ' 75' ' ' GLU . 41.3 mmtm -57.1 -42.58 81.03 Favored 'General case' 0 N--CA 1.481 1.105 0 C-N-CA 123.495 0.718 . . . . 74.450000000000003 110.827 -176.662 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 80' ' ' GLY . . . . . 0.636 ' HA2' ' HA ' ' A' ' 84' ' ' GLN . . . -67.26 -40.63 92.17 Favored Glycine 0 C--N 1.344 1.004 0 O-C-N 124.583 1.177 . . . . 53.130000000000003 113.001 179.259 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 3.1 tt -64.49 -48.3 75.69 Favored 'General case' 0 N--CA 1.475 0.805 0 C-N-CA 123.895 0.878 . . . . 74.549999999999997 109.375 179.301 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 85.7 mt -64.1 -62.69 1.46 Allowed 'General case' 0 CA--C 1.543 0.685 0 C-N-CA 124.391 1.076 . . . . 74.340000000000003 111.708 -171.885 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 7.9 tt0 -155.62 10.27 0.29 Allowed 'General case' 0 N--CA 1.488 1.426 0 N-CA-C 111.437 0.162 . . . . 75.209999999999994 111.437 -177.018 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 84' ' ' GLN . . . . . 0.636 ' HA ' ' HA2' ' A' ' 80' ' ' GLY . 28.6 tt0 72.41 -7.15 1.43 Allowed 'General case' 0 N--CA 1.493 1.7 0 C-N-CA 124.984 1.314 . . . . 74.129999999999995 112.832 -179.091 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 85' ' ' ARG . . . . . . . . . . . . . 36.3 ttp180 -82.08 140.39 33.88 Favored 'General case' 0 N--CA 1.479 0.987 0 C-N-CA 123.303 0.641 . . . . 74.319999999999993 110.721 -176.706 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 65.1 mt -65.93 -20.27 66.15 Favored 'General case' 0 N--CA 1.487 1.388 0 C-N-CA 124.381 1.072 . . . . 75.450000000000003 112.846 -174.763 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 11.3 p-10 -121.18 139.82 52.84 Favored 'General case' 0 N--CA 1.478 0.965 0 N-CA-C 108.401 -0.963 . . . . 75.430000000000007 108.401 172.15 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 26.1 mm-40 -151.29 -162.2 1.49 Allowed 'General case' 0 N--CA 1.486 1.362 0 C-N-CA 124.042 0.937 . . . . 72.5 110.093 -174.773 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . 0.739 ' HB3' ' HG3' ' A' ' 37' ' ' GLU . 96.4 mt 68.71 -94.96 0.03 OUTLIER 'General case' 0 C--N 1.361 1.072 0 C-N-CA 125.31 1.444 . . . . 74.099999999999994 109.678 -177.54 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 26.0 t -116.81 -78.19 0.58 Allowed 'General case' 0 C--O 1.242 0.667 0 N-CA-C 108.48 -0.933 . . . . 70.319999999999993 108.48 174.593 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 34.6 t -177.85 160.6 1.51 Allowed 'General case' 0 C--N 1.355 0.842 0 C-N-CA 123.082 0.553 . . . . 74.430000000000007 110.651 -179.886 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 85.1 mt -115.0 -71.11 0.76 Allowed 'General case' 0 N--CA 1.474 0.764 0 N-CA-C 108.364 -0.976 . . . . 73.299999999999997 108.364 170.068 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 49.8 mt -120.71 13.34 6.35 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.605 0 CA-C-O 122.003 0.906 . . . . 75.340000000000003 109.186 176.865 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 87.37 -11.91 64.33 Favored Glycine 0 N--CA 1.475 1.285 0 CA-C-N 116.042 -0.526 . . . . 64.420000000000002 113.967 -178.567 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 33.7 tt0 -132.77 174.1 10.67 Favored 'General case' 0 N--CA 1.477 0.894 0 N-CA-C 108.395 -0.965 . . . . 73.030000000000001 108.395 -178.398 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 45.6 m -62.6 81.74 0.02 OUTLIER 'General case' 0 N--CA 1.477 0.893 0 C-N-CA 123.936 0.894 . . . . 72.150000000000006 111.62 177.247 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 35.4 m -72.27 -43.33 64.43 Favored 'General case' 0 C--O 1.224 -0.289 0 CA-C-N 115.143 -0.935 . . . . 64.310000000000002 109.615 175.748 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 98' ' ' ARG . . . . . 0.494 ' NH1' ' HB3' ' A' ' 75' ' ' GLU . 6.9 ttp180 -59.92 -48.53 81.34 Favored 'General case' 0 CA--C 1.536 0.431 0 O-C-N 124.215 0.947 . . . . 70.420000000000002 112.705 -169.417 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 1.5 tm0? -62.96 -55.41 26.1 Favored 'General case' 0 N--CA 1.472 0.651 0 N-CA-C 109.595 -0.52 . . . . 65.140000000000001 109.595 -175.071 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 65.4 tttp -56.5 -54.2 48.59 Favored 'General case' 0 CA--C 1.543 0.7 0 O-C-N 123.963 0.789 . . . . 74.439999999999998 111.105 -179.868 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 46.8 t -67.53 -55.58 12.94 Favored 'General case' 0 CA--C 1.538 0.516 0 C-N-CA 123.686 0.794 . . . . 64.450000000000003 112.022 -171.775 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 8.0 mp -76.83 -30.54 56.4 Favored 'General case' 0 N--CA 1.485 1.282 0 N-CA-C 112.518 0.562 . . . . 75.049999999999997 112.518 -172.142 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 8.2 t30 -75.64 -41.87 53.03 Favored 'General case' 0 N--CA 1.485 1.316 0 CA-C-N 118.34 0.518 . . . . 75.349999999999994 110.257 177.46 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 104' ' ' ASN . . . . . 0.474 ' O ' ' HG2' ' A' ' 108' ' ' ARG . 28.0 t-20 -62.8 -44.28 96.57 Favored 'General case' 0 N--CA 1.481 1.084 0 N-CA-C 109.165 -0.68 . . . . 64.140000000000001 109.165 173.725 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -59.62 -38.27 80.88 Favored 'General case' 0 C--N 1.353 0.745 0 C-N-CA 123.843 0.857 . . . . 72.340000000000003 111.436 178.561 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 106' ' ' TYR . . . . . . . . . . . . . 4.3 t80 -61.0 -48.64 80.89 Favored 'General case' 0 CA--C 1.54 0.583 0 N-CA-C 108.738 -0.838 . . . . 75.310000000000002 108.738 175.104 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -61.93 -36.86 93.46 Favored Glycine 0 C--N 1.353 1.474 0 O-C-N 123.845 0.716 . . . . 74.430000000000007 112.786 -179.813 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 108' ' ' ARG . . . . . 0.474 ' HG2' ' O ' ' A' ' 104' ' ' ASN . 34.1 mmt180 -70.59 -40.38 73.28 Favored 'General case' 0 N--CA 1.473 0.679 0 C-N-CA 123.177 0.591 . . . . 71.510000000000005 110.035 -179.79 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 109' ' ' LEU . . . . . 0.425 ' HA ' ' N ' ' A' ' 114' ' ' LEU . 59.7 tp -66.75 -39.66 87.99 Favored 'General case' 0 N--CA 1.48 1.064 0 C-N-CA 123.741 0.816 . . . . 72.530000000000001 110.271 178.924 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 23.3 t -76.03 -27.76 57.44 Favored 'General case' 0 CA--C 1.543 0.696 0 CA-C-N 114.888 -1.051 . . . . 73.120000000000005 110.397 -179.802 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . -90.03 -67.04 1.21 Allowed Glycine 0 C--N 1.361 1.941 0 CA-C-O 119.194 -0.781 . . . . 64.450000000000003 113.698 -177.665 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 112' ' ' MET . . . . . 0.65 ' HB2' ' HB2' ' A' ' 118' ' ' ALA . 3.1 tmm? -97.15 -66.14 0.92 Allowed 'General case' 0 N--CA 1.481 1.088 0 CA-C-N 118.369 1.085 . . . . 75.209999999999994 110.605 179.289 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 113' ' ' LEU . . . . . 0.711 HD11 HG21 ' A' ' 56' ' ' ILE . 19.7 tp 160.21 54.35 0.0 OUTLIER 'General case' 0 N--CA 1.489 1.498 0 C-N-CA 126.378 1.871 . . . . 74.239999999999995 108.501 -178.501 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 114' ' ' LEU . . . . . 0.425 ' N ' ' HA ' ' A' ' 109' ' ' LEU . 22.3 tp 61.05 58.75 2.18 Favored 'General case' 0 CA--C 1.543 0.702 0 C-N-CA 125.764 1.626 . . . . 72.530000000000001 111.911 176.271 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 115' ' ' VAL . . . . . . . . . . . . . 24.3 m -132.97 140.92 39.13 Favored Pre-proline 0 N--CA 1.478 0.931 0 CA-C-N 114.857 -1.065 . . . . 75.540000000000006 108.326 170.586 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 10.1 Cg_exo -70.57 79.69 1.18 Allowed 'Trans proline' 0 C--N 1.374 1.887 0 C-N-CA 122.768 2.312 . . . . 75.450000000000003 111.817 -179.938 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 31.0 t70 -158.75 -71.97 0.09 Allowed 'General case' 0 C--N 1.349 0.571 0 CA-C-N 115.315 -0.857 . . . . 74.299999999999997 110.664 -178.055 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 118' ' ' ALA . . . . . 0.65 ' HB2' ' HB2' ' A' ' 112' ' ' MET . . . -103.34 108.33 58.71 Favored Pre-proline 0 N--CA 1.477 0.883 0 C-N-CA 123.441 0.696 . . . . 73.340000000000003 111.042 -173.559 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 119' ' ' PRO . . . . . . . . . . . . . 83.2 Cg_endo -91.54 142.52 2.85 Favored 'Trans proline' 0 C--N 1.369 1.649 0 C-N-CA 122.913 2.409 . . . . 74.25 111.035 167.402 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . -154.43 165.07 31.79 Favored Glycine 0 N--CA 1.466 0.696 0 N-CA-C 112.302 -0.319 . . . . 64.430000000000007 112.302 -176.338 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . -159.37 157.47 30.41 Favored 'General case' 0 N--CA 1.472 0.645 0 C-N-CA 123.238 0.615 . . . . 75.230000000000004 110.046 179.992 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 122' ' ' SER . . . . . . . . . . . . . 30.9 m . . . . . 0 C--O 1.249 1.07 0 C-N-CA 123.656 0.782 . . . . 75.209999999999994 109.367 -179.077 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 25.3 ttt . . . . . 0 CA--C 1.553 1.078 0 CA-C-O 119.495 -0.288 . . . . 73.409999999999997 110.856 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 37.1 p -56.03 -49.08 74.68 Favored 'General case' 0 N--CA 1.487 1.405 0 N-CA-C 112.704 0.631 . . . . 74.519999999999996 112.704 -172.142 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 55.2 m -68.41 -26.67 65.65 Favored 'General case' 0 N--CA 1.483 1.183 0 C-N-CA 122.459 0.304 . . . . 73.420000000000002 111.774 -178.597 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 4' ' ' THR . . . . . 0.495 HG23 HD11 ' A' ' 60' ' ' ILE . 28.2 m -75.02 -41.3 59.56 Favored 'General case' 0 C--N 1.349 0.566 0 C-N-CA 123.191 0.596 . . . . 73.420000000000002 110.755 177.37 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 87.9 t -68.32 -36.36 74.7 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.817 0 C-N-CA 123.381 0.673 . . . . 65.109999999999999 109.438 177.361 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 42.2 mm-40 -62.37 -46.62 87.82 Favored 'General case' 0 N--CA 1.478 0.931 0 C-N-CA 123.761 0.824 . . . . 74.340000000000003 110.566 173.252 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 31.0 t80 -64.93 -47.91 76.0 Favored 'General case' 0 N--CA 1.475 0.821 0 O-C-N 123.989 0.805 . . . . 74.319999999999993 110.603 -175.878 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . 0.48 HD13 HG23 ' A' ' 60' ' ' ILE . 77.4 mt -65.75 -36.96 78.81 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.856 0 C-N-CA 123.607 0.763 . . . . 75.310000000000002 110.439 178.577 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 26.0 t-20 -73.29 -27.8 61.75 Favored 'General case' 0 N--CA 1.489 1.489 0 C-N-CA 123.201 0.6 . . . . 73.439999999999998 111.195 -179.681 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . 0.578 ' HB3' HG22 ' A' ' 47' ' ' VAL . 62.7 mtt85 -72.11 -37.43 69.51 Favored 'General case' 0 CA--C 1.54 0.595 0 C-N-CA 123.054 0.542 . . . . 75.209999999999994 109.754 173.038 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' TRP . . . . . . . . . . . . . 86.5 m95 -76.14 -20.92 57.17 Favored 'General case' 0 N--CA 1.475 0.824 0 CA-C-N 116.043 -0.526 . . . . 74.519999999999996 111.549 172.012 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 53.5 mt-30 -68.15 -46.38 70.93 Favored 'General case' 0 C--N 1.359 0.982 0 N-CA-C 107.553 -1.276 . . . . 73.319999999999993 107.553 168.839 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . 0.621 ' HE ' HD13 ' A' ' 17' ' ' LEU . 16.2 tpt180 -59.02 -46.66 87.64 Favored 'General case' 0 CA--C 1.548 0.868 0 O-C-N 123.8 0.688 . . . . 74.540000000000006 110.927 -177.622 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 56.8 mt -66.21 -52.81 43.5 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.095 0 O-C-N 123.201 0.313 . . . . 72.439999999999998 110.607 177.8 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . 0.587 ' HA ' ' HB ' ' A' ' 71' ' ' THR . . . -56.56 -45.15 81.43 Favored 'General case' 0 N--CA 1.488 1.436 0 C-N-CA 123.828 0.851 . . . . 73.310000000000002 111.794 -177.032 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 97.0 mt -78.58 -40.6 34.23 Favored 'General case' 0 N--CA 1.481 1.119 0 CA-C-N 114.923 -1.035 . . . . 74.209999999999994 111.39 -171.904 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . 0.621 HD13 ' HE ' ' A' ' 13' ' ' ARG . 30.3 mt -64.0 -51.3 64.89 Favored 'General case' 0 C--N 1.36 1.05 0 CA-C-O 119.166 -0.445 . . . . 75.209999999999994 110.478 177.536 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 80.5 p -62.31 -36.47 82.25 Favored 'General case' 0 N--CA 1.478 0.945 0 O-C-N 123.789 0.681 . . . . 75.040000000000006 111.123 -179.94 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 19' ' ' GLN . . . . . 0.441 HE21 ' NE2' ' A' ' 70' ' ' GLN . 6.7 tp-100 -62.19 -44.39 96.68 Favored 'General case' 0 C--N 1.358 0.976 0 C-N-CA 123.288 0.635 . . . . 72.540000000000006 110.305 175.105 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 63.4 m -62.04 -43.84 97.97 Favored 'General case' 0 C--O 1.214 -0.782 0 O-C-N 123.918 0.761 . . . . 63.43 109.663 176.975 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . 0.681 HD21 ' HA ' ' A' ' 33' ' ' LEU . 52.4 mt -64.15 -31.92 73.3 Favored 'General case' 0 C--N 1.351 0.638 0 C-N-CA 123.268 0.627 . . . . 75.409999999999997 110.54 -178.009 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . 0.723 ' HA ' HD23 ' A' ' 78' ' ' LEU . 50.7 tp -66.85 -54.64 20.38 Favored 'General case' 0 N--CA 1.48 1.039 0 C-N-CA 123.096 0.558 . . . . 55.109999999999999 110.082 176.173 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . 0.411 ' HB3' ' NH1' ' A' ' 27' ' ' ARG . 11.6 mm-40 -52.69 -52.48 55.81 Favored 'General case' 0 CA--C 1.547 0.858 0 C-N-CA 124.593 1.157 . . . . 74.310000000000002 111.414 177.935 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . 0.472 HD23 HD11 ' A' ' 32' ' ' LEU . 77.8 mt -63.45 -43.78 96.39 Favored 'General case' 0 CA--C 1.538 0.516 0 CA-C-N 114.485 -1.234 . . . . 74.230000000000004 110.941 -176.752 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . 0.459 ' HB1' HD23 ' A' ' 33' ' ' LEU . . . -58.28 -48.35 80.75 Favored 'General case' 0 N--CA 1.483 1.214 0 C-N-CA 123.264 0.625 . . . . 73.010000000000005 110.884 -179.838 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 96.3 mt-30 -63.77 -37.46 87.46 Favored 'General case' 0 CA--C 1.545 0.777 0 CA-C-N 114.815 -1.084 . . . . 74.299999999999997 110.904 179.716 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . 0.411 ' NH1' ' HB3' ' A' ' 23' ' ' GLU . 78.2 mtt180 -87.97 3.78 47.41 Favored 'General case' 0 N--CA 1.482 1.152 0 C-N-CA 123.793 0.837 . . . . 74.200000000000003 112.793 -178.222 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 83.97 12.12 77.57 Favored Glycine 0 C--N 1.351 1.405 0 N-CA-C 115.06 0.784 . . . . 75.420000000000002 115.06 171.876 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . 0.409 ' HB2' ' HB3' ' A' ' 24' ' ' LEU . 14.3 mm-40 -91.02 50.71 1.82 Allowed 'General case' 0 CA--C 1.55 0.977 0 C-N-CA 124.649 1.18 . . . . 72.5 110.464 176.053 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 30' ' ' TRP . . . . . 0.582 ' HA ' HD13 ' A' ' 33' ' ' LEU . 75.3 m95 -64.55 -26.67 68.52 Favored 'General case' 0 N--CA 1.485 1.295 0 C-N-CA 123.204 0.601 . . . . 75.129999999999995 111.005 -178.257 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 8.8 m-20 -57.03 -42.81 81.13 Favored 'General case' 0 N--CA 1.478 0.927 0 C-N-CA 123.274 0.63 . . . . 63.219999999999999 110.393 172.98 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . 0.472 HD11 HD23 ' A' ' 24' ' ' LEU . 76.1 mt -72.08 -18.93 61.89 Favored 'General case' 0 CA--C 1.547 0.839 0 CA-C-N 116.237 -0.438 . . . . 75.239999999999995 111.354 -178.882 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . 0.681 ' HA ' HD21 ' A' ' 21' ' ' LEU . 10.2 mp -69.37 -46.95 65.73 Favored 'General case' 0 N--CA 1.485 1.307 0 N-CA-C 109.254 -0.647 . . . . 65.530000000000001 109.254 167.317 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 59.8 mt -61.41 -38.68 87.97 Favored 'General case' 0 N--CA 1.483 1.212 0 O-C-N 123.99 0.807 . . . . 74.209999999999994 111.306 179.291 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -69.05 -45.27 70.83 Favored 'General case' 0 N--CA 1.481 1.116 0 C-N-CA 123.955 0.902 . . . . 75.319999999999993 111.34 -179.996 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 36' ' ' GLN . . . . . 0.474 ' HB2' HD22 ' A' ' 21' ' ' LEU . 87.1 mm-40 -81.42 -15.35 55.4 Favored 'General case' 0 N--CA 1.487 1.423 0 C-N-CA 122.791 0.436 . . . . 63.140000000000001 111.634 -178.282 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . 0.457 ' HG3' ' HB3' ' A' ' 89' ' ' LEU . 24.1 tt0 -45.81 -65.97 0.47 Allowed 'General case' 0 N--CA 1.48 1.048 0 C-N-CA 124.849 1.259 . . . . 72.25 113.282 -176.559 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 48.9 t -61.62 -35.44 67.22 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.087 0 C-N-CA 123.682 0.793 . . . . 75.310000000000002 111.104 -170.472 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 49.1 m -65.57 -49.29 69.38 Favored 'General case' 0 CA--C 1.54 0.563 0 C-N-CA 123.788 0.835 . . . . 75.040000000000006 110.729 176.573 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 38.0 t80 -60.99 -40.51 93.74 Favored 'General case' 0 N--CA 1.48 1.032 0 C-N-CA 124.203 1.001 . . . . 74.140000000000001 110.982 -178.862 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . 0.657 ' HB3' HD21 ' A' ' 92' ' ' LEU . 69.7 mt -70.14 -48.31 57.96 Favored 'General case' 0 C--O 1.252 1.185 0 O-C-N 124.613 1.195 . . . . 75.400000000000006 111.761 -175.292 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 46.6 tt0 -63.27 -39.48 94.7 Favored 'General case' 0 CA--C 1.551 1.015 0 CA-C-N 115.592 -0.731 . . . . 72.450000000000003 109.831 177.644 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 43' ' ' SER . . . . . 0.548 ' O ' HG21 ' A' ' 47' ' ' VAL . 67.2 m -61.96 -56.39 19.61 Favored 'General case' 0 C--N 1.356 0.862 0 C-N-CA 123.28 0.632 . . . . 55.130000000000003 111.022 178.27 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 11.5 tt -58.04 -42.16 82.18 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.36 0 C-N-CA 123.729 0.812 . . . . 73.439999999999998 110.977 -173.756 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 72.1 mm-40 -60.81 -48.45 81.75 Favored 'General case' 0 C--N 1.362 1.151 0 O-C-N 123.492 0.495 . . . . 54.329999999999998 111.272 175.174 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 66.9 m -57.06 -39.12 74.29 Favored 'General case' 0 N--CA 1.489 1.515 0 C-N-CA 122.991 0.516 . . . . 75.340000000000003 111.895 178.971 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 47' ' ' VAL . . . . . 0.578 HG22 ' HB3' ' A' ' 10' ' ' ARG . 43.3 t -65.98 -44.75 92.16 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.173 0 C-N-CA 123.302 0.641 . . . . 61.140000000000001 110.377 -178.479 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 48' ' ' MET . . . . . 0.543 ' SD ' ' HB2' ' A' ' 101' ' ' SER . 75.2 mtm -69.75 -27.23 64.77 Favored 'General case' 0 N--CA 1.485 1.276 0 CA-C-N 116.093 -0.503 . . . . 73.5 111.8 179.221 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 38.5 mt-10 -71.22 -24.47 62.21 Favored 'General case' 0 N--CA 1.481 1.107 0 C-N-CA 123.037 0.535 . . . . 74.200000000000003 111.319 173.868 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -87.04 142.5 27.89 Favored 'General case' 0 N--CA 1.478 0.974 0 C-N-CA 123.203 0.601 . . . . 75.510000000000005 110.28 -178.944 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 8.8 tt0 -85.56 158.52 20.11 Favored 'General case' 0 N--CA 1.474 0.755 0 C-N-CA 123.761 0.824 . . . . 72.310000000000002 110.017 -178.921 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 52' ' ' THR . . . . . 0.436 ' OG1' ' HB3' ' A' ' 114' ' ' LEU . 22.0 m -78.36 129.87 73.52 Favored Pre-proline 0 CA--C 1.546 0.823 0 C-N-CA 123.119 0.567 . . . . 73.120000000000005 110.263 175.514 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 53' ' ' PRO . . . . . 0.486 ' HG3' ' HA ' ' A' ' 4' ' ' THR . 56.8 Cg_endo -67.01 157.88 59.56 Favored 'Trans proline' 0 C--N 1.376 2.022 0 C-N-CA 123.2 2.6 . . . . 74.349999999999994 112.652 177.754 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 38.8 Cg_endo -65.49 -45.54 6.83 Favored 'Trans proline' 0 C--N 1.375 1.948 0 C-N-CA 122.843 2.362 . . . . 72.200000000000003 112.75 176.397 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . -69.2 78.8 0.3 Allowed Glycine 0 C--N 1.359 1.843 0 O-C-N 123.765 0.666 . . . . 63.509999999999998 114.054 -175.488 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 23.8 mm -117.91 136.39 55.26 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.575 0 C-N-CA 124.752 1.221 . . . . 71.439999999999998 108.337 178.444 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 72.2 p -106.66 179.12 4.36 Favored 'General case' 0 N--CA 1.473 0.717 0 N-CA-C 108.537 -0.912 . . . . 53.200000000000003 108.537 168.121 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 29.8 tpt180 -65.96 -43.36 88.16 Favored 'General case' 0 CA--C 1.54 0.588 0 N-CA-C 109.819 -0.437 . . . . 72.239999999999995 109.819 174.549 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 71.4 p -62.64 -42.45 99.61 Favored 'General case' 0 CA--C 1.545 0.762 0 C-N-CA 123.5 0.72 . . . . 71.400000000000006 110.934 -179.544 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 60' ' ' ILE . . . . . 0.495 HD11 HG23 ' A' ' 4' ' ' THR . 93.9 mt -59.81 -45.65 94.56 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.019 0 C-N-CA 123.806 0.842 . . . . 73.400000000000006 110.513 173.762 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 64.5 tt0 -59.91 -37.39 79.28 Favored 'General case' 0 N--CA 1.478 0.932 0 C-N-CA 123.875 0.87 . . . . 74.530000000000001 111.104 179.657 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 70.5 m-20 -71.21 -39.44 71.74 Favored 'General case' 0 N--CA 1.481 1.112 0 C-N-CA 123.383 0.673 . . . . 62.100000000000001 111.02 179.085 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 63' ' ' MET . . . . . . . . . . . . . 71.0 mtm -71.31 -41.58 69.72 Favored 'General case' 0 N--CA 1.481 1.099 0 C-N-CA 122.923 0.489 . . . . 70.430000000000007 111.649 -178.997 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 64' ' ' VAL . . . . . 0.46 ' O ' HG13 ' A' ' 68' ' ' ILE . 85.8 t -67.9 -55.69 15.8 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.755 0 N-CA-C 109.531 -0.544 . . . . 62.43 109.531 179.497 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . 0.559 ' HB3' HD22 ' A' ' 109' ' ' LEU . . . -63.07 -28.38 70.04 Favored 'General case' 0 N--CA 1.488 1.472 0 O-C-N 123.351 0.407 . . . . 73.219999999999999 110.849 178.594 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -67.02 -40.79 93.32 Favored Glycine 0 C--N 1.35 1.345 0 O-C-N 123.562 0.539 . . . . 53.219999999999999 112.519 175.531 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 16.6 m-30 -72.54 -38.82 67.91 Favored 'General case' 0 N--CA 1.48 1.074 0 C-N-CA 123.328 0.651 . . . . 75.439999999999998 110.988 178.189 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 68' ' ' ILE . . . . . 0.545 ' O ' ' HG ' ' A' ' 72' ' ' LEU . 78.3 mt -57.96 -50.43 77.93 Favored 'Isoleucine or valine' 0 C--N 1.353 0.736 0 O-C-N 124.575 1.172 . . . . 75.430000000000007 108.361 173.783 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 69' ' ' LYS . . . . . 0.59 ' HB2' ' HE2' ' A' ' 106' ' ' TYR . 0.7 OUTLIER -57.83 -49.07 77.92 Favored 'General case' 0 C--N 1.353 0.757 0 C-N-CA 123.886 0.874 . . . . 73.140000000000001 110.673 -178.847 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 70' ' ' GLN . . . . . 0.441 ' NE2' HE21 ' A' ' 19' ' ' GLN . 58.9 tt0 -58.25 -44.88 88.53 Favored 'General case' 0 N--CA 1.471 0.593 0 O-C-N 124.705 1.253 . . . . 75.510000000000005 110.784 -176.984 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 71' ' ' THR . . . . . 0.587 ' HB ' ' HA ' ' A' ' 15' ' ' ALA . 12.8 t -76.93 -22.43 53.31 Favored 'General case' 0 C--O 1.21 -0.999 0 CA-C-O 118.846 -0.597 . . . . 74.030000000000001 110.344 -177.965 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 72' ' ' LEU . . . . . 0.696 HD22 ' HB3' ' A' ' 102' ' ' LEU . 40.5 mt -72.23 -32.98 67.21 Favored 'General case' 0 N--CA 1.49 1.57 0 CA-C-N 118.136 0.426 . . . . 75.540000000000006 110.789 173.5 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 38.8 m-20 -64.13 -49.87 70.47 Favored 'General case' 0 N--CA 1.477 0.91 0 N-CA-C 108.542 -0.91 . . . . 62.25 108.542 172.071 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 70.5 m-20 -62.28 -37.08 84.12 Favored 'General case' 0 N--CA 1.478 0.964 0 CA-C-N 115.037 -0.983 . . . . 75.129999999999995 111.566 179.96 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . 0.43 ' HG2' ' O ' ' A' ' 71' ' ' THR . 17.2 mm-40 -66.47 -51.62 54.89 Favored 'General case' 0 N--CA 1.481 1.094 0 C-N-CA 123.316 0.646 . . . . 72.450000000000003 110.275 178.667 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 9.1 tt0 -58.09 -48.85 78.9 Favored 'General case' 0 N--CA 1.475 0.818 0 O-C-N 123.492 0.495 . . . . 75.299999999999997 110.807 -177.778 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 96.8 mt -63.63 -57.13 11.03 Favored 'General case' 0 N--CA 1.471 0.625 0 O-C-N 123.975 0.797 . . . . 75.0 111.043 -176.959 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . 0.723 HD23 ' HA ' ' A' ' 22' ' ' LEU . 82.4 mt -63.54 -66.47 0.54 Allowed 'General case' 0 N--CA 1.481 1.107 0 O-C-N 123.553 0.533 . . . . 73.409999999999997 111.785 -178.514 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 33.0 mmtp -59.54 -35.15 73.66 Favored 'General case' 0 N--CA 1.475 0.793 0 O-C-N 124.219 0.95 . . . . 73.140000000000001 110.928 -173.808 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -66.69 -40.26 93.91 Favored Glycine 0 C--N 1.355 1.606 0 O-C-N 123.526 0.516 . . . . 71.409999999999997 113.019 175.069 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 8.2 tt -66.21 -36.96 84.42 Favored 'General case' 0 N--CA 1.485 1.322 0 C-N-CA 123.465 0.706 . . . . 75.510000000000005 109.737 177.092 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 95.1 mt -77.73 -36.76 50.53 Favored 'General case' 0 N--CA 1.473 0.71 0 C-N-CA 123.955 0.902 . . . . 75.209999999999994 111.328 -175.516 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 8.1 tt0 -168.98 -74.34 0.02 OUTLIER 'General case' 0 N--CA 1.477 0.901 0 C-N-CA 123.657 0.783 . . . . 75.230000000000004 109.714 177.796 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 73.9 mm-40 -157.17 168.0 28.73 Favored 'General case' 0 N--CA 1.489 1.475 0 C-N-CA 125.709 1.603 . . . . 74.519999999999996 108.309 -178.457 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 85' ' ' ARG . . . . . . . . . . . . . 81.4 mtm-85 -65.1 82.91 0.04 OUTLIER 'General case' 0 N--CA 1.486 1.338 0 C-N-CA 123.248 0.619 . . . . 74.430000000000007 111.042 -178.846 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 86' ' ' LEU . . . . . 0.707 HD21 ' HA ' ' A' ' 96' ' ' SER . 9.4 mt -174.58 151.85 1.57 Allowed 'General case' 0 N--CA 1.476 0.861 0 C-N-CA 126.24 1.816 . . . . 73.329999999999998 107.678 -179.951 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 87' ' ' ASP . . . . . 0.509 ' HB2' ' NH1' ' A' ' 98' ' ' ARG . 2.6 m-20 -76.58 84.58 3.25 Favored 'General case' 0 C--O 1.242 0.677 0 N-CA-C 108.707 -0.849 . . . . 63.229999999999997 108.707 177.169 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -74.03 -16.66 61.04 Favored 'General case' 0 CA--C 1.547 0.827 0 CA-C-N 114.76 -1.109 . . . . 75.450000000000003 109.702 169.158 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . 0.457 ' HB3' ' HG3' ' A' ' 37' ' ' GLU . 88.4 mt -49.54 -49.51 45.8 Favored 'General case' 0 C--N 1.358 0.96 0 C-N-CA 124.42 1.088 . . . . 73.299999999999997 110.234 168.154 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 90' ' ' SER . . . . . 0.4 ' HB3' ' CD1' ' A' ' 41' ' ' LEU . 31.3 t -169.64 129.36 1.0 Allowed 'General case' 0 CA--C 1.542 0.648 0 CA-C-N 114.651 -1.159 . . . . 50.240000000000002 108.242 172.682 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 19.8 m -69.6 111.44 5.41 Favored 'General case' 0 CA--C 1.539 0.552 0 C-N-CA 123.702 0.801 . . . . 73.049999999999997 109.83 -177.0 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 92' ' ' LEU . . . . . 0.657 HD21 ' HB3' ' A' ' 41' ' ' LEU . 94.7 mt -67.81 -75.43 0.1 Allowed 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 124.238 1.015 . . . . 63.520000000000003 110.607 -179.447 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 42.6 mt -124.46 65.87 0.3 Allowed 'Isoleucine or valine' 0 CA--C 1.546 0.811 0 N-CA-C 107.537 -1.282 . . . . 74.120000000000005 107.537 172.621 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 48.39 -87.53 0.01 OUTLIER Glycine 0 C--N 1.363 2.081 0 CA-C-N 114.219 -1.355 . . . . 65.239999999999995 115.157 172.322 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 5.8 pm0 -66.49 -173.52 0.22 Allowed 'General case' 0 N--CA 1.477 0.878 0 C-N-CA 124.564 1.145 . . . . 75.120000000000005 111.461 178.628 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 96' ' ' SER . . . . . 0.707 ' HA ' HD21 ' A' ' 86' ' ' LEU . 44.5 m -80.42 38.57 0.43 Allowed 'General case' 0 CA--C 1.545 0.78 0 N-CA-C 113.289 0.848 . . . . 60.310000000000002 113.289 -173.037 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 39.1 m -49.48 -61.12 2.28 Favored 'General case' 0 N--CA 1.48 1.026 0 C-N-CA 124.014 0.926 . . . . 75.450000000000003 110.828 173.028 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 98' ' ' ARG . . . . . 0.629 ' HD2' ' HB2' ' A' ' 92' ' ' LEU . 0.0 OUTLIER -47.62 -56.07 7.99 Favored 'General case' 0 CA--C 1.552 1.036 0 C-N-CA 125.955 1.702 . . . . 75.439999999999998 113.533 178.306 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 31.0 mm-40 -66.28 -43.65 85.78 Favored 'General case' 0 N--CA 1.482 1.157 0 C-N-CA 122.968 0.507 . . . . 74.519999999999996 111.068 -175.375 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 13.8 tmtt? -63.36 -38.13 89.97 Favored 'General case' 0 C--O 1.217 -0.629 0 CA-C-N 114.897 -1.047 . . . . 74.019999999999996 110.638 178.579 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 101' ' ' SER . . . . . 0.543 ' HB2' ' SD ' ' A' ' 48' ' ' MET . 73.1 m -78.33 -32.15 49.06 Favored 'General case' 0 N--CA 1.479 0.981 0 C-N-CA 123.08 0.552 . . . . 74.109999999999999 112.076 -172.9 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 102' ' ' LEU . . . . . 0.696 ' HB3' HD22 ' A' ' 72' ' ' LEU . 10.0 mp -71.29 -43.3 67.41 Favored 'General case' 0 N--CA 1.483 1.184 0 N-CA-C 110.074 -0.343 . . . . 72.109999999999999 110.074 172.561 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 8.9 t30 -64.08 -41.01 97.47 Favored 'General case' 0 N--CA 1.481 1.079 0 CA-C-O 121.159 0.504 . . . . 75.230000000000004 110.507 176.625 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 7.2 t30 -64.05 -39.3 93.77 Favored 'General case' 0 N--CA 1.478 0.958 0 C-N-CA 124.397 1.079 . . . . 75.219999999999999 109.469 176.54 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -59.41 -48.39 81.82 Favored 'General case' 0 C--N 1.347 0.467 0 O-C-N 124.049 0.843 . . . . 74.319999999999993 110.444 178.598 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 106' ' ' TYR . . . . . 0.59 ' HE2' ' HB2' ' A' ' 69' ' ' LYS . 20.0 t80 -59.47 -56.32 23.44 Favored 'General case' 0 CA--C 1.55 0.957 0 O-C-N 123.867 0.73 . . . . 73.099999999999994 111.074 179.8 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -69.0 -41.01 83.62 Favored Glycine 0 C--N 1.347 1.194 0 O-C-N 123.989 0.805 . . . . 73.0 113.302 -171.272 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 5.5 mmp_? -68.91 -33.91 74.53 Favored 'General case' 0 C--N 1.349 0.578 0 CA-C-O 119.258 -0.401 . . . . 65.200000000000003 110.455 177.42 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 109' ' ' LEU . . . . . 0.559 HD22 ' HB3' ' A' ' 65' ' ' ALA . 47.3 tp -61.56 -44.8 96.37 Favored 'General case' 0 N--CA 1.482 1.162 0 CA-C-O 120.888 0.375 . . . . 73.310000000000002 110.301 175.388 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 10.9 t -69.58 -34.28 73.91 Favored 'General case' 0 CA--C 1.554 1.127 0 CA-C-N 114.749 -1.114 . . . . 72.430000000000007 110.938 -179.043 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . -91.2 -63.27 1.19 Allowed Glycine 0 C--N 1.357 1.735 0 N-CA-C 114.454 0.542 . . . . 63.240000000000002 114.454 -177.649 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 112' ' ' MET . . . . . . . . . . . . . 3.8 mmm -93.13 -68.92 0.77 Allowed 'General case' 0 N--CA 1.489 1.481 0 CA-C-N 117.454 0.627 . . . . 72.310000000000002 112.021 -178.578 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 113' ' ' LEU . . . . . 0.495 HD22 ' H ' ' A' ' 120' ' ' GLY . 23.8 tp 174.01 13.41 0.0 OUTLIER 'General case' 0 N--CA 1.492 1.635 0 C-N-CA 125.172 1.389 . . . . 74.450000000000003 110.018 178.28 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 114' ' ' LEU . . . . . 0.449 ' N ' ' HA ' ' A' ' 109' ' ' LEU . 2.5 tt 83.0 -24.54 0.17 Allowed 'General case' 0 N--CA 1.5 2.063 0 C-N-CA 126.683 1.993 . . . . 74.230000000000004 109.842 -170.321 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 115' ' ' VAL . . . . . . . . . . . . . 7.2 p -113.17 135.96 21.77 Favored Pre-proline 0 CA--C 1.548 0.884 0 N-CA-C 107.097 -1.446 . . . . 73.420000000000002 107.097 176.167 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 97.5 Cg_endo -78.2 30.25 0.45 Allowed 'Trans proline' 0 C--N 1.376 1.985 0 C-N-CA 122.623 2.215 . . . . 75.340000000000003 113.218 178.21 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 26.8 t70 -85.72 -82.27 0.19 Allowed 'General case' 0 CA--C 1.549 0.934 0 C-N-CA 123.643 0.777 . . . . 73.120000000000005 110.747 -175.884 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -155.73 128.79 4.31 Favored Pre-proline 0 CA--C 1.546 0.794 0 C-N-CA 123.555 0.742 . . . . 74.109999999999999 109.037 -177.527 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 119' ' ' PRO . . . . . . . . . . . . . 48.5 Cg_endo -68.31 101.71 0.75 Allowed 'Trans proline' 0 C--N 1.377 2.045 0 C-N-CA 122.417 2.078 . . . . 72.409999999999997 111.587 179.46 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 120' ' ' GLY . . . . . 0.495 ' H ' HD22 ' A' ' 113' ' ' LEU . . . -113.99 18.42 19.05 Favored Glycine 0 C--N 1.347 1.15 0 CA-C-N 115.803 -0.635 . . . . 75.239999999999995 113.128 -178.77 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . -71.6 105.49 3.68 Favored 'General case' 0 CA--C 1.546 0.807 0 N-CA-C 109.877 -0.416 . . . . 53.530000000000001 109.877 177.827 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 122' ' ' SER . . . . . . . . . . . . . 48.8 m . . . . . 0 C--O 1.249 1.05 0 N-CA-C 109.253 -0.647 . . . . 62.43 109.253 177.431 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 1' ' ' MET . . . . . 0.454 ' HG3' HG22 ' A' ' 5' ' ' VAL . 16.7 ptt? . . . . . 0 N--CA 1.486 1.329 0 CA-C-O 120.683 0.278 . . . . 72.120000000000005 110.65 . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 9.2 t -54.6 -40.32 68.74 Favored 'General case' 0 N--CA 1.483 1.216 0 C-N-CA 123.353 0.661 . . . . 74.219999999999999 112.725 -172.766 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 17.2 m -72.46 -32.42 66.23 Favored 'General case' 0 N--CA 1.479 1.019 0 C-N-CA 123.247 0.619 . . . . 73.030000000000001 111.4 -178.758 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 52.5 m -74.57 -39.11 62.45 Favored 'General case' 0 C--O 1.217 -0.64 0 C-N-CA 123.07 0.548 . . . . 61.32 110.295 178.233 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . 0.454 HG22 ' HG3' ' A' ' 1' ' ' MET . 90.2 t -63.77 -40.48 89.2 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.905 0 C-N-CA 123.309 0.644 . . . . 73.230000000000004 109.297 176.581 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 33.9 mm-40 -57.1 -51.98 67.11 Favored 'General case' 0 N--CA 1.473 0.685 0 O-C-N 123.939 0.774 . . . . 71.129999999999995 110.625 171.228 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 42.6 t80 -61.88 -43.86 97.99 Favored 'General case' 0 CA--C 1.552 1.027 0 C-N-CA 124.106 0.962 . . . . 74.219999999999999 111.337 -173.464 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . 0.433 HD13 HG21 ' A' ' 60' ' ' ILE . 77.5 mt -63.84 -45.19 97.76 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.873 0 C-N-CA 123.772 0.829 . . . . 75.430000000000007 109.357 176.473 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 28.5 t-20 -67.09 -27.41 67.33 Favored 'General case' 0 N--CA 1.479 0.991 0 C-N-CA 123.834 0.854 . . . . 75.349999999999994 111.54 -177.25 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . 0.55 ' HB3' HG22 ' A' ' 47' ' ' VAL . 50.8 mtt180 -81.46 -28.02 34.34 Favored 'General case' 0 CA--C 1.543 0.684 0 C-N-CA 123.394 0.678 . . . . 75.310000000000002 110.191 176.477 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' TRP . . . . . . . . . . . . . 61.2 m95 -74.53 -28.21 60.87 Favored 'General case' 0 N--CA 1.474 0.774 0 CA-C-O 119.313 -0.375 . . . . 73.25 110.828 167.663 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . 0.47 ' HG2' ' CE2' ' A' ' 67' ' ' TYR . 41.1 mt-30 -67.52 -38.79 84.76 Favored 'General case' 0 C--N 1.358 0.956 0 N-CA-C 108.064 -1.087 . . . . 64.329999999999998 108.064 170.165 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 32.2 tpt180 -57.1 -55.54 33.38 Favored 'General case' 0 CA--C 1.542 0.643 0 CA-C-N 115.328 -0.851 . . . . 74.299999999999997 109.984 179.753 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' ILE . . . . . 0.413 HG23 ' OG1' ' A' ' 71' ' ' THR . 19.1 mt -64.81 -45.97 93.41 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.357 0 O-C-N 122.938 0.148 . . . . 73.340000000000003 111.001 179.806 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . 0.597 ' HA ' ' HB ' ' A' ' 71' ' ' THR . . . -58.05 -48.52 79.84 Favored 'General case' 0 N--CA 1.487 1.399 0 C-N-CA 124.406 1.082 . . . . 70.530000000000001 112.154 -176.426 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 87.0 mt -78.64 -37.44 42.09 Favored 'General case' 0 N--CA 1.48 1.051 0 CA-C-N 114.902 -1.045 . . . . 73.530000000000001 110.903 -173.085 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . 0.495 ' O ' ' HG ' ' A' ' 21' ' ' LEU . 59.0 mt -62.46 -48.1 81.12 Favored 'General case' 0 N--CA 1.479 0.976 0 O-C-N 123.344 0.403 . . . . 73.140000000000001 110.461 176.816 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 78.5 p -64.63 -38.34 90.68 Favored 'General case' 0 N--CA 1.475 0.808 0 C-N-CA 123.01 0.524 . . . . 62.549999999999997 111.125 -179.804 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 7.0 tp-100 -60.83 -42.33 97.52 Favored 'General case' 0 C--N 1.354 0.782 0 O-C-N 123.704 0.628 . . . . 71.420000000000002 110.625 175.207 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 48.6 m -60.89 -48.77 80.31 Favored 'General case' 0 C--N 1.346 0.441 0 O-C-N 123.391 0.432 . . . . 65.329999999999998 110.071 175.611 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . 0.538 HD22 ' HA ' ' A' ' 33' ' ' LEU . 59.2 mt -64.8 -26.91 68.55 Favored 'General case' 0 N--CA 1.471 0.624 0 C-N-CA 123.62 0.768 . . . . 74.129999999999995 110.836 -178.114 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . 0.609 ' HA ' HD23 ' A' ' 78' ' ' LEU . 46.0 tp -68.07 -58.35 4.64 Favored 'General case' 0 C--N 1.35 0.599 0 C-N-CA 123.376 0.67 . . . . 73.319999999999993 109.564 176.767 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 41.0 mt-10 -53.91 -46.03 71.34 Favored 'General case' 0 N--CA 1.48 1.031 0 C-N-CA 124.147 0.979 . . . . 75.239999999999995 111.073 -179.955 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . 0.492 ' HB3' ' HB2' ' A' ' 29' ' ' GLU . 96.0 mt -67.08 -46.89 72.9 Favored 'General case' 0 CA--C 1.538 0.511 0 CA-C-N 114.661 -1.154 . . . . 72.310000000000002 111.455 -176.623 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . 0.402 ' HB1' HD23 ' A' ' 33' ' ' LEU . . . -64.16 -34.25 77.65 Favored 'General case' 0 N--CA 1.484 1.25 0 CA-C-N 117.971 0.351 . . . . 64.329999999999998 111.501 -179.555 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 98.0 mt-30 -63.65 -38.43 91.09 Favored 'General case' 0 N--CA 1.482 1.143 0 C-N-CA 123.333 0.653 . . . . 64.5 110.61 173.681 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 97.2 mtt180 -75.78 -17.39 59.89 Favored 'General case' 0 N--CA 1.483 1.197 0 C-N-CA 123.161 0.584 . . . . 70.209999999999994 111.868 174.775 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 92.3 20.79 34.31 Favored Glycine 0 C--N 1.346 1.127 0 N-CA-C 112.727 -0.149 . . . . 71.129999999999995 112.727 179.078 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . 0.492 ' HB2' ' HB3' ' A' ' 24' ' ' LEU . 49.3 mm-40 -84.54 68.77 10.44 Favored 'General case' 0 C--O 1.238 0.452 0 C-N-CA 124.312 1.045 . . . . 74.420000000000002 110.871 -179.775 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 30' ' ' TRP . . . . . . . . . . . . . 24.8 m95 -63.68 -42.18 98.07 Favored 'General case' 0 N--CA 1.475 0.788 0 CA-C-N 115.114 -0.948 . . . . 74.209999999999994 111.097 -176.134 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 9.8 m-20 -60.62 -41.68 95.33 Favored 'General case' 0 N--CA 1.478 0.971 0 C-N-CA 123.48 0.712 . . . . 74.219999999999999 110.893 -178.813 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . 0.494 HD22 ' NE2' ' A' ' 35' ' ' GLN . 72.6 mt -64.47 -37.03 86.11 Favored 'General case' 0 N--CA 1.478 0.941 0 O-C-N 123.61 0.569 . . . . 74.439999999999998 111.211 -178.907 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . 0.538 ' HA ' HD22 ' A' ' 21' ' ' LEU . 10.7 mp -61.74 -46.92 87.54 Favored 'General case' 0 N--CA 1.486 1.325 0 CA-C-O 120.719 0.295 . . . . 74.120000000000005 110.24 172.365 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 91.2 mt -67.66 -26.97 66.47 Favored 'General case' 0 CA--C 1.549 0.915 0 C-N-CA 123.482 0.713 . . . . 74.109999999999999 112.18 -177.227 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 35' ' ' GLN . . . . . 0.494 ' NE2' HD22 ' A' ' 32' ' ' LEU . 48.5 mt-30 -77.96 -36.78 48.72 Favored 'General case' 0 N--CA 1.48 1.035 0 C-N-CA 123.304 0.642 . . . . 74.129999999999995 110.619 176.705 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 30.9 mm-40 -82.79 -15.24 52.47 Favored 'General case' 0 N--CA 1.483 1.188 0 C-N-CA 123.09 0.556 . . . . 74.109999999999999 111.532 177.931 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . 0.41 ' O ' ' HG ' ' A' ' 41' ' ' LEU . 31.8 tt0 -45.49 -57.47 4.1 Favored 'General case' 0 N--CA 1.481 1.086 0 C-N-CA 124.681 1.192 . . . . 73.510000000000005 112.972 -174.823 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 46.1 t -58.04 -39.88 74.31 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.143 0 C-N-CA 123.344 0.658 . . . . 74.549999999999997 111.378 -175.514 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 74.3 m -68.38 -43.7 76.78 Favored 'General case' 0 N--CA 1.474 0.739 0 C-N-CA 123.097 0.559 . . . . 72.129999999999995 111.272 179.189 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 34.9 t80 -64.96 -47.51 77.36 Favored 'General case' 0 N--CA 1.471 0.61 0 O-C-N 123.824 0.703 . . . . 71.099999999999994 110.059 -177.128 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . 0.41 ' HG ' ' O ' ' A' ' 37' ' ' GLU . 57.8 mt -59.81 -50.53 73.46 Favored 'General case' 0 C--N 1.351 0.667 0 O-C-N 124.636 1.21 . . . . 74.349999999999994 110.082 178.952 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 53.4 tt0 -60.22 -41.72 93.69 Favored 'General case' 0 N--CA 1.476 0.87 0 O-C-N 123.637 0.585 . . . . 72.340000000000003 111.497 -178.442 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 43' ' ' SER . . . . . 0.467 ' O ' HG21 ' A' ' 47' ' ' VAL . 70.2 m -60.85 -60.38 3.88 Favored 'General case' 0 N--CA 1.471 0.591 0 C-N-CA 123.169 0.588 . . . . 75.310000000000002 110.641 -179.102 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 44' ' ' ILE . . . . . 0.46 HG12 ' HE2' ' A' ' 48' ' ' MET . 16.3 tt -63.37 -30.33 49.5 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.977 0 O-C-N 123.808 0.692 . . . . 72.420000000000002 111.321 -175.57 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 9.6 mm-40 -59.38 -55.12 38.7 Favored 'General case' 0 N--CA 1.481 1.103 0 C-N-CA 123.301 0.64 . . . . 74.420000000000002 110.796 171.226 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 19.9 m -67.18 -23.8 65.8 Favored 'General case' 0 CA--C 1.55 0.967 0 CA-C-N 115.656 -0.702 . . . . 75.209999999999994 111.652 -174.369 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 47' ' ' VAL . . . . . 0.55 HG22 ' HB3' ' A' ' 10' ' ' ARG . 40.4 t -83.28 -35.82 12.2 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.086 0 C-N-CA 122.618 0.367 . . . . 72.329999999999998 111.143 176.532 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 48' ' ' MET . . . . . 0.46 ' HE2' HG12 ' A' ' 44' ' ' ILE . 74.6 mtm -70.13 -34.93 73.69 Favored 'General case' 0 N--CA 1.49 1.567 0 C-N-CA 122.504 0.321 . . . . 72.310000000000002 111.476 179.398 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 10.9 pt-20 -78.01 -22.53 49.16 Favored 'General case' 0 N--CA 1.478 0.964 0 C-N-CA 122.347 0.259 . . . . 75.099999999999994 110.443 175.776 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 15.0 tppt? -69.21 133.77 48.39 Favored 'General case' 0 N--CA 1.473 0.686 0 C-N-CA 123.61 0.764 . . . . 74.040000000000006 111.117 -174.207 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 8.3 tt0 -83.72 128.41 34.51 Favored 'General case' 0 C--O 1.239 0.535 0 N-CA-C 108.886 -0.783 . . . . 73.409999999999997 108.886 174.757 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 17.1 m -70.36 134.29 86.95 Favored Pre-proline 0 CA--C 1.551 0.99 0 C-N-CA 124.058 0.943 . . . . 62.450000000000003 110.658 178.995 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 24.2 Cg_exo -66.5 152.52 80.65 Favored 'Trans proline' 0 C--N 1.378 2.089 0 C-N-CA 121.908 1.739 . . . . 74.549999999999997 111.961 171.954 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 21.3 Cg_exo -67.36 -46.78 2.61 Favored 'Trans proline' 0 C--N 1.372 1.809 0 C-N-CA 122.998 2.465 . . . . 64.109999999999999 111.685 173.354 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . -66.22 81.28 0.1 Allowed Glycine 0 C--N 1.351 1.396 0 O-C-N 124.112 0.882 . . . . 74.209999999999994 113.455 -178.651 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 56' ' ' ILE . . . . . 0.541 ' HB ' HD11 ' A' ' 113' ' ' LEU . 6.9 mt -137.87 117.6 15.37 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.515 0 C-N-CA 125.54 1.536 . . . . 75.120000000000005 107.702 178.325 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 57' ' ' THR . . . . . 0.454 ' H ' HD12 ' A' ' 60' ' ' ILE . 47.4 p -78.01 -178.26 5.44 Favored 'General case' 0 N--CA 1.473 0.682 0 C-N-CA 123.863 0.865 . . . . 71.450000000000003 110.482 -179.271 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 28.4 tpt180 -65.19 -45.17 85.88 Favored 'General case' 0 CA--C 1.542 0.644 0 CA-C-N 116.248 -0.433 . . . . 75.109999999999999 110.019 174.881 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 40.3 m -58.53 -42.46 87.82 Favored 'General case' 0 N--CA 1.485 1.276 0 CA-C-O 121.405 0.621 . . . . 71.519999999999996 111.096 179.732 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 60' ' ' ILE . . . . . 0.454 HD12 ' H ' ' A' ' 57' ' ' THR . 83.7 mt -66.68 -41.19 87.73 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.522 0 CA-C-N 115.073 -0.967 . . . . 75.319999999999993 110.104 178.25 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 58.9 tt0 -62.17 -36.22 81.19 Favored 'General case' 0 CA--C 1.547 0.844 0 C-N-CA 123.393 0.677 . . . . 73.439999999999998 110.43 177.332 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 65.9 m-20 -66.05 -46.55 77.39 Favored 'General case' 0 N--CA 1.48 1.057 0 C-N-CA 123.288 0.635 . . . . 72.120000000000005 110.764 178.518 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 63' ' ' MET . . . . . . . . . . . . . 71.1 mtm -65.74 -51.9 55.5 Favored 'General case' 0 N--CA 1.482 1.175 0 O-C-N 123.557 0.536 . . . . 43.409999999999997 111.16 -179.007 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 64' ' ' VAL . . . . . 0.505 ' O ' HG13 ' A' ' 68' ' ' ILE . 77.1 t -57.98 -56.17 17.41 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.725 0 C-N-CA 123.955 0.902 . . . . 74.549999999999997 110.809 179.997 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . 0.426 ' HB1' HD23 ' A' ' 109' ' ' LEU . . . -59.14 -42.2 90.13 Favored 'General case' 0 N--CA 1.487 1.41 0 C-N-CA 123.05 0.54 . . . . 64.0 110.767 179.837 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -56.34 -42.69 89.36 Favored Glycine 0 C--N 1.344 1.026 0 O-C-N 124.153 0.908 . . . . 63.240000000000002 112.12 176.814 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 67' ' ' TYR . . . . . 0.47 ' CE2' ' HG2' ' A' ' 12' ' ' GLN . 16.7 m-30 -70.7 -37.79 73.6 Favored 'General case' 0 N--CA 1.478 0.945 0 C-N-CA 123.847 0.859 . . . . 75.030000000000001 111.946 179.09 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 68' ' ' ILE . . . . . 0.505 HG13 ' O ' ' A' ' 64' ' ' VAL . 64.7 mt -58.44 -58.88 4.69 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.027 0 O-C-N 124.169 0.918 . . . . 75.340000000000003 108.851 179.185 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 69' ' ' LYS . . . . . 0.461 ' HB2' ' HE2' ' A' ' 106' ' ' TYR . 20.1 ttpp -60.63 -41.12 94.23 Favored 'General case' 0 C--N 1.347 0.462 0 O-C-N 124.151 0.907 . . . . 75.040000000000006 110.243 -179.143 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 62.3 tt0 -57.02 -47.98 79.59 Favored 'General case' 0 N--CA 1.478 0.95 0 C-N-CA 123.538 0.735 . . . . 71.209999999999994 111.406 -178.788 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 71' ' ' THR . . . . . 0.597 ' HB ' ' HA ' ' A' ' 15' ' ' ALA . 9.1 t -77.64 -25.47 49.7 Favored 'General case' 0 C--N 1.351 0.647 0 N-CA-C 110.07 -0.345 . . . . 73.530000000000001 110.07 -175.469 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 72' ' ' LEU . . . . . 0.462 ' HG ' ' O ' ' A' ' 68' ' ' ILE . 37.5 mt -67.75 -38.8 83.95 Favored 'General case' 0 C--O 1.209 -1.07 0 O-C-N 123.507 0.504 . . . . 74.329999999999998 110.107 171.026 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 75.2 m-20 -73.62 -41.22 63.08 Favored 'General case' 0 N--CA 1.484 1.234 0 C-N-CA 123.53 0.732 . . . . 75.299999999999997 110.995 -178.544 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 74' ' ' ASN . . . . . 0.422 ' HA ' HD21 ' A' ' 22' ' ' LEU . 86.4 m-20 -61.79 -52.11 65.55 Favored 'General case' 0 N--CA 1.475 0.804 0 O-C-N 123.911 0.757 . . . . 71.510000000000005 109.558 178.491 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . 0.416 ' O ' ' HG2' ' A' ' 79' ' ' LYS . 17.3 tt0 -76.58 -19.22 58.11 Favored 'General case' 0 CA--C 1.552 1.042 0 CA-C-N 115.642 -0.708 . . . . 73.219999999999999 111.688 -178.101 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 9.8 tt0 -68.65 -46.74 68.37 Favored 'General case' 0 N--CA 1.488 1.448 0 N-CA-C 109.547 -0.538 . . . . 75.049999999999997 109.547 173.6 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 92.3 mt -61.26 -38.87 88.26 Favored 'General case' 0 C--N 1.346 0.449 0 CA-C-N 115.661 -0.699 . . . . 62.340000000000003 109.623 174.449 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . 0.609 HD23 ' HA ' ' A' ' 22' ' ' LEU . 50.3 mt -59.07 -42.64 90.87 Favored 'General case' 0 C--N 1.358 0.962 0 O-C-N 123.92 0.762 . . . . 75.120000000000005 111.833 172.805 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 79' ' ' LYS . . . . . 0.422 ' HD2' HD21 ' A' ' 86' ' ' LEU . 28.9 mmtm -57.08 -47.15 81.71 Favored 'General case' 0 N--CA 1.482 1.135 0 N-CA-C 109.735 -0.469 . . . . 74.450000000000003 109.735 176.608 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 80' ' ' GLY . . . . . 0.693 ' HA2' ' HA ' ' A' ' 84' ' ' GLN . . . -67.6 -28.75 73.56 Favored Glycine 0 C--N 1.344 0.998 0 O-C-N 124.518 1.136 . . . . 54.340000000000003 114.17 178.754 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 5.8 tt -85.43 -39.56 17.4 Favored 'General case' 0 N--CA 1.478 0.925 0 C-N-CA 124.309 1.044 . . . . 73.439999999999998 110.528 -173.279 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 67.5 mt -84.23 -43.39 14.94 Favored 'General case' 0 CA--C 1.548 0.885 0 C-N-CA 123.704 0.801 . . . . 74.409999999999997 111.265 -169.847 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 21.8 tp60 -151.48 1.29 0.38 Allowed 'General case' 0 N--CA 1.493 1.69 0 N-CA-C 112.192 0.441 . . . . 71.120000000000005 112.192 -177.801 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 84' ' ' GLN . . . . . 0.693 ' HA ' ' HA2' ' A' ' 80' ' ' GLY . 23.4 mt-30 62.65 19.25 11.21 Favored 'General case' 0 N--CA 1.491 1.584 0 C-N-CA 124.188 0.995 . . . . 72.150000000000006 111.267 -169.929 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 85' ' ' ARG . . . . . . . . . . . . . 34.2 ttt180 -165.17 172.72 12.17 Favored 'General case' 0 CA--C 1.55 0.966 0 C-N-CA 123.456 0.702 . . . . 74.519999999999996 109.658 -168.143 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 86' ' ' LEU . . . . . 0.422 HD21 ' HD2' ' A' ' 79' ' ' LYS . 89.9 mt -57.94 97.88 0.03 OUTLIER 'General case' 0 C--N 1.356 0.875 0 C-N-CA 124.578 1.151 . . . . 73.430000000000007 112.01 178.093 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 5.9 p-10 -86.44 -161.15 0.62 Allowed 'General case' 0 CA--C 1.553 1.072 0 C-N-CA 123.843 0.857 . . . . 73.120000000000005 109.945 175.778 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 9.5 tp10 -60.33 -24.88 65.37 Favored 'General case' 0 N--CA 1.483 1.209 0 C-N-CA 123.786 0.835 . . . . 73.219999999999999 113.066 -175.515 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 96.1 mt -65.83 -10.41 37.63 Favored 'General case' 0 N--CA 1.486 1.347 0 N-CA-C 113.299 0.852 . . . . 74.150000000000006 113.299 -177.299 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 94.7 p -82.58 -5.04 58.55 Favored 'General case' 0 N--CA 1.482 1.148 0 C-N-CA 122.957 0.503 . . . . 73.420000000000002 111.496 175.723 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 45.7 t -70.53 84.99 0.61 Allowed 'General case' 0 N--CA 1.481 1.103 0 C-N-CA 124.149 0.98 . . . . 70.129999999999995 110.497 178.426 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 92' ' ' LEU . . . . . 0.488 HD11 ' HG2' ' A' ' 98' ' ' ARG . 80.7 mt -141.31 -139.19 0.12 Allowed 'General case' 0 N--CA 1.476 0.861 0 C-N-CA 124.402 1.081 . . . . 61.420000000000002 108.492 -175.865 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 28.3 mt -45.84 -43.83 4.55 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.819 0 C-N-CA 123.87 0.868 . . . . 75.239999999999995 110.535 171.629 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -171.09 158.96 30.74 Favored Glycine 0 C--O 1.252 1.225 0 CA-C-N 114.227 -1.352 . . . . 72.120000000000005 111.167 175.162 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 4.9 pm0 -55.56 127.34 29.3 Favored 'General case' 0 CA--C 1.552 1.056 0 C-N-CA 124.248 1.019 . . . . 72.219999999999999 110.126 172.224 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 20.1 t 76.52 -46.29 0.52 Allowed 'General case' 0 N--CA 1.487 1.397 0 C-N-CA 125.618 1.567 . . . . 73.430000000000007 113.824 178.126 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 6.5 t -52.4 -32.32 38.4 Favored 'General case' 0 N--CA 1.491 1.583 0 C-N-CA 123.947 0.899 . . . . 73.409999999999997 112.624 -169.163 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 98' ' ' ARG . . . . . 0.488 ' HG2' HD11 ' A' ' 92' ' ' LEU . 0.0 OUTLIER -68.12 -33.84 75.26 Favored 'General case' 0 CA--C 1.55 0.961 0 O-C-N 123.875 0.734 . . . . 75.200000000000003 112.852 -175.076 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 27.4 mt-30 -66.51 -39.65 88.79 Favored 'General case' 0 N--CA 1.481 1.118 0 N-CA-C 109.176 -0.675 . . . . 75.010000000000005 109.176 175.649 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 100' ' ' LYS . . . . . 0.505 ' HZ2' ' HA ' ' A' ' 100' ' ' LYS . 0.0 OUTLIER -66.29 -35.69 81.04 Favored 'General case' 0 C--O 1.214 -0.779 0 CA-C-N 115.153 -0.93 . . . . 73.109999999999999 110.497 172.697 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 62.4 m -63.53 -45.12 92.06 Favored 'General case' 0 N--CA 1.479 0.987 0 C-N-CA 123.152 0.581 . . . . 75.049999999999997 111.292 -177.226 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 9.1 mp -76.17 -38.79 56.18 Favored 'General case' 0 N--CA 1.485 1.323 0 O-C-N 123.186 0.304 . . . . 75.140000000000001 111.494 179.103 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 4.4 t-20 -63.52 -40.32 96.72 Favored 'General case' 0 N--CA 1.486 1.342 0 CA-C-O 121.244 0.545 . . . . 50.520000000000003 110.684 177.374 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 26.1 t-20 -72.27 -38.77 68.76 Favored 'General case' 0 N--CA 1.471 0.584 0 CA-C-N 115.271 -0.877 . . . . 72.519999999999996 109.492 178.876 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -62.59 -31.36 72.18 Favored 'General case' 0 N--CA 1.476 0.848 0 C-N-CA 123.408 0.683 . . . . 70.150000000000006 111.079 175.863 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 106' ' ' TYR . . . . . 0.461 ' HE2' ' HB2' ' A' ' 69' ' ' LYS . 2.9 t80 -67.71 -50.56 56.85 Favored 'General case' 0 C--N 1.35 0.628 0 N-CA-C 108.921 -0.77 . . . . 72.319999999999993 108.921 175.808 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -62.86 -30.3 76.75 Favored Glycine 0 C--N 1.351 1.381 0 O-C-N 123.608 0.568 . . . . 74.510000000000005 113.107 177.377 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 1.2 mpt_? -77.14 -29.43 54.65 Favored 'General case' 0 N--CA 1.468 0.461 0 C-N-CA 123.985 0.914 . . . . 75.409999999999997 110.185 176.67 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 109' ' ' LEU . . . . . 0.486 HD12 ' HB2' ' A' ' 114' ' ' LEU . 34.6 tp -71.7 -34.92 70.03 Favored 'General case' 0 N--CA 1.479 1.018 0 N-CA-C 109.393 -0.595 . . . . 74.540000000000006 109.393 175.08 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 47.9 t -66.04 -42.93 88.93 Favored 'General case' 0 CA--C 1.54 0.578 0 CA-C-N 114.912 -1.04 . . . . 74.409999999999997 109.819 173.52 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . -90.27 -68.07 1.21 Allowed Glycine 0 C--N 1.364 2.138 0 CA-C-O 119.027 -0.874 . . . . 62.530000000000001 114.8 -175.816 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 112' ' ' MET . . . . . 0.61 ' HG3' ' HA ' ' A' ' 117' ' ' ASP . 2.8 tmm? -97.85 -66.33 0.91 Allowed 'General case' 0 N--CA 1.488 1.447 0 CA-C-N 118.647 1.224 . . . . 74.299999999999997 113.049 -174.078 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 113' ' ' LEU . . . . . 0.541 HD11 ' HB ' ' A' ' 56' ' ' ILE . 0.2 OUTLIER 171.39 50.29 0.0 OUTLIER 'General case' 0 N--CA 1.495 1.786 0 C-N-CA 124.324 1.049 . . . . 74.420000000000002 109.866 178.164 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 114' ' ' LEU . . . . . 0.486 ' HB2' HD12 ' A' ' 109' ' ' LEU . 6.0 tt 77.69 -27.23 0.17 Allowed 'General case' 0 N--CA 1.501 2.088 0 C-N-CA 126.136 1.774 . . . . 71.430000000000007 112.17 175.608 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 115' ' ' VAL . . . . . 0.433 ' HA ' ' HD3' ' A' ' 116' ' ' PRO . 2.9 m -92.35 141.58 25.07 Favored Pre-proline 0 CA--C 1.546 0.8 0 C-N-CA 123.966 0.906 . . . . 73.430000000000007 109.135 178.427 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 116' ' ' PRO . . . . . 0.433 ' HD3' ' HA ' ' A' ' 115' ' ' VAL . 21.6 Cg_exo -66.09 78.92 0.3 Allowed 'Trans proline' 0 C--N 1.377 2.031 0 C-N-CA 123.728 2.952 . . . . 74.340000000000003 113.685 -175.56 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 117' ' ' ASP . . . . . 0.61 ' HA ' ' HG3' ' A' ' 112' ' ' MET . 62.8 m-20 63.55 5.57 2.2 Favored 'General case' 0 N--CA 1.482 1.147 0 C-N-CA 125.722 1.609 . . . . 73.209999999999994 114.404 172.645 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -97.27 139.18 21.31 Favored Pre-proline 0 N--CA 1.479 1.0 0 C-N-CA 123.369 0.667 . . . . 73.129999999999995 110.004 -179.447 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 119' ' ' PRO . . . . . . . . . . . . . 34.7 Cg_endo -63.68 124.36 13.54 Favored 'Trans proline' 0 C--N 1.375 1.969 0 C-N-CA 122.45 2.1 . . . . 71.430000000000007 111.883 -179.985 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . -68.98 178.49 25.73 Favored Glycine 0 C--N 1.346 1.119 0 N-CA-C 114.611 0.604 . . . . 73.239999999999995 114.611 -175.127 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . -144.96 135.42 24.28 Favored 'General case' 0 N--CA 1.475 0.801 0 C-N-CA 123.362 0.665 . . . . 72.409999999999997 110.154 -178.583 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 122' ' ' SER . . . . . . . . . . . . . 20.3 m . . . . . 0 CA--C 1.553 1.089 0 C-N-CA 123.535 0.734 . . . . 74.549999999999997 109.401 176.438 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 1' ' ' MET . . . . . 0.461 ' HG2' HG23 ' A' ' 5' ' ' VAL . 25.1 ttt . . . . . 0 CA--C 1.554 1.106 0 CA-C-O 119.738 -0.173 . . . . 72.420000000000002 110.938 . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 39.8 p -51.29 -40.39 58.87 Favored 'General case' 0 N--CA 1.486 1.357 0 C-N-CA 123.802 0.841 . . . . 75.319999999999993 112.638 -174.643 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 79.6 p -64.88 -41.98 95.19 Favored 'General case' 0 C--N 1.357 0.895 0 O-C-N 123.456 0.472 . . . . 73.239999999999995 110.436 -178.268 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 4' ' ' THR . . . . . 0.467 ' HA ' ' HG2' ' A' ' 53' ' ' PRO . 33.5 m -67.57 -47.08 70.83 Favored 'General case' 0 C--N 1.356 0.878 0 O-C-N 123.632 0.582 . . . . 74.120000000000005 111.278 178.968 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . 0.461 HG23 ' HG2' ' A' ' 1' ' ' MET . 64.1 t -60.39 -43.27 93.55 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.411 0 C-N-CA 123.546 0.738 . . . . 71.200000000000003 110.708 -178.606 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . 0.46 ' O ' ' HG3' ' A' ' 10' ' ' ARG . 3.2 tm-20 -71.87 -34.2 69.02 Favored 'General case' 0 CA--C 1.54 0.594 0 CA-C-N 114.727 -1.124 . . . . 75.099999999999994 109.822 -178.014 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 59.4 t80 -67.72 -39.22 84.31 Favored 'General case' 0 CA--C 1.553 1.064 0 C-N-CA 123.578 0.751 . . . . 74.329999999999998 110.807 176.545 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . 0.418 HG13 ' O ' ' A' ' 4' ' ' THR . 87.8 mt -64.07 -39.94 87.28 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.965 0 N-CA-C 109.058 -0.719 . . . . 75.209999999999994 109.058 174.054 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 3.8 t-20 -66.63 -30.74 71.08 Favored 'General case' 0 C--N 1.354 0.779 0 O-C-N 123.919 0.762 . . . . 71.150000000000006 110.57 179.434 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . 0.46 ' HG3' ' O ' ' A' ' 6' ' ' GLU . 85.4 mtt180 -64.58 -46.08 84.27 Favored 'General case' 0 N--CA 1.477 0.91 0 C-N-CA 123.211 0.605 . . . . 71.510000000000005 109.745 173.349 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' TRP . . . . . 0.426 ' CD1' HG11 ' A' ' 64' ' ' VAL . 81.5 m95 -65.65 -31.73 72.92 Favored 'General case' 0 N--CA 1.48 1.033 0 O-C-N 123.618 0.574 . . . . 74.049999999999997 111.962 176.629 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . 0.414 ' HG2' ' CE2' ' A' ' 67' ' ' TYR . 55.3 mt-30 -61.6 -45.86 92.3 Favored 'General case' 0 C--N 1.354 0.776 0 N-CA-C 108.685 -0.857 . . . . 73.439999999999998 108.685 172.718 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . 0.439 ' NH2' ' HB3' ' A' ' 39' ' ' SER . 14.0 tpt180 -61.41 -49.41 76.97 Favored 'General case' 0 CA--C 1.545 0.788 0 O-C-N 123.832 0.708 . . . . 73.209999999999994 110.907 -178.221 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' ILE . . . . . 0.432 HD12 HG23 ' A' ' 47' ' ' VAL . 54.3 mt -62.75 -47.99 90.25 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.409 0 C-N-CA 122.658 0.383 . . . . 74.519999999999996 110.57 -178.785 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . 0.551 ' HA ' ' HB ' ' A' ' 71' ' ' THR . . . -59.07 -45.72 90.11 Favored 'General case' 0 N--CA 1.477 0.924 0 C-N-CA 124.148 0.979 . . . . 73.439999999999998 111.388 -178.249 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 94.5 mt -76.34 -34.13 58.98 Favored 'General case' 0 N--CA 1.482 1.17 0 O-C-N 124.344 1.028 . . . . 72.439999999999998 111.499 -175.885 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . 0.461 ' O ' ' HG ' ' A' ' 21' ' ' LEU . 34.2 mt -64.09 -56.83 12.13 Favored 'General case' 0 N--CA 1.476 0.864 0 N-CA-C 109.242 -0.651 . . . . 72.040000000000006 109.242 176.868 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 69.0 p -63.03 -32.01 73.28 Favored 'General case' 0 N--CA 1.475 0.777 0 O-C-N 124.223 0.952 . . . . 72.109999999999999 111.582 -178.78 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 6.7 tp-100 -59.63 -51.95 67.62 Favored 'General case' 0 N--CA 1.478 0.971 0 C-N-CA 123.662 0.785 . . . . 75.319999999999993 109.861 172.716 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 51.3 m -60.15 -41.97 93.88 Favored 'General case' 0 C--O 1.215 -0.759 0 O-C-N 124.163 0.914 . . . . 74.430000000000007 110.314 177.045 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . 0.564 HD21 ' HA ' ' A' ' 33' ' ' LEU . 35.2 mt -67.65 -33.34 74.76 Favored 'General case' 0 C--N 1.348 0.527 0 C-N-CA 123.035 0.534 . . . . 75.230000000000004 110.849 -176.459 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . 0.545 ' HA ' HD22 ' A' ' 78' ' ' LEU . 47.8 tp -69.83 -49.95 47.54 Favored 'General case' 0 C--O 1.244 0.771 0 O-C-N 123.74 0.65 . . . . 74.219999999999999 109.939 179.041 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . 0.52 ' HB3' ' HE ' ' A' ' 27' ' ' ARG . 42.5 mt-10 -55.21 -60.48 3.33 Favored 'General case' 0 C--N 1.352 0.678 0 O-C-N 124.219 0.949 . . . . 72.129999999999995 110.37 176.941 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . 0.475 HD21 ' HD2' ' A' ' 27' ' ' ARG . 79.1 mt -61.36 -32.19 72.09 Favored 'General case' 0 CA--C 1.542 0.639 0 C-N-CA 124.652 1.181 . . . . 74.239999999999995 111.847 -176.543 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . 0.436 ' HB1' HD22 ' A' ' 33' ' ' LEU . . . -61.22 -49.07 78.62 Favored 'General case' 0 N--CA 1.482 1.131 0 CA-C-O 120.873 0.368 . . . . 71.140000000000001 110.191 174.912 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 95.2 mt-30 -72.11 -22.99 61.25 Favored 'General case' 0 CA--C 1.549 0.924 0 CA-C-N 115.017 -0.992 . . . . 75.239999999999995 111.759 -179.216 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . 0.52 ' HE ' ' HB3' ' A' ' 23' ' ' GLU . 47.2 mtt-85 -80.52 -10.03 59.75 Favored 'General case' 0 N--CA 1.485 1.324 0 C-N-CA 123.638 0.775 . . . . 74.310000000000002 110.95 174.179 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 83.39 9.0 84.28 Favored Glycine 0 C--N 1.348 1.228 0 C-N-CA 122.673 0.178 . . . . 72.239999999999995 113.316 -178.8 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 20.9 mm-40 -86.56 55.08 3.4 Favored 'General case' 0 CA--C 1.547 0.846 0 C-N-CA 125.306 1.442 . . . . 74.200000000000003 110.777 178.836 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 30' ' ' TRP . . . . . 0.431 ' O ' ' HG ' ' A' ' 34' ' ' LEU . 86.4 m95 -63.13 -29.03 70.47 Favored 'General case' 0 N--CA 1.481 1.089 0 C-N-CA 123.681 0.792 . . . . 75.120000000000005 111.313 -177.654 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 20.1 m-20 -53.6 -48.93 68.8 Favored 'General case' 0 N--CA 1.48 1.069 0 C-N-CA 123.608 0.763 . . . . 73.340000000000003 110.131 175.43 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . 0.463 HD13 HD22 ' A' ' 24' ' ' LEU . 34.7 mt -63.97 -30.67 71.73 Favored 'General case' 0 CA--C 1.542 0.654 0 CA-C-N 115.094 -0.957 . . . . 71.519999999999996 111.063 -176.242 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . 0.564 ' HA ' HD21 ' A' ' 21' ' ' LEU . 9.8 mp -63.96 -46.3 85.26 Favored 'General case' 0 N--CA 1.477 0.91 0 O-C-N 123.585 0.553 . . . . 75.030000000000001 110.159 171.327 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . 0.431 ' HG ' ' O ' ' A' ' 30' ' ' TRP . 64.6 mt -63.37 -30.78 71.86 Favored 'General case' 0 N--CA 1.484 1.269 0 C-N-CA 123.367 0.667 . . . . 72.040000000000006 112.21 -177.862 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 1.3 mp0 -74.24 -49.06 24.87 Favored 'General case' 0 N--CA 1.485 1.284 0 C-N-CA 122.526 0.33 . . . . 74.129999999999995 111.009 173.798 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 36' ' ' GLN . . . . . 0.485 ' HB2' HD22 ' A' ' 21' ' ' LEU . 84.5 mm-40 -69.42 -14.44 62.9 Favored 'General case' 0 N--CA 1.48 1.034 0 C-N-CA 123.41 0.684 . . . . 74.230000000000004 111.966 179.617 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . 0.469 ' O ' ' HG ' ' A' ' 41' ' ' LEU . 28.2 tt0 -48.04 -54.62 12.43 Favored 'General case' 0 N--CA 1.481 1.086 0 C-N-CA 124.903 1.281 . . . . 70.519999999999996 111.876 178.536 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 59.6 t -57.4 -45.38 85.5 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.998 0 C-N-CA 123.973 0.909 . . . . 74.030000000000001 110.726 -176.494 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 39' ' ' SER . . . . . 0.439 ' HB3' ' NH2' ' A' ' 13' ' ' ARG . 41.5 m -67.08 -36.88 82.95 Favored 'General case' 0 CA--C 1.542 0.643 0 CA-C-N 114.792 -1.095 . . . . 70.430000000000007 111.401 179.056 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 76.5 t80 -69.2 -46.94 66.22 Favored 'General case' 0 N--CA 1.477 0.896 0 C-N-CA 123.745 0.818 . . . . 74.150000000000006 110.291 -176.255 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . 0.469 ' HG ' ' O ' ' A' ' 37' ' ' GLU . 73.9 mt -58.31 -52.18 66.69 Favored 'General case' 0 C--N 1.355 0.807 0 O-C-N 124.672 1.233 . . . . 74.120000000000005 109.13 176.773 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 50.3 tt0 -54.76 -48.22 72.92 Favored 'General case' 0 C--N 1.354 0.779 0 O-C-N 124.003 0.814 . . . . 75.109999999999999 111.498 -178.232 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 43' ' ' SER . . . . . 0.457 ' O ' HG21 ' A' ' 47' ' ' VAL . 68.1 m -61.41 -59.7 4.85 Favored 'General case' 0 CA--C 1.545 0.767 0 C-N-CA 123.069 0.548 . . . . 72.010000000000005 111.259 -178.263 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 44' ' ' ILE . . . . . 0.529 HG12 ' HE2' ' A' ' 48' ' ' MET . 12.6 tt -59.95 -39.37 79.96 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.145 0 O-C-N 123.821 0.701 . . . . 74.349999999999994 111.319 -172.914 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 18.3 mm-40 -65.25 -54.34 30.82 Favored 'General case' 0 N--CA 1.475 0.796 0 C-N-CA 123.554 0.741 . . . . 73.120000000000005 110.892 177.673 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 46' ' ' THR . . . . . 0.442 ' O ' ' HD3' ' A' ' 50' ' ' LYS . 87.9 m -56.47 -31.46 64.04 Favored 'General case' 0 N--CA 1.489 1.502 0 C-N-CA 123.469 0.708 . . . . 75.400000000000006 111.925 -177.831 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 47' ' ' VAL . . . . . 0.457 HG21 ' O ' ' A' ' 43' ' ' SER . 60.9 t -76.21 -46.33 33.63 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.821 0 CA-C-N 116.848 -0.16 . . . . 74.349999999999994 111.212 177.332 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 48' ' ' MET . . . . . 0.529 ' HE2' HG12 ' A' ' 44' ' ' ILE . 70.6 mtm -74.6 -21.07 59.66 Favored 'General case' 0 N--CA 1.487 1.392 0 N-CA-C 112.811 0.671 . . . . 75.239999999999995 112.811 -175.842 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 50.7 mt-10 -83.14 -37.3 23.9 Favored 'General case' 0 N--CA 1.488 1.455 0 C-N-CA 122.699 0.4 . . . . 75.230000000000004 111.07 177.681 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . 0.442 ' HD3' ' O ' ' A' ' 46' ' ' THR . 13.6 mptt -91.45 147.02 23.33 Favored 'General case' 0 N--CA 1.475 0.8 0 CA-C-N 115.67 -0.696 . . . . 75.140000000000001 110.036 -170.485 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 7.6 tt0 -71.83 136.52 47.04 Favored 'General case' 0 CA--C 1.539 0.539 0 CA-C-N 115.013 -0.994 . . . . 74.109999999999999 110.757 -173.655 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 52' ' ' THR . . . . . 0.758 HG22 ' HB3' ' A' ' 114' ' ' LEU . 59.9 m -70.44 133.16 87.22 Favored Pre-proline 0 CA--C 1.555 1.168 0 CA-C-N 115.263 -0.88 . . . . 74.140000000000001 110.109 173.313 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 53' ' ' PRO . . . . . 0.467 ' HG2' ' HA ' ' A' ' 4' ' ' THR . 45.4 Cg_exo -58.62 151.98 59.08 Favored 'Trans proline' 0 C--N 1.383 2.356 0 C-N-CA 122.379 2.053 . . . . 73.120000000000005 113.162 177.63 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 18.5 Cg_exo -68.68 -46.96 1.52 Allowed 'Trans proline' 0 C--N 1.375 1.972 0 C-N-CA 122.963 2.442 . . . . 71.239999999999995 110.994 172.827 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . -68.99 87.18 0.22 Allowed Glycine 0 C--N 1.349 1.268 0 CA-C-N 114.928 -1.033 . . . . 70.319999999999993 113.134 -179.164 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 80.3 mt -128.15 123.99 61.54 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.639 0 C-N-CA 124.574 1.15 . . . . 53.210000000000001 108.005 173.891 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 57' ' ' THR . . . . . 0.407 ' H ' HD12 ' A' ' 60' ' ' ILE . 31.9 p -85.2 179.23 7.27 Favored 'General case' 0 N--CA 1.473 0.703 0 N-CA-C 109.31 -0.626 . . . . 64.340000000000003 109.31 176.249 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 39.1 tpt85 -64.43 -47.04 80.63 Favored 'General case' 0 CA--C 1.541 0.606 0 C-N-CA 122.917 0.487 . . . . 74.219999999999999 109.772 176.176 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 17.7 m -60.84 -41.61 96.17 Favored 'General case' 0 N--CA 1.475 0.811 0 C-N-CA 123.683 0.793 . . . . 61.210000000000001 111.35 179.517 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 60' ' ' ILE . . . . . 0.407 HD12 ' H ' ' A' ' 57' ' ' THR . 98.1 mt -64.28 -42.04 94.22 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.95 0 C-N-CA 123.242 0.617 . . . . 72.209999999999994 110.43 177.826 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 49.0 tt0 -58.08 -42.23 85.11 Favored 'General case' 0 CA--C 1.544 0.72 0 O-C-N 123.801 0.688 . . . . 74.140000000000001 110.548 176.359 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 35.4 m-20 -68.82 -39.31 80.08 Favored 'General case' 0 N--CA 1.48 1.026 0 C-N-CA 123.214 0.606 . . . . 74.420000000000002 112.078 -179.608 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 63' ' ' MET . . . . . . . . . . . . . 71.6 mtm -68.68 -46.17 69.77 Favored 'General case' 0 N--CA 1.482 1.175 0 O-C-N 123.322 0.389 . . . . 63.450000000000003 110.691 -179.821 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 64' ' ' VAL . . . . . 0.518 ' O ' HG13 ' A' ' 68' ' ' ILE . 70.6 t -63.91 -60.05 3.34 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.558 0 CA-C-N 115.175 -0.92 . . . . 55.549999999999997 109.916 178.827 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . 0.485 ' HB1' HD21 ' A' ' 109' ' ' LEU . . . -60.92 -29.55 69.67 Favored 'General case' 0 N--CA 1.493 1.689 0 C-N-CA 123.298 0.639 . . . . 62.219999999999999 112.018 -179.054 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -67.0 -42.1 92.78 Favored Glycine 0 C--N 1.345 1.073 0 O-C-N 123.66 0.6 . . . . 65.420000000000002 111.928 176.018 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 67' ' ' TYR . . . . . 0.414 ' CE2' ' HG2' ' A' ' 12' ' ' GLN . 9.8 m-30 -75.89 -29.34 58.42 Favored 'General case' 0 N--CA 1.473 0.701 0 C-N-CA 123.046 0.539 . . . . 74.219999999999999 112.276 177.289 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 68' ' ' ILE . . . . . 0.522 ' O ' ' HG ' ' A' ' 72' ' ' LEU . 47.3 mt -64.03 -50.01 79.04 Favored 'Isoleucine or valine' 0 C--N 1.355 0.845 0 N-CA-C 107.251 -1.388 . . . . 73.349999999999994 107.251 172.306 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 69' ' ' LYS . . . . . 0.555 ' HB2' ' HE2' ' A' ' 106' ' ' TYR . 48.0 tttp -52.11 -48.46 64.77 Favored 'General case' 0 N--CA 1.481 1.098 0 C-N-CA 123.967 0.907 . . . . 73.310000000000002 111.149 176.432 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 60.7 tt0 -59.53 -46.38 89.04 Favored 'General case' 0 C--N 1.348 0.505 0 O-C-N 124.534 1.146 . . . . 72.549999999999997 110.41 -176.398 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 71' ' ' THR . . . . . 0.551 ' HB ' ' HA ' ' A' ' 15' ' ' ALA . 12.3 t -78.8 -18.74 53.63 Favored 'General case' 0 C--O 1.215 -0.752 0 CA-C-O 118.525 -0.75 . . . . 74.340000000000003 110.906 -177.91 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 72' ' ' LEU . . . . . 0.522 ' HG ' ' O ' ' A' ' 68' ' ' ILE . 37.6 mt -76.63 -33.42 58.35 Favored 'General case' 0 N--CA 1.491 1.611 0 CA-C-N 118.447 0.567 . . . . 64.439999999999998 110.791 173.596 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 50.8 m-20 -69.71 -49.01 57.43 Favored 'General case' 0 N--CA 1.476 0.855 0 N-CA-C 109.114 -0.698 . . . . 74.120000000000005 109.114 175.025 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 78.6 m-20 -57.86 -41.72 82.99 Favored 'General case' 0 N--CA 1.48 1.031 0 O-C-N 124.12 0.888 . . . . 73.129999999999995 110.714 175.522 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . 0.456 ' O ' ' HG2' ' A' ' 79' ' ' LYS . 11.2 tp10 -53.91 -61.64 2.17 Favored 'General case' 0 N--CA 1.485 1.284 0 C-N-CA 125.389 1.476 . . . . 54.450000000000003 110.697 176.234 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 9.1 tt0 -58.13 -46.77 85.03 Favored 'General case' 0 CA--C 1.543 0.702 0 O-C-N 124.056 0.848 . . . . 73.230000000000004 111.107 -174.094 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 95.2 mt -67.18 -40.25 86.55 Favored 'General case' 0 CA--C 1.545 0.751 0 CA-C-N 115.535 -0.757 . . . . 74.439999999999998 111.607 -176.538 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . 0.545 HD22 ' HA ' ' A' ' 22' ' ' LEU . 15.9 mt -65.79 -46.23 79.47 Favored 'General case' 0 N--CA 1.478 0.944 0 O-C-N 123.442 0.464 . . . . 75.209999999999994 111.807 -179.031 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 79' ' ' LYS . . . . . 0.456 ' HG2' ' O ' ' A' ' 75' ' ' GLU . 22.8 mmtp -70.57 -32.92 70.51 Favored 'General case' 0 N--CA 1.481 1.1 0 CA-C-O 121.002 0.429 . . . . 75.439999999999998 109.947 -178.438 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -64.67 -28.8 73.77 Favored Glycine 0 C--N 1.345 1.076 0 CA-C-N 114.594 -1.185 . . . . 75.109999999999999 112.983 172.354 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -83.79 -38.99 20.57 Favored 'General case' 0 CA--C 1.558 1.256 0 C-N-CA 123.46 0.704 . . . . 72.420000000000002 110.527 176.813 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 78.9 mt -72.29 -63.88 1.06 Allowed 'General case' 0 N--CA 1.483 1.21 0 C-N-CA 123.546 0.738 . . . . 71.310000000000002 111.634 -172.624 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 18.1 tp60 -135.29 21.85 3.44 Favored 'General case' 0 CA--C 1.547 0.852 0 C-N-CA 123.032 0.533 . . . . 71.420000000000002 109.746 -173.778 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 8.9 tt0 73.39 -17.01 0.45 Allowed 'General case' 0 N--CA 1.49 1.574 0 C-N-CA 125.299 1.44 . . . . 75.420000000000002 112.657 175.368 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 85' ' ' ARG . . . . . . . . . . . . . 81.3 mtt85 -145.02 171.99 13.69 Favored 'General case' 0 N--CA 1.469 0.519 0 C-N-CA 124.828 1.251 . . . . 74.420000000000002 109.21 -173.402 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 82.5 mt -53.89 96.78 0.02 OUTLIER 'General case' 0 N--CA 1.481 1.11 0 C-N-CA 124.147 0.979 . . . . 74.400000000000006 111.734 -175.746 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 27.0 t70 -166.79 112.21 0.78 Allowed 'General case' 0 CA--C 1.536 0.409 0 N-CA-C 107.612 -1.255 . . . . 73.5 107.612 -179.276 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 88' ' ' GLU . . . . . 0.403 ' HB3' ' HZ2' ' A' ' 79' ' ' LYS . 0.8 OUTLIER -100.68 -174.84 2.74 Favored 'General case' 0 N--CA 1.481 1.123 0 C-N-CA 123.375 0.67 . . . . 71.430000000000007 111.166 -175.342 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 39.9 mt -54.14 -40.63 67.56 Favored 'General case' 0 CA--C 1.548 0.887 0 CA-C-N 114.282 -1.326 . . . . 74.310000000000002 111.825 179.765 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 90' ' ' SER . . . . . 0.437 ' HB3' HD11 ' A' ' 41' ' ' LEU . 47.0 t -152.8 143.95 23.13 Favored 'General case' 0 N--CA 1.47 0.572 0 C-N-CA 123.641 0.777 . . . . 75.400000000000006 109.874 179.941 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 56.8 p -64.57 143.23 58.07 Favored 'General case' 0 CA--C 1.55 0.944 0 C-N-CA 123.843 0.857 . . . . 73.329999999999998 111.701 -177.578 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 92' ' ' LEU . . . . . 0.481 ' HB2' ' HA ' ' A' ' 96' ' ' SER . 90.8 mt -79.95 -84.21 0.09 Allowed 'General case' 0 CA--C 1.549 0.908 0 C-N-CA 123.725 0.81 . . . . 71.239999999999995 111.248 -175.253 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 5.9 mt -99.34 35.06 0.22 Allowed 'Isoleucine or valine' 0 N--CA 1.484 1.247 0 N-CA-C 108.34 -0.985 . . . . 64.430000000000007 108.34 -179.69 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 74.21 -70.87 1.53 Allowed Glycine 0 C--N 1.349 1.298 0 N-CA-C 109.255 -1.538 . . . . 74.310000000000002 109.255 -163.928 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 50.5 mt-30 -69.76 97.13 1.04 Allowed 'General case' 0 C--N 1.349 0.587 0 N-CA-C 108.038 -1.097 . . . . 74.120000000000005 108.038 161.782 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 96' ' ' SER . . . . . 0.481 ' HA ' ' HB2' ' A' ' 92' ' ' LEU . 17.3 m -71.69 90.29 1.05 Allowed 'General case' 0 CA--C 1.535 0.376 0 N-CA-C 109.176 -0.676 . . . . 75.230000000000004 109.176 178.707 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 11.3 t -85.96 44.34 1.12 Allowed 'General case' 0 CA--C 1.557 1.25 0 C-N-CA 123.825 0.85 . . . . 74.340000000000003 110.111 -179.182 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 98' ' ' ARG . . . . . 0.403 ' H ' ' HD2' ' A' ' 98' ' ' ARG . 0.2 OUTLIER -58.98 -53.35 59.37 Favored 'General case' 0 CA--C 1.548 0.891 0 C-N-CA 123.974 0.91 . . . . 74.120000000000005 110.86 -174.161 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 33.9 tt0 -72.61 -50.15 27.26 Favored 'General case' 0 C--N 1.346 0.441 0 C-N-CA 123.836 0.854 . . . . 75.209999999999994 109.508 -175.399 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 71.0 mmtt -60.44 -55.47 33.14 Favored 'General case' 0 N--CA 1.472 0.674 0 O-C-N 123.971 0.795 . . . . 75.310000000000002 110.501 -173.245 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 39.0 t -72.28 -44.25 63.05 Favored 'General case' 0 CA--C 1.546 0.825 0 O-C-N 124.062 0.851 . . . . 70.549999999999997 112.344 -174.526 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 6.4 tp -72.38 -38.24 68.53 Favored 'General case' 0 N--CA 1.49 1.563 0 CA-C-N 118.532 0.605 . . . . 72.230000000000004 110.617 -174.505 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 66.5 t30 -77.59 -24.89 49.61 Favored 'General case' 0 N--CA 1.478 0.949 0 CA-C-N 116.435 -0.348 . . . . 74.140000000000001 110.682 177.237 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 47.9 t30 -66.74 -38.29 86.36 Favored 'General case' 0 N--CA 1.488 1.445 0 C-N-CA 122.864 0.465 . . . . 73.120000000000005 109.818 171.201 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -61.34 -47.81 84.18 Favored 'General case' 0 C--N 1.352 0.7 0 O-C-N 123.896 0.748 . . . . 74.049999999999997 109.96 174.621 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 106' ' ' TYR . . . . . 0.555 ' HE2' ' HB2' ' A' ' 69' ' ' LYS . 4.6 t80 -55.93 -53.42 57.09 Favored 'General case' 0 CA--C 1.55 0.956 0 O-C-N 124.248 0.968 . . . . 73.5 111.06 176.354 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -68.5 -37.97 86.05 Favored Glycine 0 C--N 1.349 1.266 0 O-C-N 123.781 0.676 . . . . 63.450000000000003 113.268 -172.043 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 38.3 ttp-105 -71.01 -32.59 69.43 Favored 'General case' 0 CA--C 1.543 0.707 0 C-N-CA 123.665 0.786 . . . . 72.340000000000003 109.779 177.395 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 109' ' ' LEU . . . . . 0.566 ' HA ' ' N ' ' A' ' 114' ' ' LEU . 47.9 tp -66.99 -46.14 75.5 Favored 'General case' 0 N--CA 1.481 1.103 0 C-N-CA 123.297 0.639 . . . . 73.109999999999999 110.778 175.129 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 23.0 t -67.83 -35.43 78.58 Favored 'General case' 0 CA--C 1.543 0.681 0 O-C-N 124.147 0.904 . . . . 74.430000000000007 110.229 -178.643 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . -84.26 -63.93 1.62 Allowed Glycine 0 C--N 1.36 1.874 0 CA-C-O 119.274 -0.737 . . . . 65.129999999999995 113.28 -176.363 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 112' ' ' MET . . . . . 0.448 ' O ' ' HB2' ' A' ' 113' ' ' LEU . 2.0 tmm? -95.24 -66.24 0.92 Allowed 'General case' 0 N--CA 1.487 1.393 0 CA-C-N 118.496 1.148 . . . . 72.030000000000001 110.351 179.586 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 113' ' ' LEU . . . . . 0.448 ' HB2' ' O ' ' A' ' 112' ' ' MET . 14.8 tp 164.4 28.17 0.0 OUTLIER 'General case' 0 N--CA 1.505 2.309 0 C-N-CA 125.445 1.498 . . . . 74.329999999999998 110.472 179.269 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 114' ' ' LEU . . . . . 0.758 ' HB3' HG22 ' A' ' 52' ' ' THR . 0.5 OUTLIER 75.26 -6.04 2.05 Favored 'General case' 0 N--CA 1.501 2.12 0 C-N-CA 125.553 1.541 . . . . 72.420000000000002 111.215 -178.569 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 115' ' ' VAL . . . . . . . . . . . . . 22.7 t -107.97 123.94 36.25 Favored Pre-proline 0 CA--C 1.541 0.616 0 N-CA-C 107.167 -1.42 . . . . 72.530000000000001 107.167 178.467 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 60.7 Cg_endo -74.39 102.92 1.61 Allowed 'Trans proline' 0 CA--C 1.554 1.495 0 C-N-CA 121.652 1.568 . . . . 70.150000000000006 111.885 176.562 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 30.2 m-20 -141.35 55.57 1.53 Allowed 'General case' 0 N--CA 1.488 1.456 0 C-N-CA 124.103 0.961 . . . . 75.209999999999994 110.364 177.669 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . 68.9 139.65 0.06 OUTLIER Pre-proline 0 CA--C 1.558 1.256 0 C-N-CA 124.939 1.296 . . . . 55.049999999999997 112.438 179.141 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 119' ' ' PRO . . . . . . . . . . . . . 85.4 Cg_endo -80.26 -171.16 1.17 Allowed 'Trans proline' 0 C--N 1.373 1.819 0 C-N-CA 122.427 2.085 . . . . 71.430000000000007 110.542 167.453 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . -138.75 171.98 23.29 Favored Glycine 0 N--CA 1.467 0.742 0 N-CA-C 111.716 -0.554 . . . . 74.319999999999993 111.716 -178.568 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . -63.26 -34.62 78.07 Favored 'General case' 0 N--CA 1.477 0.912 0 C-N-CA 123.852 0.861 . . . . 74.219999999999999 111.195 177.686 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 122' ' ' SER . . . . . . . . . . . . . 56.2 m . . . . . 0 CA--C 1.554 1.113 0 C-N-CA 124.473 1.109 . . . . 75.510000000000005 108.67 175.651 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 12.4 tpt . . . . . 0 N--CA 1.478 0.971 0 CA-C-O 119.045 -0.502 . . . . 73.140000000000001 111.548 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 46.7 p -55.46 -41.35 72.8 Favored 'General case' 0 N--CA 1.484 1.228 0 C-N-CA 122.754 0.422 . . . . 74.439999999999998 112.075 -175.94 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 14.7 m -58.35 -42.32 86.66 Favored 'General case' 0 N--CA 1.48 1.03 0 C-N-CA 123.299 0.64 . . . . 73.239999999999995 111.121 177.629 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 56.9 m -68.77 -40.62 79.6 Favored 'General case' 0 CA--C 1.544 0.744 0 C-N-CA 123.552 0.741 . . . . 65.349999999999994 111.38 177.908 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 88.4 t -63.46 -40.78 90.31 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.021 0 C-N-CA 123.06 0.544 . . . . 75.299999999999997 110.127 179.943 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . 0.431 ' O ' ' HG3' ' A' ' 10' ' ' ARG . 50.3 mm-40 -71.68 -35.07 70.18 Favored 'General case' 0 N--CA 1.469 0.502 0 O-C-N 123.718 0.636 . . . . 70.329999999999998 111.031 178.599 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 55.4 t80 -67.62 -45.06 76.49 Favored 'General case' 0 CA--C 1.551 1.0 0 C-N-CA 123.031 0.533 . . . . 74.430000000000007 110.529 179.62 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . 0.496 HD13 HG21 ' A' ' 60' ' ' ILE . 90.2 mt -62.97 -40.24 88.25 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.811 0 C-N-CA 123.621 0.768 . . . . 74.400000000000006 109.381 173.677 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 20.9 t-20 -61.79 -33.35 73.95 Favored 'General case' 0 N--CA 1.481 1.117 0 C-N-CA 124.063 0.945 . . . . 73.129999999999995 111.239 177.227 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . 0.609 ' HB3' HG22 ' A' ' 47' ' ' VAL . 64.0 mtt85 -68.59 -40.48 80.48 Favored 'General case' 0 CA--C 1.536 0.442 0 C-N-CA 123.124 0.569 . . . . 73.329999999999998 110.377 175.565 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' TRP . . . . . 0.411 ' CD1' HG13 ' A' ' 64' ' ' VAL . 74.8 m95 -69.84 -32.12 70.35 Favored 'General case' 0 N--CA 1.479 1.011 0 N-CA-C 112.14 0.422 . . . . 75.430000000000007 112.14 174.931 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . 0.409 ' HG3' ' O ' ' A' ' 8' ' ' ILE . 52.9 mt-30 -63.23 -42.02 99.18 Favored 'General case' 0 N--CA 1.472 0.637 0 N-CA-C 108.701 -0.851 . . . . 73.329999999999998 108.701 172.302 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 15.5 tpt180 -63.31 -50.69 69.05 Favored 'General case' 0 CA--C 1.541 0.605 0 CA-C-N 115.174 -0.921 . . . . 63.140000000000001 110.587 -177.091 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' ILE . . . . . 0.421 HD12 HG23 ' A' ' 47' ' ' VAL . 70.2 mt -63.11 -44.06 99.27 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.062 0 C-N-CA 123.456 0.702 . . . . 74.230000000000004 110.653 -179.041 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . 0.583 ' HA ' ' HB ' ' A' ' 71' ' ' THR . . . -61.21 -50.79 71.69 Favored 'General case' 0 N--CA 1.479 0.991 0 C-N-CA 124.073 0.949 . . . . 73.409999999999997 111.964 -179.672 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 97.9 mt -76.61 -35.17 58.25 Favored 'General case' 0 N--CA 1.48 1.057 0 CA-C-N 114.795 -1.093 . . . . 75.310000000000002 111.516 -172.655 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . 0.485 ' O ' ' HG ' ' A' ' 21' ' ' LEU . 45.7 mt -66.43 -47.8 72.06 Favored 'General case' 0 N--CA 1.473 0.707 0 CA-C-O 118.971 -0.537 . . . . 75.010000000000005 109.947 175.9 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 98.2 p -65.67 -30.73 71.47 Favored 'General case' 0 N--CA 1.487 1.421 0 C-N-CA 122.611 0.364 . . . . 75.120000000000005 111.246 179.151 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 19' ' ' GLN . . . . . 0.599 ' HA ' HD21 ' A' ' 74' ' ' ASN . 6.3 tp-100 -59.31 -49.63 77.08 Favored 'General case' 0 C--N 1.354 0.799 0 O-C-N 123.737 0.648 . . . . 74.409999999999997 109.303 171.134 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 44.6 m -62.65 -41.73 99.21 Favored 'General case' 0 CA--C 1.542 0.644 0 CA-C-N 115.233 -0.894 . . . . 75.049999999999997 111.163 178.179 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . 0.485 ' HG ' ' O ' ' A' ' 17' ' ' LEU . 80.2 mt -63.26 -39.83 95.72 Favored 'General case' 0 N--CA 1.478 0.967 0 C-N-CA 123.64 0.776 . . . . 75.0 110.087 -177.421 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . 0.565 ' HA ' HD22 ' A' ' 78' ' ' LEU . 55.6 tp -64.29 -54.77 28.01 Favored 'General case' 0 CA--C 1.539 0.546 0 CA-C-N 115.628 -0.715 . . . . 73.310000000000002 110.224 178.058 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 47.3 mt-10 -54.17 -50.82 66.12 Favored 'General case' 0 N--CA 1.483 1.186 0 C-N-CA 123.862 0.865 . . . . 74.409999999999997 111.279 -178.954 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . 0.428 ' HB3' ' HB2' ' A' ' 29' ' ' GLU . 91.7 mt -63.47 -40.28 96.69 Favored 'General case' 0 N--CA 1.47 0.554 0 CA-C-N 115.012 -0.995 . . . . 74.120000000000005 111.067 -177.363 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -59.91 -40.6 89.37 Favored 'General case' 0 N--CA 1.482 1.161 0 C-N-CA 123.137 0.575 . . . . 74.349999999999994 111.352 176.813 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 86.7 mt-30 -64.42 -35.8 82.08 Favored 'General case' 0 N--CA 1.48 1.067 0 C-N-CA 123.899 0.88 . . . . 73.200000000000003 110.975 175.776 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 57.7 mtt180 -82.35 -6.79 59.49 Favored 'General case' 0 N--CA 1.482 1.134 0 C-N-CA 123.914 0.886 . . . . 74.109999999999999 112.021 179.36 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 84.09 9.77 81.73 Favored Glycine 0 C--N 1.352 1.441 0 N-CA-C 113.587 0.195 . . . . 74.140000000000001 113.587 -179.916 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . 0.428 ' HB2' ' HB3' ' A' ' 24' ' ' LEU . 40.4 mm-40 -85.5 54.28 3.06 Favored 'General case' 0 CA--C 1.546 0.793 0 C-N-CA 124.626 1.17 . . . . 64.129999999999995 111.168 179.629 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 30' ' ' TRP . . . . . 0.477 ' O ' ' HG ' ' A' ' 34' ' ' LEU . 96.0 m95 -64.79 -28.8 69.82 Favored 'General case' 0 N--CA 1.475 0.781 0 C-N-CA 123.402 0.681 . . . . 74.319999999999993 111.797 -176.869 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 11.1 m-20 -59.54 -39.46 84.04 Favored 'General case' 0 N--CA 1.486 1.352 0 C-N-CA 123.23 0.612 . . . . 74.439999999999998 110.439 178.456 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 88.0 mt -67.82 -31.45 71.3 Favored 'General case' 0 CA--C 1.543 0.679 0 CA-C-N 115.255 -0.884 . . . . 74.109999999999999 110.963 179.135 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . 0.437 ' HA ' HD21 ' A' ' 21' ' ' LEU . 9.2 mp -65.44 -43.7 89.62 Favored 'General case' 0 N--CA 1.488 1.45 0 N-CA-C 110.051 -0.351 . . . . 73.420000000000002 110.051 171.627 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . 0.477 ' HG ' ' O ' ' A' ' 30' ' ' TRP . 49.0 mt -66.3 -33.19 75.19 Favored 'General case' 0 N--CA 1.477 0.914 0 O-C-N 123.989 0.806 . . . . 72.109999999999999 111.442 -176.844 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 98.1 mt-30 -74.07 -53.88 9.02 Favored 'General case' 0 N--CA 1.477 0.903 0 C-N-CA 123.414 0.686 . . . . 54.5 110.294 177.04 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 83.5 mm-40 -63.86 -18.1 63.82 Favored 'General case' 0 N--CA 1.484 1.225 0 O-C-N 123.773 0.67 . . . . 73.230000000000004 111.637 178.848 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . 0.545 ' O ' ' HG ' ' A' ' 41' ' ' LEU . 30.3 tt0 -48.97 -60.97 2.32 Favored 'General case' 0 C--N 1.361 1.094 0 C-N-CA 124.523 1.129 . . . . 72.349999999999994 111.523 178.995 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 58.1 t -60.76 -40.59 85.48 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.291 0 O-C-N 123.787 0.679 . . . . 70.230000000000004 111.45 -173.973 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 50.8 m -62.22 -39.75 93.82 Favored 'General case' 0 CA--C 1.545 0.784 0 C-N-CA 123.382 0.673 . . . . 63.43 110.794 175.478 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 37.9 t80 -70.94 -40.15 72.22 Favored 'General case' 0 C--N 1.35 0.598 0 C-N-CA 124.274 1.029 . . . . 71.120000000000005 110.357 -176.976 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . 0.545 ' HG ' ' O ' ' A' ' 37' ' ' GLU . 67.3 mt -61.11 -51.07 70.68 Favored 'General case' 0 C--N 1.355 0.845 0 O-C-N 124.291 0.995 . . . . 73.120000000000005 108.623 178.773 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 50.8 tt0 -56.51 -42.03 77.69 Favored 'General case' 0 CA--C 1.544 0.735 0 CA-C-N 114.659 -1.155 . . . . 74.540000000000006 110.65 178.303 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 43' ' ' SER . . . . . 0.535 ' O ' HG21 ' A' ' 47' ' ' VAL . 68.8 m -61.54 -62.82 1.55 Allowed 'General case' 0 C--N 1.357 0.898 0 C-N-CA 122.959 0.504 . . . . 72.530000000000001 110.968 179.345 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 44' ' ' ILE . . . . . 0.497 HG12 ' HE1' ' A' ' 48' ' ' MET . 13.7 tt -64.02 -35.35 73.26 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.914 0 C-N-CA 123.836 0.854 . . . . 75.310000000000002 111.477 -169.882 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 10.7 mm-40 -65.86 -49.25 68.82 Favored 'General case' 0 C--N 1.348 0.528 0 CA-C-N 115.873 -0.603 . . . . 74.349999999999994 110.317 175.332 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 60.9 m -53.64 -39.94 65.43 Favored 'General case' 0 N--CA 1.484 1.239 0 O-C-N 123.864 0.727 . . . . 74.540000000000006 111.163 177.784 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 47' ' ' VAL . . . . . 0.609 HG22 ' HB3' ' A' ' 10' ' ' ARG . 20.9 t -68.56 -49.09 68.4 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.004 0 C-N-CA 123.104 0.562 . . . . 75.230000000000004 111.575 -178.228 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 48' ' ' MET . . . . . 0.497 ' HE1' HG12 ' A' ' 44' ' ' ILE . 70.3 mtm -75.62 -14.38 60.37 Favored 'General case' 0 N--CA 1.483 1.187 0 C-N-CA 122.507 0.323 . . . . 75.209999999999994 111.761 -177.784 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 47.0 mt-10 -95.98 -11.98 25.71 Favored 'General case' 0 N--CA 1.481 1.089 0 C-N-CA 123.724 0.81 . . . . 75.129999999999995 110.555 171.82 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 14.9 tppt? -87.2 132.94 33.72 Favored 'General case' 0 N--CA 1.472 0.628 0 N-CA-C 108.883 -0.784 . . . . 75.519999999999996 108.883 177.331 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 3.4 tt0 -66.83 131.22 45.45 Favored 'General case' 0 C--O 1.242 0.683 0 N-CA-C 108.961 -0.755 . . . . 74.150000000000006 108.961 174.634 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 22.1 m -69.25 127.09 93.08 Favored Pre-proline 0 CA--C 1.551 0.995 0 O-C-N 123.579 0.55 . . . . 72.420000000000002 109.555 175.905 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_endo -66.32 155.02 71.98 Favored 'Trans proline' 0 C--N 1.377 2.079 0 C-N-CA 122.258 1.972 . . . . 71.129999999999995 112.031 178.97 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 17.4 Cg_exo -67.85 -47.74 1.75 Allowed 'Trans proline' 0 C--N 1.372 1.798 0 C-N-CA 122.941 2.427 . . . . 75.099999999999994 111.653 177.406 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . -63.2 85.0 0.05 OUTLIER Glycine 0 C--N 1.353 1.48 0 O-C-N 124.411 1.07 . . . . 62.350000000000001 113.593 -177.413 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 59.2 mt -133.69 102.12 4.4 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.683 0 C-N-CA 124.764 1.226 . . . . 75.420000000000002 108.399 178.081 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 40.8 p -82.42 -173.62 4.69 Favored 'General case' 0 N--CA 1.471 0.601 0 C-N-CA 123.652 0.781 . . . . 74.209999999999994 110.31 175.192 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 22.0 tpt180 -63.01 -48.82 77.14 Favored 'General case' 0 CA--C 1.54 0.596 0 C-N-CA 123.608 0.763 . . . . 75.219999999999999 110.665 179.711 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 20.3 m -56.89 -43.98 81.86 Favored 'General case' 0 N--CA 1.479 1.017 0 C-N-CA 123.43 0.692 . . . . 74.439999999999998 111.375 179.389 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 60' ' ' ILE . . . . . 0.496 HG21 HD13 ' A' ' 8' ' ' ILE . 69.6 mt -64.08 -42.27 95.09 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.808 0 CA-C-N 115.114 -0.948 . . . . 74.109999999999999 110.328 178.728 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 60.4 tt0 -61.23 -41.27 96.58 Favored 'General case' 0 CA--C 1.546 0.79 0 C-N-CA 124.09 0.956 . . . . 74.540000000000006 111.087 179.729 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 14.1 m-20 -68.27 -43.3 78.11 Favored 'General case' 0 N--CA 1.479 0.986 0 C-N-CA 123.235 0.614 . . . . 73.549999999999997 111.632 179.503 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 63' ' ' MET . . . . . . . . . . . . . 73.3 mtm -65.88 -51.3 59.92 Favored 'General case' 0 N--CA 1.482 1.129 0 O-C-N 123.206 0.316 . . . . 74.140000000000001 111.109 179.864 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 64' ' ' VAL . . . . . 0.491 ' O ' HG13 ' A' ' 68' ' ' ILE . 53.1 t -59.98 -61.12 1.63 Allowed 'Isoleucine or valine' 0 CA--C 1.543 0.703 0 C-N-CA 123.707 0.803 . . . . 73.209999999999994 110.692 -179.522 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -64.67 -32.33 73.94 Favored 'General case' 0 N--CA 1.483 1.181 0 C-N-CA 122.697 0.399 . . . . 60.310000000000002 111.706 -176.708 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -65.94 -38.78 94.51 Favored Glycine 0 C--N 1.349 1.271 0 O-C-N 123.412 0.445 . . . . 74.519999999999996 112.049 177.798 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 67' ' ' TYR . . . . . 0.42 ' HB3' ' HB3' ' A' ' 15' ' ' ALA . 8.1 m-85 -74.9 -34.39 62.16 Favored 'General case' 0 N--CA 1.469 0.524 0 C-N-CA 123.439 0.696 . . . . 75.420000000000002 111.971 177.973 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 68' ' ' ILE . . . . . 0.534 ' O ' ' HG ' ' A' ' 72' ' ' LEU . 48.1 mt -61.93 -52.69 57.54 Favored 'Isoleucine or valine' 0 C--N 1.36 1.061 0 N-CA-C 108.353 -0.98 . . . . 72.340000000000003 108.353 174.369 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 69' ' ' LYS . . . . . 0.581 ' HB2' ' HE2' ' A' ' 106' ' ' TYR . 12.1 tmtt? -53.83 -47.76 70.58 Favored 'General case' 0 N--CA 1.479 1.017 0 C-N-CA 124.542 1.137 . . . . 75.129999999999995 109.772 -179.408 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 58.0 tt0 -55.49 -54.39 44.43 Favored 'General case' 0 C--N 1.347 0.485 0 CA-C-N 114.951 -1.022 . . . . 62.340000000000003 111.974 179.626 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 71' ' ' THR . . . . . 0.583 ' HB ' ' HA ' ' A' ' 15' ' ' ALA . 10.1 t -71.48 -27.09 62.99 Favored 'General case' 0 C--O 1.251 1.169 0 CA-C-N 116.22 -0.445 . . . . 74.209999999999994 110.891 -171.816 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 72' ' ' LEU . . . . . 0.534 ' HG ' ' O ' ' A' ' 68' ' ' ILE . 43.0 mt -62.07 -55.66 26.75 Favored 'General case' 0 C--N 1.358 0.955 0 O-C-N 123.789 0.681 . . . . 74.239999999999995 109.876 173.622 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -56.29 -52.56 64.06 Favored 'General case' 0 N--CA 1.489 1.487 0 O-C-N 124.253 0.971 . . . . 74.319999999999993 111.982 -179.787 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 74' ' ' ASN . . . . . 0.599 HD21 ' HA ' ' A' ' 19' ' ' GLN . 2.7 m-20 -58.74 -55.23 37.72 Favored 'General case' 0 C--O 1.248 0.992 0 O-C-N 124.036 0.835 . . . . 74.219999999999999 111.528 -174.786 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . 0.547 ' O ' ' HG2' ' A' ' 79' ' ' LYS . 14.5 tt0 -76.85 -15.4 59.72 Favored 'General case' 0 CA--C 1.545 0.763 0 CA-C-O 118.778 -0.63 . . . . 75.010000000000005 111.047 -177.107 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 76' ' ' GLN . . . . . 0.405 ' HA ' ' HG2' ' A' ' 79' ' ' LYS . 9.9 tt0 -69.46 -38.57 77.83 Favored 'General case' 0 N--CA 1.487 1.424 0 CA-C-N 118.464 0.575 . . . . 71.319999999999993 110.243 171.43 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 96.4 mt -60.62 -40.57 92.39 Favored 'General case' 0 N--CA 1.472 0.67 0 CA-C-N 115.592 -0.731 . . . . 73.299999999999997 109.087 171.031 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . 0.565 HD22 ' HA ' ' A' ' 22' ' ' LEU . 88.3 mt -63.76 -36.03 82.55 Favored 'General case' 0 CA--C 1.55 0.95 0 CA-C-O 118.44 -0.79 . . . . 71.120000000000005 112.262 171.634 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 79' ' ' LYS . . . . . 0.626 ' HE2' ' HB2' ' A' ' 99' ' ' GLN . 48.5 mmtm -59.34 -42.01 90.52 Favored 'General case' 0 N--CA 1.5 2.029 0 CA-C-N 119.032 0.833 . . . . 75.019999999999996 110.093 178.191 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -69.0 -43.08 74.84 Favored Glycine 0 C--N 1.349 1.297 0 CA-C-N 114.596 -1.184 . . . . 60.140000000000001 112.995 177.566 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -72.29 -33.04 67.12 Favored 'General case' 0 CA--C 1.555 1.169 0 C-N-CA 123.345 0.658 . . . . 73.510000000000005 110.436 -174.927 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 80.3 mt -73.71 -38.1 64.94 Favored 'General case' 0 N--CA 1.477 0.894 0 C-N-CA 123.35 0.66 . . . . 72.340000000000003 111.053 -178.516 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -159.93 -75.27 0.07 Allowed 'General case' 0 CA--C 1.544 0.741 0 O-C-N 123.367 0.417 . . . . 72.420000000000002 110.092 -178.811 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 9.4 tt0 -151.2 -70.0 0.17 Allowed 'General case' 0 N--CA 1.48 1.042 0 N-CA-C 110.327 -0.249 . . . . 64.230000000000004 110.327 -171.327 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 85' ' ' ARG . . . . . . . . . . . . . 9.6 ttm180 -167.38 146.85 5.14 Favored 'General case' 0 N--CA 1.479 0.996 0 N-CA-C 109.442 -0.577 . . . . 72.319999999999993 109.442 -178.447 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 86' ' ' LEU . . . . . 0.453 ' HB3' ' HB3' ' A' ' 96' ' ' SER . 91.8 mt 63.27 4.91 1.79 Allowed 'General case' 0 N--CA 1.488 1.463 0 C-N-CA 124.492 1.117 . . . . 74.530000000000001 112.247 -174.358 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 37.1 t70 -87.47 92.1 8.97 Favored 'General case' 0 C--N 1.353 0.744 0 CA-C-O 121.643 0.735 . . . . 73.349999999999994 109.985 -175.998 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 88' ' ' GLU . . . . . 0.566 ' HB3' ' HE3' ' A' ' 79' ' ' LYS . 4.3 pt-20 -89.19 156.63 18.66 Favored 'General case' 0 N--CA 1.482 1.162 0 C-N-CA 125.385 1.474 . . . . 73.129999999999995 110.798 -176.047 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 95.0 mt -50.66 -40.87 54.67 Favored 'General case' 0 N--CA 1.486 1.344 0 O-C-N 124.071 0.857 . . . . 74.450000000000003 111.372 -178.85 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 45.2 t -147.48 130.96 16.71 Favored 'General case' 0 C--O 1.241 0.627 0 CA-C-N 115.488 -0.778 . . . . 61.420000000000002 109.165 173.078 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 19.9 m -66.3 112.78 4.16 Favored 'General case' 0 C--O 1.24 0.592 0 O-C-N 124.269 0.981 . . . . 71.120000000000005 109.595 176.321 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 92' ' ' LEU . . . . . 0.513 ' HB2' ' HB ' ' A' ' 97' ' ' THR . 92.5 mt -60.43 -64.14 1.06 Allowed 'General case' 0 CA--C 1.543 0.697 0 O-C-N 123.686 0.616 . . . . 75.25 111.294 -175.654 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 39.0 mt -117.4 76.67 0.49 Allowed 'Isoleucine or valine' 0 CA--C 1.547 0.848 0 N-CA-C 109.042 -0.725 . . . . 74.329999999999998 109.042 -178.07 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 76.5 -77.03 1.45 Allowed Glycine 0 C--N 1.35 1.359 0 CA-C-N 115.388 -0.824 . . . . 74.049999999999997 113.604 174.272 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 2.9 mp0 -89.7 -173.13 3.82 Favored 'General case' 0 N--CA 1.478 0.952 0 C-N-CA 124.186 0.994 . . . . 75.040000000000006 110.364 178.71 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 96' ' ' SER . . . . . 0.453 ' HB3' ' HB3' ' A' ' 86' ' ' LEU . 58.8 m -63.27 95.8 0.1 Allowed 'General case' 0 CA--C 1.544 0.714 0 CA-C-N 115.063 -0.971 . . . . 61.140000000000001 110.367 174.618 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 97' ' ' THR . . . . . 0.513 ' HB ' ' HB2' ' A' ' 92' ' ' LEU . 87.3 m -100.37 -45.12 5.69 Favored 'General case' 0 C--O 1.215 -0.736 0 CA-C-N 114.796 -1.093 . . . . 73.239999999999995 111.272 -173.282 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 2.4 tmt_? -48.78 -58.24 5.11 Favored 'General case' 0 N--CA 1.482 1.165 0 C-N-CA 124.651 1.18 . . . . 73.430000000000007 112.077 -167.703 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 99' ' ' GLN . . . . . 0.626 ' HB2' ' HE2' ' A' ' 79' ' ' LYS . 48.3 tt0 -71.97 -43.81 64.57 Favored 'General case' 0 N--CA 1.472 0.659 0 N-CA-C 110.063 -0.347 . . . . 73.140000000000001 110.063 -169.729 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 29.4 ttpp -68.14 -47.38 68.25 Favored 'General case' 0 CA--C 1.546 0.802 0 C-N-CA 124.314 1.046 . . . . 73.129999999999995 111.192 -175.075 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 38.6 t -68.06 -42.6 80.22 Favored 'General case' 0 N--CA 1.472 0.671 0 C-N-CA 124.186 0.994 . . . . 71.230000000000004 110.729 -177.538 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 7.1 tp -74.56 -31.45 62.09 Favored 'General case' 0 CA--C 1.549 0.922 0 O-C-N 123.329 0.393 . . . . 75.140000000000001 111.187 -176.718 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 9.8 t30 -66.93 -41.89 86.25 Favored 'General case' 0 N--CA 1.48 1.059 0 C-N-CA 123.55 0.74 . . . . 61.109999999999999 109.696 173.938 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 27.7 t-20 -71.58 -28.88 64.13 Favored 'General case' 0 CA--C 1.54 0.568 0 CA-C-N 115.374 -0.83 . . . . 72.150000000000006 110.434 177.353 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -67.25 -38.79 85.74 Favored 'General case' 0 N--CA 1.48 1.037 0 C-N-CA 123.233 0.613 . . . . 74.540000000000006 110.454 176.627 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 106' ' ' TYR . . . . . 0.581 ' HE2' ' HB2' ' A' ' 69' ' ' LYS . 1.0 OUTLIER -61.21 -47.49 85.88 Favored 'General case' 0 C--N 1.355 0.814 0 N-CA-C 108.816 -0.809 . . . . 74.409999999999997 108.816 171.216 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -57.87 -40.69 93.47 Favored Glycine 0 C--N 1.351 1.386 0 O-C-N 123.732 0.645 . . . . 63.520000000000003 112.781 179.446 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 2.5 mmp_? -68.14 -34.17 75.84 Favored 'General case' 0 C--N 1.345 0.377 0 C-N-CA 123.508 0.723 . . . . 73.310000000000002 110.036 177.063 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 109' ' ' LEU . . . . . 0.456 ' HA ' ' N ' ' A' ' 114' ' ' LEU . 53.1 tp -68.37 -32.64 72.87 Favored 'General case' 0 N--CA 1.482 1.167 0 C-N-CA 123.174 0.589 . . . . 70.120000000000005 111.114 177.659 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 33.5 t -72.45 -42.49 64.95 Favored 'General case' 0 CA--C 1.541 0.598 0 CA-C-N 115.66 -0.7 . . . . 73.230000000000004 109.803 177.747 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . -88.71 -61.73 1.42 Allowed Glycine 0 C--N 1.355 1.611 0 C-N-CA 121.144 -0.551 . . . . 72.519999999999996 114.127 -175.773 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 112' ' ' MET . . . . . . . . . . . . . 2.2 mmm -93.72 -66.65 0.91 Allowed 'General case' 0 N--CA 1.486 1.338 0 CA-C-N 117.927 0.863 . . . . 74.530000000000001 112.904 -176.245 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 6.6 mt 157.27 44.77 0.0 OUTLIER 'General case' 0 N--CA 1.503 2.183 0 C-N-CA 126.364 1.866 . . . . 75.230000000000004 108.6 -174.191 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 114' ' ' LEU . . . . . 0.456 ' N ' ' HA ' ' A' ' 109' ' ' LEU . 1.0 OUTLIER 76.03 -13.96 0.84 Allowed 'General case' 0 N--CA 1.503 2.194 0 C-N-CA 125.387 1.475 . . . . 74.099999999999994 111.788 174.703 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 115' ' ' VAL . . . . . 0.689 HG12 ' HA ' ' A' ' 119' ' ' PRO . 19.9 m -88.39 157.27 50.43 Favored Pre-proline 0 CA--C 1.548 0.9 0 C-N-CA 124.39 1.076 . . . . 75.420000000000002 110.266 -178.395 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 76.7 Cg_exo -53.02 -42.28 65.69 Favored 'Trans proline' 0 C--N 1.378 2.083 0 C-N-CA 123.242 2.628 . . . . 75.450000000000003 113.221 178.374 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 12.7 p-10 -166.46 -35.85 0.03 OUTLIER 'General case' 0 N--CA 1.484 1.268 0 C-N-CA 123.035 0.534 . . . . 72.340000000000003 111.218 -176.915 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -123.02 135.66 26.1 Favored Pre-proline 0 N--CA 1.477 0.918 0 C-N-CA 123.331 0.652 . . . . 73.140000000000001 109.856 -178.349 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 119' ' ' PRO . . . . . 0.689 ' HA ' HG12 ' A' ' 115' ' ' VAL . 91.9 Cg_endo -81.67 55.34 5.48 Favored 'Trans proline' 0 C--N 1.379 2.152 0 C-N-CA 123.43 2.753 . . . . 75.239999999999995 111.324 176.815 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . 101.1 -133.64 11.4 Favored Glycine 0 C--N 1.343 0.924 0 CA-C-N 114.024 -1.444 . . . . 74.230000000000004 111.263 -172.577 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . 62.81 13.75 6.77 Favored 'General case' 0 N--CA 1.488 1.472 0 C-N-CA 124.681 1.192 . . . . 60.020000000000003 112.434 -179.988 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 122' ' ' SER . . . . . . . . . . . . . 20.3 m . . . . . 0 C--O 1.252 1.207 0 C-N-CA 124.269 1.028 . . . . 74.230000000000004 108.961 -175.862 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 1' ' ' MET . . . . . 0.503 ' HG3' HG23 ' A' ' 5' ' ' VAL . 21.0 ptt? . . . . . 0 N--CA 1.486 1.339 0 CA-C-O 120.963 0.411 . . . . 71.400000000000006 110.5 . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 43.8 m -54.98 -61.32 2.39 Favored 'General case' 0 N--CA 1.482 1.141 0 C-N-CA 123.571 0.748 . . . . 72.219999999999999 112.344 -172.107 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 17.0 m -63.78 -28.66 70.02 Favored 'General case' 0 N--CA 1.478 0.962 0 C-N-CA 123.529 0.732 . . . . 74.040000000000006 112.341 -174.726 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 23.6 m -77.96 -36.56 48.98 Favored 'General case' 0 CA--C 1.549 0.934 0 C-N-CA 123.421 0.688 . . . . 74.109999999999999 111.569 -179.665 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . 0.503 HG23 ' HG3' ' A' ' 1' ' ' MET . 51.5 t -71.08 -38.62 72.22 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.107 0 C-N-CA 122.851 0.46 . . . . 75.219999999999999 110.143 175.76 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . 0.537 ' HB3' ' NH1' ' A' ' 10' ' ' ARG . 45.6 mm-40 -60.83 -45.38 94.68 Favored 'General case' 0 N--CA 1.478 0.931 0 O-C-N 123.639 0.587 . . . . 74.400000000000006 110.128 173.48 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 81.8 t80 -53.09 -58.75 5.94 Favored 'General case' 0 CA--C 1.549 0.934 0 C-N-CA 125.242 1.417 . . . . 73.200000000000003 111.534 176.646 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . 0.445 ' O ' ' HG3' ' A' ' 12' ' ' GLN . 70.6 mt -61.1 -45.78 97.91 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.015 0 O-C-N 123.766 0.666 . . . . 75.349999999999994 110.559 -178.78 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 4.3 t-20 -64.89 -29.54 70.5 Favored 'General case' 0 N--CA 1.482 1.132 0 C-N-CA 123.539 0.736 . . . . 74.010000000000005 111.379 -175.814 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . 0.6 ' HB3' HG21 ' A' ' 47' ' ' VAL . 68.3 mtt85 -78.55 -32.17 47.74 Favored 'General case' 0 CA--C 1.541 0.627 0 C-N-CA 122.986 0.514 . . . . 73.120000000000005 111.214 176.571 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' TRP . . . . . . . . . . . . . 85.5 m95 -71.01 -29.92 66.0 Favored 'General case' 0 N--CA 1.487 1.399 0 CA-C-N 117.53 0.15 . . . . 75.299999999999997 111.007 169.987 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . 0.562 ' HG2' ' CE2' ' A' ' 67' ' ' TYR . 42.9 mt-30 -63.61 -46.81 84.05 Favored 'General case' 0 C--N 1.357 0.928 0 N-CA-C 108.329 -0.989 . . . . 74.299999999999997 108.329 170.78 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 11.9 tpt180 -55.77 -49.45 73.12 Favored 'General case' 0 CA--C 1.544 0.73 0 O-C-N 124.375 1.047 . . . . 75.329999999999998 111.513 -179.118 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 54.1 mt -63.69 -45.07 98.41 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.292 0 O-C-N 123.271 0.357 . . . . 73.409999999999997 110.301 179.25 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . 0.617 ' HA ' ' HB ' ' A' ' 71' ' ' THR . . . -56.46 -45.45 80.87 Favored 'General case' 0 N--CA 1.485 1.321 0 C-N-CA 123.959 0.904 . . . . 64.329999999999998 111.664 178.572 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 95.9 mt -79.38 -35.75 40.28 Favored 'General case' 0 N--CA 1.478 0.933 0 CA-C-N 114.562 -1.199 . . . . 72.340000000000003 111.233 -172.352 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . 0.464 ' O ' ' HG ' ' A' ' 21' ' ' LEU . 45.6 mt -66.21 -51.84 53.74 Favored 'General case' 0 N--CA 1.476 0.849 0 O-C-N 123.655 0.597 . . . . 74.519999999999996 109.774 178.518 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 88.4 p -62.21 -38.47 89.3 Favored 'General case' 0 N--CA 1.479 0.981 0 C-N-CA 123.229 0.612 . . . . 72.120000000000005 111.031 179.457 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 6.7 tp-100 -58.61 -48.97 79.2 Favored 'General case' 0 C--N 1.356 0.867 0 O-C-N 123.873 0.733 . . . . 74.420000000000002 110.858 174.311 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 20' ' ' SER . . . . . 0.405 ' O ' ' HG ' ' A' ' 24' ' ' LEU . 69.2 m -61.09 -46.6 89.98 Favored 'General case' 0 C--O 1.213 -0.851 0 O-C-N 124.053 0.846 . . . . 61.439999999999998 110.159 178.609 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . 0.464 ' HG ' ' O ' ' A' ' 17' ' ' LEU . 68.5 mt -68.44 -27.53 66.26 Favored 'General case' 0 CA--C 1.537 0.471 0 C-N-CA 123.328 0.651 . . . . 73.040000000000006 111.125 -175.469 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . 0.675 ' HA ' HD23 ' A' ' 78' ' ' LEU . 46.4 tp -71.67 -48.36 48.07 Favored 'General case' 0 N--CA 1.477 0.875 0 N-CA-C 109.372 -0.603 . . . . 74.200000000000003 109.372 176.639 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . 0.428 ' HB3' ' NH1' ' A' ' 27' ' ' ARG . 45.1 mt-10 -54.51 -55.14 32.19 Favored 'General case' 0 N--CA 1.479 0.984 0 O-C-N 124.3 1.0 . . . . 65.120000000000005 110.365 175.656 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . 0.405 ' HG ' ' O ' ' A' ' 20' ' ' SER . 92.5 mt -61.13 -45.7 93.58 Favored 'General case' 0 CA--C 1.541 0.632 0 CA-C-N 114.683 -1.144 . . . . 74.150000000000006 111.356 -176.445 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . 0.471 ' HB1' HD21 ' A' ' 33' ' ' LEU . . . -59.62 -46.65 88.36 Favored 'General case' 0 N--CA 1.482 1.142 0 C-N-CA 122.969 0.507 . . . . 53.229999999999997 111.609 -178.94 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 95.1 mt-30 -72.4 -23.04 61.04 Favored 'General case' 0 CA--C 1.549 0.905 0 CA-C-N 115.589 -0.732 . . . . 72.329999999999998 111.551 -179.174 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . 0.428 ' NH1' ' HB3' ' A' ' 23' ' ' GLU . 88.9 mtt180 -88.63 4.85 45.59 Favored 'General case' 0 N--CA 1.487 1.387 0 C-N-CA 123.537 0.735 . . . . 74.209999999999994 111.776 174.304 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 77.76 9.18 87.07 Favored Glycine 0 C--N 1.352 1.466 0 N-CA-C 114.122 0.409 . . . . 63.109999999999999 114.122 177.117 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . 0.429 ' HB3' HD13 ' A' ' 32' ' ' LEU . 18.1 mm-40 -86.04 49.65 1.82 Allowed 'General case' 0 CA--C 1.556 1.18 0 C-N-CA 124.296 1.038 . . . . 74.120000000000005 110.259 178.287 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 30' ' ' TRP . . . . . 0.467 ' HA ' HD13 ' A' ' 33' ' ' LEU . 74.8 m95 -62.5 -30.47 71.3 Favored 'General case' 0 N--CA 1.485 1.297 0 C-N-CA 123.376 0.67 . . . . 75.120000000000005 111.027 -176.406 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 17.2 m-20 -56.27 -44.72 80.01 Favored 'General case' 0 N--CA 1.472 0.657 0 C-N-CA 123.781 0.833 . . . . 71.329999999999998 111.019 176.225 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . 0.429 HD13 ' HB3' ' A' ' 29' ' ' GLU . 96.2 mt -64.21 -30.1 71.17 Favored 'General case' 0 CA--C 1.552 1.033 0 CA-C-N 115.755 -0.657 . . . . 72.109999999999999 110.927 -179.912 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . 0.471 HD21 ' HB1' ' A' ' 25' ' ' ALA . 8.4 mp -66.75 -41.93 86.99 Favored 'General case' 0 N--CA 1.491 1.584 0 C-N-CA 122.536 0.335 . . . . 74.25 110.574 171.389 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 71.8 mt -59.61 -45.43 91.97 Favored 'General case' 0 N--CA 1.484 1.241 0 C-N-CA 123.106 0.563 . . . . 74.400000000000006 111.456 -179.217 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 10.4 mp0 -71.22 -28.16 64.0 Favored 'General case' 0 N--CA 1.483 1.213 0 C-N-CA 123.188 0.595 . . . . 71.329999999999998 111.875 177.466 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 86.3 mm-40 -88.88 -11.72 43.81 Favored 'General case' 0 N--CA 1.485 1.311 0 N-CA-C 112.907 0.706 . . . . 71.140000000000001 112.907 179.027 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . 0.44 ' O ' ' HG ' ' A' ' 41' ' ' LEU . 38.5 tt0 -47.52 -59.66 3.08 Favored 'General case' 0 N--CA 1.481 1.118 0 C-N-CA 124.109 0.964 . . . . 72.439999999999998 112.394 -178.696 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 73.9 t -57.52 -41.06 78.1 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.28 0 C-N-CA 123.255 0.622 . . . . 74.540000000000006 111.375 -179.365 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 42.9 m -61.98 -43.74 98.19 Favored 'General case' 0 CA--C 1.543 0.71 0 C-N-CA 123.36 0.664 . . . . 71.030000000000001 111.431 179.351 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 47.6 t80 -69.34 -48.5 61.2 Favored 'General case' 0 N--CA 1.468 0.469 0 CA-C-N 115.567 -0.742 . . . . 72.129999999999995 110.471 -176.476 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . 0.455 HD23 HD22 ' A' ' 92' ' ' LEU . 46.5 mt -66.08 -44.51 84.25 Favored 'General case' 0 CA--C 1.538 0.502 0 O-C-N 124.485 1.116 . . . . 65.010000000000005 110.408 -176.371 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 48.3 tt0 -58.95 -49.95 75.89 Favored 'General case' 0 N--CA 1.473 0.681 0 O-C-N 123.695 0.622 . . . . 73.310000000000002 110.132 178.576 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 43' ' ' SER . . . . . 0.54 ' O ' HG23 ' A' ' 47' ' ' VAL . 69.5 m -58.93 -55.29 37.02 Favored 'General case' 0 C--N 1.354 0.761 0 O-C-N 123.803 0.689 . . . . 64.310000000000002 111.808 -178.989 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 44' ' ' ILE . . . . . 0.645 HG12 ' HE2' ' A' ' 48' ' ' MET . 10.1 tt -60.38 -42.44 90.9 Favored 'Isoleucine or valine' 0 CA--C 1.557 1.236 0 C-N-CA 122.854 0.461 . . . . 74.329999999999998 111.395 -173.994 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . 0.429 ' O ' ' HG3' ' A' ' 49' ' ' GLU . 8.6 mm-40 -61.57 -49.25 77.42 Favored 'General case' 0 N--CA 1.48 1.066 0 C-N-CA 123.056 0.542 . . . . 72.209999999999994 111.035 176.224 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 46' ' ' THR . . . . . 0.535 ' O ' ' HD3' ' A' ' 50' ' ' LYS . 95.9 m -57.53 -43.12 84.08 Favored 'General case' 0 N--CA 1.479 1.003 0 C-N-CA 123.802 0.841 . . . . 65.129999999999995 111.825 -177.141 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 47' ' ' VAL . . . . . 0.6 HG21 ' HB3' ' A' ' 10' ' ' ARG . 30.5 t -67.82 -42.56 86.07 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.717 0 C-N-CA 122.868 0.467 . . . . 73.340000000000003 110.163 -179.543 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 48' ' ' MET . . . . . 0.645 ' HE2' HG12 ' A' ' 44' ' ' ILE . 79.1 mtm -70.58 -15.57 62.77 Favored 'General case' 0 N--CA 1.48 1.074 0 N-CA-C 112.286 0.476 . . . . 75.140000000000001 112.286 177.809 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . 0.429 ' HG3' ' O ' ' A' ' 45' ' ' GLU . 62.5 mt-10 -73.29 -35.99 66.22 Favored 'General case' 0 N--CA 1.488 1.463 0 CA-C-N 118.152 0.433 . . . . 63.299999999999997 111.436 171.664 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . 0.535 ' HD3' ' O ' ' A' ' 46' ' ' THR . 10.8 mptt -78.32 135.86 37.59 Favored 'General case' 0 N--CA 1.483 1.2 0 C-N-CA 123.162 0.585 . . . . 74.310000000000002 111.192 -170.552 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 8.0 tt0 -69.15 148.29 50.13 Favored 'General case' 0 N--CA 1.474 0.747 0 C-N-CA 124.276 1.03 . . . . 75.430000000000007 110.791 177.632 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 25.1 m -65.7 127.03 92.75 Favored Pre-proline 0 CA--C 1.555 1.137 0 C-N-CA 123.893 0.877 . . . . 73.430000000000007 110.643 178.296 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 15.3 Cg_exo -69.84 151.32 68.56 Favored 'Trans proline' 0 C--N 1.38 2.235 0 C-N-CA 121.912 1.741 . . . . 74.319999999999993 111.372 173.01 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 41.7 Cg_endo -67.81 -44.12 4.5 Favored 'Trans proline' 0 C--N 1.372 1.774 0 C-N-CA 122.999 2.466 . . . . 74.5 112.035 173.832 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . -76.68 66.86 2.68 Favored Glycine 0 C--N 1.352 1.427 0 CA-C-N 116.029 -0.532 . . . . 75.219999999999999 113.645 -178.349 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 56' ' ' ILE . . . . . 0.413 HG21 HG23 ' A' ' 60' ' ' ILE . 58.2 mt -110.0 106.45 20.75 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.653 0 N-CA-C 107.41 -1.329 . . . . 73.219999999999999 107.41 170.107 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 31.2 p -75.08 178.8 5.41 Favored 'General case' 0 N--CA 1.473 0.723 0 C-N-CA 122.911 0.484 . . . . 73.349999999999994 110.244 -179.314 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 40.8 tpt85 -64.08 -46.53 83.88 Favored 'General case' 0 N--CA 1.471 0.606 0 C-N-CA 123.273 0.629 . . . . 73.030000000000001 109.961 -179.964 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 31.8 m -63.01 -40.57 98.17 Favored 'General case' 0 CA--C 1.547 0.827 0 CA-C-N 115.596 -0.729 . . . . 71.040000000000006 111.34 178.264 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 60' ' ' ILE . . . . . 0.413 HG23 HG21 ' A' ' 56' ' ' ILE . 74.8 mt -63.16 -41.41 92.72 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.163 0 C-N-CA 122.962 0.505 . . . . 61.240000000000002 110.608 176.064 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 61.1 tt0 -59.82 -42.65 93.99 Favored 'General case' 0 N--CA 1.476 0.859 0 C-N-CA 123.641 0.776 . . . . 73.299999999999997 110.429 179.493 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 50.0 m-20 -68.23 -45.65 72.7 Favored 'General case' 0 N--CA 1.48 1.025 0 O-C-N 123.563 0.54 . . . . 75.019999999999996 112.227 178.374 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 63' ' ' MET . . . . . . . . . . . . . 65.4 mtm -64.24 -49.93 69.99 Favored 'General case' 0 N--CA 1.486 1.337 0 C-N-CA 122.331 0.253 . . . . 74.519999999999996 110.876 -177.281 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 64' ' ' VAL . . . . . 0.492 ' O ' HG13 ' A' ' 68' ' ' ILE . 82.1 t -60.46 -54.99 27.5 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.815 0 O-C-N 124.171 0.919 . . . . 70.239999999999995 110.945 178.238 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -65.99 -28.8 69.15 Favored 'General case' 0 N--CA 1.494 1.765 0 CA-C-N 118.492 0.587 . . . . 74.5 112.083 -178.817 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -69.23 -38.86 82.63 Favored Glycine 0 C--N 1.343 0.966 0 N-CA-C 111.386 -0.685 . . . . 72.450000000000003 111.386 176.407 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 67' ' ' TYR . . . . . 0.562 ' CE2' ' HG2' ' A' ' 12' ' ' GLN . 10.8 m-85 -71.0 -36.01 72.29 Favored 'General case' 0 N--CA 1.467 0.413 0 C-N-CA 123.605 0.762 . . . . 65.439999999999998 111.134 175.059 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 68' ' ' ILE . . . . . 0.544 ' O ' ' HG ' ' A' ' 72' ' ' LEU . 60.8 mt -63.18 -48.54 87.14 Favored 'Isoleucine or valine' 0 C--N 1.36 1.042 0 N-CA-C 108.649 -0.871 . . . . 73.200000000000003 108.649 176.22 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 69' ' ' LYS . . . . . 0.609 ' HB2' ' HE2' ' A' ' 106' ' ' TYR . 0.7 OUTLIER -57.67 -48.22 80.12 Favored 'General case' 0 C--N 1.356 0.861 0 C-N-CA 123.58 0.752 . . . . 75.349999999999994 110.297 -179.06 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 59.7 tt0 -60.22 -45.7 92.32 Favored 'General case' 0 C--N 1.347 0.489 0 O-C-N 124.491 1.119 . . . . 70.120000000000005 110.979 -179.026 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 71' ' ' THR . . . . . 0.617 ' HB ' ' HA ' ' A' ' 15' ' ' ALA . 15.1 t -77.9 -22.97 48.87 Favored 'General case' 0 C--N 1.354 0.779 0 CA-C-O 119.329 -0.367 . . . . 74.120000000000005 110.257 -175.554 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 72' ' ' LEU . . . . . 0.544 ' HG ' ' O ' ' A' ' 68' ' ' ILE . 28.6 mt -63.81 -50.94 66.97 Favored 'General case' 0 C--N 1.359 0.986 0 N-CA-C 108.524 -0.917 . . . . 74.340000000000003 108.524 171.831 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 73' ' ' ASP . . . . . 0.463 ' O ' ' HG ' ' A' ' 77' ' ' LEU . 60.6 m-20 -62.4 -53.75 50.42 Favored 'General case' 0 N--CA 1.476 0.842 0 O-C-N 124.363 1.039 . . . . 72.319999999999993 111.264 -178.349 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 74' ' ' ASN . . . . . 0.467 ' HA ' HD21 ' A' ' 22' ' ' LEU . 74.7 m-20 -54.32 -53.93 47.25 Favored 'General case' 0 N--CA 1.487 1.403 0 C-N-CA 123.647 0.779 . . . . 74.349999999999994 110.825 -178.904 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . 0.554 ' HG3' ' HZ3' ' A' ' 79' ' ' LYS . 43.1 tt0 -66.47 -31.03 71.51 Favored 'General case' 0 CA--C 1.549 0.942 0 C-N-CA 123.802 0.841 . . . . 70.150000000000006 111.548 -178.46 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 76' ' ' GLN . . . . . 0.468 ' HB2' ' O ' ' A' ' 72' ' ' LEU . 8.1 tt0 -74.86 -36.36 62.32 Favored 'General case' 0 N--CA 1.482 1.155 0 N-CA-C 109.906 -0.405 . . . . 75.230000000000004 109.906 -178.597 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . 0.463 ' HG ' ' O ' ' A' ' 73' ' ' ASP . 89.5 mt -67.38 -40.7 85.7 Favored 'General case' 0 C--N 1.351 0.654 0 O-C-N 123.84 0.712 . . . . 73.400000000000006 109.347 176.602 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . 0.675 HD23 ' HA ' ' A' ' 22' ' ' LEU . 73.0 mt -63.82 -62.85 1.38 Allowed 'General case' 0 N--CA 1.482 1.131 0 C-N-CA 123.915 0.886 . . . . 72.129999999999995 112.242 177.739 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 79' ' ' LYS . . . . . 0.554 ' HZ3' ' HG3' ' A' ' 75' ' ' GLU . 1.0 OUTLIER -66.43 -32.89 74.54 Favored 'General case' 0 N--CA 1.476 0.873 0 C-N-CA 123.558 0.743 . . . . 72.319999999999993 110.479 -174.442 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -65.85 -40.68 95.65 Favored Glycine 0 C--N 1.349 1.262 0 CA-C-N 115.832 -0.622 . . . . 70.129999999999995 112.353 173.843 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . 0.419 ' HB2' ' O ' ' A' ' 77' ' ' LEU . 6.0 tt -62.13 -40.22 95.18 Favored 'General case' 0 N--CA 1.487 1.377 0 C-N-CA 124.217 1.007 . . . . 74.409999999999997 109.612 175.743 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 82' ' ' LEU . . . . . 0.413 ' HG ' ' O ' ' A' ' 78' ' ' LEU . 99.1 mt -58.1 -52.8 64.03 Favored 'General case' 0 C--N 1.358 0.96 0 O-C-N 124.07 0.856 . . . . 72.420000000000002 110.11 -179.391 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 21.5 tp60 -169.67 -45.76 0.02 OUTLIER 'General case' 0 N--CA 1.48 1.045 0 O-C-N 123.844 0.715 . . . . 73.319999999999993 112.08 176.275 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -148.37 147.73 29.56 Favored 'General case' 0 N--CA 1.486 1.345 0 N-CA-C 109.403 -0.592 . . . . 55.240000000000002 109.403 -170.007 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 85' ' ' ARG . . . . . . . . . . . . . 19.6 ttm-85 -48.93 -51.82 28.07 Favored 'General case' 0 N--CA 1.485 1.314 0 C-N-CA 124.282 1.033 . . . . 73.310000000000002 111.969 179.335 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 86' ' ' LEU . . . . . 0.422 ' HB3' ' HA ' ' A' ' 96' ' ' SER . 75.0 mt -83.46 -0.31 49.52 Favored 'General case' 0 CA--C 1.552 1.031 0 CA-C-N 114.927 -1.033 . . . . 74.010000000000005 112.548 -172.248 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 26.6 t70 -67.21 172.69 4.46 Favored 'General case' 0 N--CA 1.49 1.563 0 C-N-CA 124.385 1.074 . . . . 52.299999999999997 110.603 177.302 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 13.7 tp10 -153.13 157.1 39.85 Favored 'General case' 0 CA--C 1.549 0.906 0 C-N-CA 122.989 0.516 . . . . 70.129999999999995 110.6 -174.888 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . 0.449 ' HG ' ' HE2' ' A' ' 79' ' ' LYS . 92.7 mt -61.27 -51.2 69.92 Favored 'General case' 0 N--CA 1.476 0.858 0 C-N-CA 124.849 1.26 . . . . 74.299999999999997 111.318 175.194 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 18.4 t -154.84 -164.83 1.89 Allowed 'General case' 0 CA--C 1.558 1.283 0 C-N-CA 122.871 0.468 . . . . 71.319999999999993 110.217 -178.284 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 14.5 p -75.6 107.06 7.5 Favored 'General case' 0 CA--C 1.557 1.229 0 N-CA-C 114.14 1.163 . . . . 62.299999999999997 114.14 -167.929 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 92' ' ' LEU . . . . . 0.455 HD22 HD23 ' A' ' 41' ' ' LEU . 59.5 mt -89.62 -154.73 0.33 Allowed 'General case' 0 N--CA 1.484 1.254 0 C-N-CA 124.346 1.058 . . . . 74.409999999999997 108.317 162.789 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 93' ' ' ILE . . . . . 0.522 ' HB ' HG22 ' A' ' 97' ' ' THR . 68.7 mt -51.26 -40.88 23.66 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.61 0 CA-C-O 121.364 0.602 . . . . 71.450000000000003 110.401 167.072 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 179.07 -174.69 46.7 Favored Glycine 0 C--O 1.242 0.63 0 CA-C-N 114.724 -1.125 . . . . 72.230000000000004 110.711 175.211 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 18.3 mm100 -75.82 149.53 37.87 Favored 'General case' 0 CA--C 1.541 0.631 0 N-CA-C 110.172 -0.307 . . . . 73.430000000000007 110.172 174.722 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 96' ' ' SER . . . . . 0.422 ' HA ' ' HB3' ' A' ' 86' ' ' LEU . 29.9 t 75.77 -16.6 0.58 Allowed 'General case' 0 N--CA 1.484 1.247 0 C-N-CA 125.865 1.666 . . . . 60.350000000000001 113.119 -174.554 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 97' ' ' THR . . . . . 0.522 HG22 ' HB ' ' A' ' 93' ' ' ILE . 86.7 m -59.52 -36.86 76.93 Favored 'General case' 0 N--CA 1.477 0.89 0 C-N-CA 123.4 0.68 . . . . 71.219999999999999 112.186 -176.109 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 98' ' ' ARG . . . . . 0.534 ' HG3' ' H ' ' A' ' 99' ' ' GLN . 0.0 OUTLIER -56.42 -57.28 12.98 Favored 'General case' 0 CA--C 1.554 1.119 0 O-C-N 123.434 0.459 . . . . 74.319999999999993 111.665 -178.936 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 99' ' ' GLN . . . . . 0.534 ' H ' ' HG3' ' A' ' 98' ' ' ARG . 23.1 tm0? -78.64 -42.48 28.65 Favored 'General case' 0 C--N 1.349 0.558 0 N-CA-C 109.28 -0.637 . . . . 73.400000000000006 109.28 -170.643 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 4.5 tppp? -62.53 -52.36 63.77 Favored 'General case' 0 CA--C 1.539 0.525 0 O-C-N 123.707 0.629 . . . . 74.549999999999997 110.992 -176.592 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 33.3 t -72.89 -36.87 67.41 Favored 'General case' 0 CA--C 1.543 0.692 0 O-C-N 123.61 0.569 . . . . 74.510000000000005 111.449 -174.973 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 5.0 tp -75.98 -32.81 59.65 Favored 'General case' 0 N--CA 1.487 1.403 0 CA-C-N 118.21 0.459 . . . . 72.430000000000007 111.4 -177.743 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 25.9 t-20 -78.91 -31.03 45.14 Favored 'General case' 0 N--CA 1.489 1.517 0 C-N-CA 123.326 0.65 . . . . 70.319999999999993 110.35 176.87 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 53.1 t30 -66.03 -38.75 89.21 Favored 'General case' 0 N--CA 1.487 1.393 0 C-N-CA 123.604 0.761 . . . . 75.450000000000003 109.384 171.859 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -60.49 -48.57 81.18 Favored 'General case' 0 CA--C 1.54 0.586 0 CA-C-N 115.002 -0.999 . . . . 73.519999999999996 110.522 175.459 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 106' ' ' TYR . . . . . 0.609 ' HE2' ' HB2' ' A' ' 69' ' ' LYS . 6.3 t80 -56.28 -45.07 80.29 Favored 'General case' 0 C--N 1.355 0.84 0 O-C-N 123.62 0.575 . . . . 72.420000000000002 110.18 174.702 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -58.32 -43.56 95.55 Favored Glycine 0 C--N 1.354 1.568 0 O-C-N 123.842 0.714 . . . . 71.329999999999998 112.882 -177.285 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 99.7 mtt180 -68.47 -37.93 80.6 Favored 'General case' 0 CA--C 1.544 0.715 0 C-N-CA 123.196 0.598 . . . . 73.519999999999996 111.116 177.615 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 109' ' ' LEU . . . . . 0.504 ' HA ' ' N ' ' A' ' 114' ' ' LEU . 35.8 tp -72.84 -31.15 64.57 Favored 'General case' 0 N--CA 1.488 1.449 0 C-N-CA 123.06 0.544 . . . . 72.519999999999996 111.554 -178.383 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 33.3 t -79.87 -32.55 40.43 Favored 'General case' 0 CA--C 1.537 0.48 0 C-N-CA 123.789 0.836 . . . . 75.319999999999993 109.337 178.148 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . -87.9 -64.35 1.36 Allowed Glycine 0 C--N 1.36 1.904 0 CA-C-O 119.164 -0.798 . . . . 62.219999999999999 113.606 -178.439 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 112' ' ' MET . . . . . . . . . . . . . 21.7 mmm -96.98 -69.0 0.77 Allowed 'General case' 0 N--CA 1.489 1.518 0 CA-C-N 118.34 1.07 . . . . 74.040000000000006 113.194 178.058 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 13.6 tp 172.03 25.7 0.0 OUTLIER 'General case' 0 N--CA 1.495 1.786 0 O-C-N 123.77 0.669 . . . . 75.25 110.888 -173.3 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 114' ' ' LEU . . . . . 0.504 ' N ' ' HA ' ' A' ' 109' ' ' LEU . 41.5 tp 84.2 -12.33 0.79 Allowed 'General case' 0 N--CA 1.501 2.092 0 C-N-CA 126.571 1.948 . . . . 74.019999999999996 111.9 -177.443 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 115' ' ' VAL . . . . . . . . . . . . . 35.9 m -66.77 143.94 98.32 Favored Pre-proline 0 CA--C 1.553 1.083 0 C-N-CA 122.502 0.321 . . . . 74.310000000000002 110.169 173.233 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 21.5 Cg_exo -65.74 163.69 29.57 Favored 'Trans proline' 0 C--N 1.375 1.963 0 C-N-CA 122.475 2.117 . . . . 73.329999999999998 112.281 176.611 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 17.4 m-20 59.79 79.88 0.22 Allowed 'General case' 0 N--CA 1.474 0.726 0 C-N-CA 125.018 1.327 . . . . 73.310000000000002 110.379 -176.558 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -110.22 91.67 11.92 Favored Pre-proline 0 CA--C 1.549 0.936 0 C-N-CA 123.715 0.806 . . . . 71.230000000000004 110.437 -179.293 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 119' ' ' PRO . . . . . . . . . . . . . 91.4 Cg_endo -76.12 -11.27 19.51 Favored 'Trans proline' 0 C--N 1.378 2.083 0 C-N-CA 122.95 2.433 . . . . 75.439999999999998 112.398 175.5 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . 130.28 137.38 4.16 Favored Glycine 0 C--N 1.347 1.151 0 N-CA-C 111.24 -0.744 . . . . 63.32 111.24 -178.97 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . -151.88 156.47 40.19 Favored 'General case' 0 N--CA 1.475 0.793 0 C-N-CA 123.575 0.75 . . . . 71.200000000000003 110.762 177.317 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 122' ' ' SER . . . . . . . . . . . . . 29.7 t . . . . . 0 CA--C 1.558 1.263 0 C-N-CA 123.964 0.906 . . . . 62.219999999999999 108.743 -179.196 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 1' ' ' MET . . . . . 0.598 ' HG2' ' HB ' ' A' ' 4' ' ' THR . 0.0 OUTLIER . . . . . 0 CA--C 1.55 0.96 0 N-CA-C 109.362 -0.607 . . . . 74.200000000000003 109.362 . . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 42.2 p -57.81 -48.05 80.85 Favored 'General case' 0 N--CA 1.479 1.011 0 C-N-CA 124.411 1.084 . . . . 74.129999999999995 113.555 -166.531 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 36.2 m -66.08 -38.52 88.49 Favored 'General case' 0 N--CA 1.476 0.873 0 O-C-N 123.522 0.514 . . . . 70.540000000000006 111.543 -176.078 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 4' ' ' THR . . . . . 0.598 ' HB ' ' HG2' ' A' ' 1' ' ' MET . 15.0 m -76.24 -38.65 56.07 Favored 'General case' 0 N--CA 1.475 0.822 0 O-C-N 123.576 0.547 . . . . 62.25 112.155 -176.575 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 85.5 t -67.86 -40.52 83.7 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.87 0 N-CA-C 109.612 -0.514 . . . . 74.329999999999998 109.612 177.109 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . 0.498 ' O ' ' HG3' ' A' ' 10' ' ' ARG . 2.6 tm-20 -64.67 -36.83 85.53 Favored 'General case' 0 CA--C 1.549 0.922 0 C-N-CA 123.666 0.786 . . . . 74.439999999999998 109.854 175.694 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' PHE . . . . . 0.418 ' O ' ' HB2' ' A' ' 10' ' ' ARG . 81.3 t80 -64.26 -47.21 80.49 Favored 'General case' 0 N--CA 1.481 1.083 0 C-N-CA 124.764 1.225 . . . . 75.349999999999994 111.851 177.342 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . 0.434 ' O ' ' HG3' ' A' ' 12' ' ' GLN . 79.1 mt -62.99 -39.71 86.23 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.91 0 N-CA-C 109.042 -0.725 . . . . 72.430000000000007 109.042 175.588 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 2.4 t-20 -61.06 -35.54 77.21 Favored 'General case' 0 N--CA 1.484 1.231 0 C-N-CA 124.695 1.198 . . . . 70.120000000000005 111.151 178.146 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . 0.498 ' HG3' ' O ' ' A' ' 6' ' ' GLU . 42.1 mtt180 -59.15 -56.7 18.86 Favored 'General case' 0 N--CA 1.474 0.757 0 C-N-CA 123.473 0.709 . . . . 72.510000000000005 109.269 172.416 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' TRP . . . . . 0.407 ' CD1' HG11 ' A' ' 64' ' ' VAL . 93.8 m95 -69.68 -23.47 63.46 Favored 'General case' 0 N--CA 1.468 0.468 0 CA-C-N 114.966 -1.015 . . . . 74.519999999999996 112.758 -175.704 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . 0.434 ' HG3' ' O ' ' A' ' 8' ' ' ILE . 59.3 mt-30 -66.84 -50.37 62.77 Favored 'General case' 0 N--CA 1.473 0.724 0 N-CA-C 108.141 -1.059 . . . . 71.120000000000005 108.141 172.436 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . 0.538 ' HE ' HD11 ' A' ' 17' ' ' LEU . 13.2 tpt180 -57.25 -47.9 80.21 Favored 'General case' 0 CA--C 1.549 0.922 0 O-C-N 124.249 0.968 . . . . 74.439999999999998 111.221 -177.758 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 14' ' ' ILE . . . . . 0.528 HD13 HG22 ' A' ' 47' ' ' VAL . 49.0 mt -67.95 -46.17 82.45 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.063 0 CA-C-N 115.744 -0.662 . . . . 72.030000000000001 110.247 -177.309 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . 0.414 ' HB3' ' OE1' ' A' ' 70' ' ' GLN . . . -61.55 -44.79 96.4 Favored 'General case' 0 N--CA 1.484 1.265 0 C-N-CA 123.614 0.766 . . . . 64.109999999999999 112.038 -178.449 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 85.4 mt -71.18 -44.68 64.98 Favored 'General case' 0 N--CA 1.477 0.897 0 CA-C-N 114.838 -1.073 . . . . 73.310000000000002 110.843 -175.541 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . 0.538 HD11 ' HE ' ' A' ' 13' ' ' ARG . 43.0 mt -72.24 -31.94 66.25 Favored 'General case' 0 N--CA 1.477 0.912 0 CA-C-O 118.874 -0.584 . . . . 74.239999999999995 112.025 -178.094 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 83.0 p -70.71 -39.45 73.41 Favored 'General case' 0 N--CA 1.486 1.34 0 CA-C-N 118.406 0.548 . . . . 73.099999999999994 110.284 175.944 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 5.9 tp-100 -57.89 -43.6 86.22 Favored 'General case' 0 C--O 1.25 1.083 0 CA-C-N 115.344 -0.844 . . . . 75.349999999999994 110.079 172.183 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 49.8 m -60.01 -57.88 10.94 Favored 'General case' 0 C--N 1.353 0.753 0 CA-C-N 114.832 -1.076 . . . . 73.010000000000005 109.98 176.772 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . 0.497 HD22 ' HG ' ' A' ' 33' ' ' LEU . 65.1 mt -57.64 -33.77 68.64 Favored 'General case' 0 N--CA 1.479 0.989 0 C-N-CA 123.607 0.763 . . . . 74.340000000000003 111.241 -175.421 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . 0.627 ' HA ' HD22 ' A' ' 78' ' ' LEU . 64.4 tp -63.34 -61.55 2.27 Favored 'General case' 0 C--O 1.251 1.149 0 O-C-N 123.791 0.682 . . . . 74.209999999999994 110.315 177.375 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . 0.468 ' O ' ' HG3' ' A' ' 27' ' ' ARG . 94.6 mt-10 -57.81 -48.0 80.99 Favored 'General case' 0 C--N 1.356 0.88 0 O-C-N 124.178 0.924 . . . . 74.519999999999996 110.58 -177.392 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 95.7 mt -62.02 -39.44 92.27 Favored 'General case' 0 N--CA 1.476 0.861 0 C-N-CA 124.558 1.143 . . . . 71.549999999999997 111.757 -176.605 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . 0.4 ' HB2' HD22 ' A' ' 33' ' ' LEU . . . -61.11 -44.36 97.47 Favored 'General case' 0 N--CA 1.484 1.228 0 CA-C-O 121.138 0.494 . . . . 53.229999999999997 110.904 175.958 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 81.5 mt-30 -68.03 -32.24 72.47 Favored 'General case' 0 CA--C 1.551 0.997 0 CA-C-N 114.937 -1.029 . . . . 71.25 111.471 177.3 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . 0.468 ' HG3' ' O ' ' A' ' 23' ' ' GLU . 89.3 mtt-85 -74.67 -20.06 60.02 Favored 'General case' 0 N--CA 1.486 1.366 0 C-N-CA 123.74 0.816 . . . . 74.219999999999999 111.226 178.811 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 94.44 5.68 61.66 Favored Glycine 0 C--N 1.351 1.385 0 O-C-N 123.272 0.358 . . . . 71.219999999999999 112.72 -176.237 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 7.6 mm-40 -83.07 52.79 2.26 Favored 'General case' 0 CA--C 1.549 0.94 0 C-N-CA 124.058 0.943 . . . . 72.329999999999998 110.541 178.989 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 30' ' ' TRP . . . . . 0.457 ' O ' ' HG ' ' A' ' 34' ' ' LEU . 94.6 m95 -66.87 -23.81 66.06 Favored 'General case' 0 N--CA 1.473 0.695 0 C-N-CA 123.56 0.744 . . . . 74.120000000000005 111.454 -178.936 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 15.2 m-20 -54.22 -46.67 72.57 Favored 'General case' 0 N--CA 1.478 0.928 0 C-N-CA 123.754 0.821 . . . . 74.219999999999999 110.078 172.098 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 93.5 mt -63.26 -33.83 76.35 Favored 'General case' 0 C--O 1.215 -0.725 0 CA-C-N 114.905 -1.043 . . . . 75.049999999999997 110.81 178.069 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . 0.497 ' HG ' HD22 ' A' ' 21' ' ' LEU . 8.1 mp -68.36 -39.89 81.66 Favored 'General case' 0 N--CA 1.488 1.457 0 CA-C-N 118.053 0.388 . . . . 73.329999999999998 111.202 174.138 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . 0.457 ' HG ' ' O ' ' A' ' 30' ' ' TRP . 93.8 mt -65.03 -38.37 90.67 Favored 'General case' 0 N--CA 1.487 1.386 0 C-N-CA 123.555 0.742 . . . . 72.109999999999999 111.542 -177.681 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 1.7 mp0 -77.22 -56.86 4.2 Favored 'General case' 0 N--CA 1.475 0.809 0 CA-C-N 116.068 -0.514 . . . . 65.230000000000004 110.643 176.986 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 82.3 mm-40 -66.81 -14.56 62.8 Favored 'General case' 0 N--CA 1.484 1.227 0 CA-C-O 118.726 -0.654 . . . . 75.049999999999997 112.6 -174.956 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 42.9 tt0 -52.79 -57.8 8.99 Favored 'General case' 0 N--CA 1.481 1.115 0 C-N-CA 123.666 0.786 . . . . 74.549999999999997 111.308 175.577 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 61.5 t -56.97 -43.88 81.61 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.163 0 C-N-CA 123.515 0.726 . . . . 70.439999999999998 111.318 -175.078 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 18.5 p -74.88 -45.49 42.59 Favored 'General case' 0 N--CA 1.477 0.91 0 C-N-CA 123.643 0.777 . . . . 64.120000000000005 112.343 -175.255 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 27.0 t80 -62.9 -42.78 99.9 Favored 'General case' 0 N--CA 1.482 1.155 0 C-N-CA 124.02 0.928 . . . . 75.510000000000005 110.821 179.963 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . 0.626 ' HA ' HG22 ' A' ' 44' ' ' ILE . 88.5 mt -78.47 -31.43 47.88 Favored 'General case' 0 C--O 1.222 -0.378 0 CA-C-N 115.556 -0.747 . . . . 73.439999999999998 111.175 -176.444 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 23.4 tm0? -59.59 -43.6 93.63 Favored 'General case' 0 N--CA 1.476 0.864 0 N-CA-C 108.831 -0.803 . . . . 73.349999999999994 108.831 170.005 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 43' ' ' SER . . . . . 0.558 ' O ' HG23 ' A' ' 47' ' ' VAL . 61.6 m -60.59 -55.08 37.68 Favored 'General case' 0 C--N 1.353 0.728 0 O-C-N 123.946 0.779 . . . . 72.329999999999998 111.106 178.478 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 44' ' ' ILE . . . . . 0.626 HG22 ' HA ' ' A' ' 41' ' ' LEU . 17.2 tt -65.42 -34.51 70.92 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.329 0 C-N-CA 123.019 0.528 . . . . 74.0 111.697 -172.961 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 21.6 mm-40 -61.27 -50.35 73.38 Favored 'General case' 0 C--N 1.356 0.882 0 C-N-CA 123.494 0.718 . . . . 65.310000000000002 109.836 172.078 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 46' ' ' THR . . . . . 0.415 ' O ' ' HB2' ' A' ' 50' ' ' LYS . 97.5 m -54.12 -39.02 66.04 Favored 'General case' 0 N--CA 1.481 1.105 0 C-N-CA 124.352 1.061 . . . . 73.340000000000003 111.534 177.419 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 47' ' ' VAL . . . . . 0.558 HG23 ' O ' ' A' ' 43' ' ' SER . 84.5 t -68.57 -45.0 82.41 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.969 0 C-N-CA 124.005 0.922 . . . . 75.400000000000006 111.447 -178.317 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 48' ' ' MET . . . . . . . . . . . . . 77.5 mtm -67.34 -31.49 71.79 Favored 'General case' 0 N--CA 1.482 1.149 0 O-C-N 123.491 0.494 . . . . 73.549999999999997 111.29 178.214 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 48.2 mt-10 -72.2 -31.2 65.67 Favored 'General case' 0 N--CA 1.481 1.086 0 C-N-CA 123.652 0.781 . . . . 73.219999999999999 110.975 174.576 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . 0.415 ' HB2' ' O ' ' A' ' 46' ' ' THR . 4.6 tppt? -79.5 160.44 26.53 Favored 'General case' 0 N--CA 1.474 0.755 0 C-N-CA 123.151 0.58 . . . . 74.219999999999999 111.858 -168.871 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 8.7 tt0 -81.95 124.87 30.13 Favored 'General case' 0 C--O 1.241 0.642 0 CA-C-N 115.165 -0.925 . . . . 64.319999999999993 110.814 -176.968 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 52' ' ' THR . . . . . 0.742 HG22 ' HB3' ' A' ' 114' ' ' LEU . 96.7 m -69.93 122.85 87.35 Favored Pre-proline 0 CA--C 1.551 0.984 0 N-CA-C 109.162 -0.681 . . . . 74.030000000000001 109.162 166.765 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 53' ' ' PRO . . . . . 0.591 ' HG3' ' HA ' ' A' ' 4' ' ' THR . 72.0 Cg_endo -69.28 156.91 63.23 Favored 'Trans proline' 0 C--N 1.369 1.645 0 C-N-CA 123.002 2.468 . . . . 73.409999999999997 112.573 178.458 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 56.7 Cg_endo -70.7 -44.61 1.36 Allowed 'Trans proline' 0 C--N 1.371 1.723 0 C-N-CA 122.526 2.151 . . . . 74.430000000000007 111.471 172.194 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . -75.04 68.93 1.94 Allowed Glycine 0 C--N 1.352 1.419 0 N-CA-C 115.048 0.779 . . . . 60.399999999999999 115.048 -172.087 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 56' ' ' ILE . . . . . 0.497 HG22 HG23 ' A' ' 60' ' ' ILE . 84.5 mt -110.24 108.46 25.48 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.656 0 N-CA-C 107.579 -1.267 . . . . 75.319999999999993 107.579 176.53 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 42.8 p -82.27 -172.45 3.99 Favored 'General case' 0 N--CA 1.483 1.176 0 C-N-CA 123.016 0.526 . . . . 74.109999999999999 110.552 -177.625 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 29.8 tpt85 -63.06 -60.33 3.59 Favored 'General case' 0 N--CA 1.475 0.794 0 C-N-CA 123.275 0.63 . . . . 75.349999999999994 110.639 -178.771 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 21.0 m -62.4 -33.6 75.09 Favored 'General case' 0 N--CA 1.475 0.798 0 C-N-CA 123.595 0.758 . . . . 64.430000000000007 111.731 -178.101 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 60' ' ' ILE . . . . . 0.497 HG23 HG22 ' A' ' 56' ' ' ILE . 74.4 mt -65.07 -43.68 95.85 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.81 0 C-N-CA 122.921 0.488 . . . . 64.420000000000002 110.125 175.087 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 60.3 tt0 -64.55 -36.64 84.89 Favored 'General case' 0 N--CA 1.48 1.072 0 C-N-CA 123.322 0.649 . . . . 73.120000000000005 111.036 179.196 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 26.5 m-20 -65.64 -46.66 78.36 Favored 'General case' 0 N--CA 1.474 0.731 0 C-N-CA 123.001 0.52 . . . . 75.319999999999993 110.853 176.976 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 63' ' ' MET . . . . . . . . . . . . . 73.3 mtm -65.96 -46.67 77.27 Favored 'General case' 0 N--CA 1.476 0.867 0 O-C-N 123.307 0.38 . . . . 73.299999999999997 111.014 -179.692 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 64' ' ' VAL . . . . . 0.486 ' O ' HG13 ' A' ' 68' ' ' ILE . 52.0 t -63.78 -60.55 2.58 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.566 0 C-N-CA 123.474 0.709 . . . . 74.409999999999997 110.615 -178.535 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . 0.497 ' HB1' HD23 ' A' ' 109' ' ' LEU . . . -60.59 -33.11 72.25 Favored 'General case' 0 N--CA 1.487 1.397 0 O-C-N 123.403 0.44 . . . . 70.140000000000001 111.519 -179.896 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -65.03 -38.04 94.95 Favored Glycine 0 C--N 1.347 1.146 0 CA-C-N 116.3 -0.409 . . . . 63.439999999999998 112.316 175.743 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 67' ' ' TYR . . . . . 0.489 ' O ' HG23 ' A' ' 71' ' ' THR . 17.4 m-30 -74.72 -33.55 62.4 Favored 'General case' 0 N--CA 1.473 0.679 0 C-N-CA 123.218 0.607 . . . . 74.010000000000005 111.238 177.563 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 68' ' ' ILE . . . . . 0.486 HG13 ' O ' ' A' ' 64' ' ' VAL . 59.8 mt -63.68 -49.06 83.83 Favored 'Isoleucine or valine' 0 C--N 1.36 1.052 0 N-CA-C 108.663 -0.866 . . . . 71.409999999999997 108.663 175.63 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 69' ' ' LYS . . . . . 0.503 ' HB2' ' HE2' ' A' ' 106' ' ' TYR . 44.0 tptt -56.33 -44.65 80.21 Favored 'General case' 0 C--N 1.349 0.555 0 C-N-CA 123.572 0.749 . . . . 75.219999999999999 110.901 174.64 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 70' ' ' GLN . . . . . 0.414 ' OE1' ' HB3' ' A' ' 15' ' ' ALA . 63.4 tt0 -61.47 -45.72 93.06 Favored 'General case' 0 C--N 1.349 0.549 0 O-C-N 123.679 0.612 . . . . 74.510000000000005 111.077 -177.49 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 71' ' ' THR . . . . . 0.489 HG23 ' O ' ' A' ' 67' ' ' TYR . 3.0 t -74.7 -39.73 61.78 Favored 'General case' 0 C--N 1.355 0.824 0 CA-C-O 119.646 -0.216 . . . . 75.519999999999996 111.12 -175.185 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 72' ' ' LEU . . . . . 0.486 HD21 ' HB2' ' A' ' 102' ' ' LEU . 44.2 mt -64.85 -39.0 92.85 Favored 'General case' 0 N--CA 1.472 0.67 0 C-N-CA 122.11 0.164 . . . . 75.310000000000002 111.069 178.578 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 73' ' ' ASP . . . . . 0.433 ' O ' ' HG ' ' A' ' 77' ' ' LEU . 14.2 t70 -65.71 -59.63 3.72 Favored 'General case' 0 CA--C 1.543 0.686 0 O-C-N 123.994 0.809 . . . . 70.420000000000002 109.677 -178.702 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 84.1 m-20 -59.52 -45.22 92.38 Favored 'General case' 0 N--CA 1.485 1.317 0 C-N-CA 124.036 0.934 . . . . 72.319999999999993 111.778 -176.2 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 3.3 tm-20 -75.05 -29.86 60.85 Favored 'General case' 0 CA--C 1.555 1.166 0 CA-C-N 115.661 -0.7 . . . . 73.239999999999995 110.413 -174.477 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 9.4 tt0 -75.27 -29.62 60.21 Favored 'General case' 0 N--CA 1.488 1.458 0 O-C-N 122.056 -0.403 . . . . 75.329999999999998 110.746 175.076 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . 0.433 ' HG ' ' O ' ' A' ' 73' ' ' ASP . 93.2 mt -65.43 -39.99 92.77 Favored 'General case' 0 N--CA 1.48 1.07 0 N-CA-C 109.428 -0.582 . . . . 73.329999999999998 109.428 172.475 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . 0.627 HD22 ' HA ' ' A' ' 22' ' ' LEU . 72.7 mt -58.23 -47.67 82.81 Favored 'General case' 0 N--CA 1.477 0.889 0 CA-C-N 115.378 -0.828 . . . . 74.319999999999993 111.246 170.476 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 79' ' ' LYS . . . . . 0.664 ' HZ3' ' HA ' ' A' ' 88' ' ' GLU . 25.9 mmtp -66.92 -28.56 68.4 Favored 'General case' 0 N--CA 1.475 0.81 0 C-N-CA 123.161 0.584 . . . . 72.150000000000006 112.463 -177.991 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -72.26 -33.99 61.38 Favored Glycine 0 C--N 1.347 1.175 0 N-CA-C 111.572 -0.611 . . . . 54.020000000000003 111.572 171.259 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 7.1 tt -73.61 -36.11 65.45 Favored 'General case' 0 CA--C 1.554 1.125 0 C-N-CA 124.224 1.009 . . . . 63.200000000000003 110.266 177.762 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 95.1 mt -77.84 -69.54 0.54 Allowed 'General case' 0 C--N 1.357 0.929 0 C-N-CA 123.078 0.551 . . . . 73.319999999999993 111.258 -171.973 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 78.6 mm-40 -159.92 -55.55 0.06 Allowed 'General case' 0 N--CA 1.487 1.404 0 C-N-CA 123.328 0.651 . . . . 73.040000000000006 110.05 -173.388 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 6.2 tp-100 -155.75 150.6 26.35 Favored 'General case' 0 N--CA 1.484 1.259 0 C-N-CA 122.913 0.485 . . . . 74.129999999999995 110.283 -171.432 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 85' ' ' ARG . . . . . 0.429 ' HA ' ' HB3' ' A' ' 79' ' ' LYS . 38.7 mtp180 -70.17 -49.67 48.06 Favored 'General case' 0 N--CA 1.487 1.392 0 C-N-CA 124.742 1.217 . . . . 75.239999999999995 112.786 -169.615 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 76.7 mt -88.76 -2.15 58.44 Favored 'General case' 0 N--CA 1.482 1.16 0 C-N-CA 123.194 0.597 . . . . 75.239999999999995 112.041 178.533 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 24.2 t70 -80.66 88.39 5.74 Favored 'General case' 0 N--CA 1.476 0.839 0 N-CA-C 108.427 -0.953 . . . . 65.209999999999994 108.427 172.964 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 88' ' ' GLU . . . . . 0.664 ' HA ' ' HZ3' ' A' ' 79' ' ' LYS . 29.6 mm-40 -75.91 168.81 19.35 Favored 'General case' 0 CA--C 1.546 0.809 0 CA-C-N 114.968 -1.014 . . . . 73.019999999999996 112.143 -170.529 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 95.4 mt -72.76 -176.0 1.87 Allowed 'General case' 0 CA--C 1.557 1.227 0 C-N-CA 123.91 0.884 . . . . 73.010000000000005 111.597 179.883 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 7.9 m -69.53 143.28 53.46 Favored 'General case' 0 N--CA 1.479 1.004 0 C-N-CA 123.771 0.828 . . . . 74.25 111.872 -175.162 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 11.2 t 68.38 30.98 5.21 Favored 'General case' 0 CA--C 1.559 1.31 0 C-N-CA 124.331 1.053 . . . . 71.510000000000005 111.609 173.24 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 92' ' ' LEU . . . . . 0.467 HD11 HD21 ' A' ' 41' ' ' LEU . 64.4 mt -108.22 165.68 11.31 Favored 'General case' 0 N--CA 1.49 1.536 0 C-N-CA 123.618 0.767 . . . . 74.420000000000002 110.324 171.763 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 59.0 mt -62.03 92.16 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.482 1.14 0 C-N-CA 124.365 1.066 . . . . 64.329999999999998 111.877 -172.954 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 60.78 30.57 73.05 Favored Glycine 0 C--N 1.353 1.499 0 CA-C-N 115.769 -0.651 . . . . 63.240000000000002 113.506 178.83 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 21.0 pt20 42.18 36.39 0.7 Allowed 'General case' 0 N--CA 1.497 1.918 0 C-N-CA 126.297 1.839 . . . . 73.140000000000001 112.849 -172.392 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 72.7 m -155.0 -168.48 2.89 Favored 'General case' 0 N--CA 1.48 1.051 0 C-N-CA 125.719 1.608 . . . . 73.109999999999999 107.873 178.138 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 54.0 m 76.83 -42.53 0.42 Allowed 'General case' 0 N--CA 1.49 1.564 0 C-N-CA 124.678 1.191 . . . . 73.310000000000002 113.473 170.159 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 1.1 tmm_? -50.81 -51.24 52.77 Favored 'General case' 0 N--CA 1.482 1.135 0 C-N-CA 125.301 1.44 . . . . 75.129999999999995 111.522 -170.291 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 30.8 tt0 -61.61 -45.82 92.44 Favored 'General case' 0 C--N 1.355 0.831 0 O-C-N 123.496 0.497 . . . . 71.209999999999994 109.975 -175.781 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 64.4 tttp -68.29 -29.26 67.99 Favored 'General case' 0 N--CA 1.482 1.162 0 O-C-N 124.098 0.874 . . . . 73.450000000000003 111.737 179.542 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 35.1 t -72.79 -41.29 65.14 Favored 'General case' 0 N--CA 1.478 0.957 0 C-N-CA 123.361 0.665 . . . . 62.109999999999999 110.282 -177.551 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 102' ' ' LEU . . . . . 0.486 ' HB2' HD21 ' A' ' 72' ' ' LEU . 9.2 mp -79.36 -23.73 43.16 Favored 'General case' 0 N--CA 1.476 0.841 0 CA-C-N 116.07 -0.514 . . . . 74.439999999999998 110.934 174.97 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -72.46 -34.15 67.52 Favored 'General case' 0 N--CA 1.482 1.175 0 N-CA-C 108.602 -0.888 . . . . 72.150000000000006 108.602 174.476 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 9.6 t30 -71.65 -37.34 70.83 Favored 'General case' 0 N--CA 1.474 0.753 0 CA-C-N 115.213 -0.903 . . . . 73.109999999999999 109.226 174.037 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 105' ' ' ALA . . . . . 0.46 ' O ' ' HG ' ' A' ' 114' ' ' LEU . . . -61.1 -48.96 79.25 Favored 'General case' 0 CA--C 1.538 0.502 0 O-C-N 123.733 0.646 . . . . 75.239999999999995 110.315 175.504 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 106' ' ' TYR . . . . . 0.503 ' HE2' ' HB2' ' A' ' 69' ' ' LYS . 7.8 t80 -61.14 -51.9 67.14 Favored 'General case' 0 CA--C 1.541 0.611 0 CA-C-N 116.008 -0.542 . . . . 73.340000000000003 109.733 179.564 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -63.37 -44.48 96.78 Favored Glycine 0 C--N 1.354 1.581 0 O-C-N 124.212 0.945 . . . . 74.409999999999997 113.19 -173.815 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 5.8 tpm_? -69.13 -34.29 74.79 Favored 'General case' 0 C--N 1.348 0.522 0 C-N-CA 122.996 0.518 . . . . 73.530000000000001 109.909 179.935 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 109' ' ' LEU . . . . . 0.497 HD23 ' HB1' ' A' ' 65' ' ' ALA . 54.9 tp -65.91 -45.76 80.75 Favored 'General case' 0 N--CA 1.488 1.426 0 C-N-CA 123.055 0.542 . . . . 75.230000000000004 110.616 176.072 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 42.4 t -59.59 -48.58 81.11 Favored 'General case' 0 CA--C 1.531 0.249 0 O-C-N 124.738 1.274 . . . . 74.540000000000006 110.551 -176.471 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . -85.4 -59.32 1.94 Allowed Glycine 0 C--N 1.356 1.646 0 CA-C-O 119.299 -0.723 . . . . 65.519999999999996 112.957 -178.463 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 112' ' ' MET . . . . . . . . . . . . . 8.0 tpt -93.07 -70.4 0.7 Allowed 'General case' 0 N--CA 1.489 1.479 0 CA-C-N 118.216 1.008 . . . . 75.519999999999996 113.143 -178.011 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 113' ' ' LEU . . . . . 0.518 ' HB3' HG22 ' A' ' 115' ' ' VAL . 15.1 tp 168.36 13.9 0.0 OUTLIER 'General case' 0 N--CA 1.507 2.379 0 C-N-CA 123.575 0.75 . . . . 75.120000000000005 112.267 -173.498 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 114' ' ' LEU . . . . . 0.742 ' HB3' HG22 ' A' ' 52' ' ' THR . 0.9 OUTLIER 72.78 10.05 5.51 Favored 'General case' 0 N--CA 1.502 2.138 0 C-N-CA 125.089 1.356 . . . . 72.439999999999998 109.98 -176.153 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 115' ' ' VAL . . . . . 0.518 HG22 ' HB3' ' A' ' 113' ' ' LEU . 35.3 m -105.71 130.16 23.49 Favored Pre-proline 0 CA--C 1.551 1.011 0 N-CA-C 107.933 -1.136 . . . . 74.209999999999994 107.933 173.912 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 86.7 Cg_endo -76.72 -178.08 4.25 Favored 'Trans proline' 0 C--N 1.372 1.782 0 C-N-CA 122.437 2.091 . . . . 73.120000000000005 112.208 -178.136 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 24.3 t70 77.31 -31.2 0.17 Allowed 'General case' 0 N--CA 1.49 1.539 0 C-N-CA 125.269 1.428 . . . . 63.240000000000002 112.676 174.461 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -104.48 135.66 19.29 Favored Pre-proline 0 N--CA 1.475 0.81 0 C-N-CA 123.709 0.803 . . . . 74.450000000000003 110.506 -179.991 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 119' ' ' PRO . . . . . . . . . . . . . 56.3 Cg_endo -88.8 157.7 6.11 Favored 'Trans proline' 0 C--N 1.372 1.77 0 C-N-CA 122.692 2.261 . . . . 71.140000000000001 111.76 172.216 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . -116.03 175.27 15.74 Favored Glycine 0 C--N 1.343 0.965 0 CA-C-N 116.246 -0.434 . . . . 54.549999999999997 112.727 178.162 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . -70.5 132.53 45.68 Favored 'General case' 0 N--CA 1.476 0.868 0 C-N-CA 123.384 0.674 . . . . 61.399999999999999 110.652 -179.228 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 122' ' ' SER . . . . . . . . . . . . . 35.8 p . . . . . 0 C--O 1.251 1.14 0 C-N-CA 124.01 0.924 . . . . 74.299999999999997 109.382 -175.836 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 1' ' ' MET . . . . . 0.423 ' O ' HG21 ' A' ' 5' ' ' VAL . 16.5 tpt . . . . . 0 N--CA 1.487 1.376 0 CA-C-O 119.325 -0.369 . . . . 70.340000000000003 111.383 . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 30.5 p -55.63 -51.36 67.45 Favored 'General case' 0 N--CA 1.489 1.488 0 C-N-CA 123.224 0.61 . . . . 70.0 112.229 -176.647 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 35.6 m -64.55 -29.58 70.61 Favored 'General case' 0 CA--C 1.541 0.601 0 CA-C-N 115.551 -0.749 . . . . 72.5 111.14 178.576 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 4' ' ' THR . . . . . 0.486 ' HA ' ' HG3' ' A' ' 53' ' ' PRO . 4.5 m -74.13 -33.3 63.5 Favored 'General case' 0 N--CA 1.473 0.688 0 C-N-CA 123.36 0.664 . . . . 70.129999999999995 110.976 178.845 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . 0.423 HG21 ' O ' ' A' ' 1' ' ' MET . 89.5 t -69.39 -45.64 78.33 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.793 0 N-CA-C 109.273 -0.64 . . . . 71.530000000000001 109.273 177.045 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 25.1 mm-40 -55.07 -47.76 74.43 Favored 'General case' 0 N--CA 1.478 0.961 0 O-C-N 123.627 0.579 . . . . 73.310000000000002 110.831 172.789 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 7' ' ' PHE . . . . . 0.638 ' HZ ' HD13 ' A' ' 109' ' ' LEU . 72.8 t80 -55.38 -61.8 2.09 Favored 'General case' 0 CA--C 1.558 1.275 0 C-N-CA 124.621 1.168 . . . . 73.109999999999999 111.922 -178.573 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . 0.41 ' O ' ' HG3' ' A' ' 12' ' ' GLN . 65.2 mt -57.77 -48.79 82.8 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.08 0 C-N-CA 123.473 0.709 . . . . 73.5 110.615 -178.905 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 2.7 t-20 -65.32 -37.82 88.28 Favored 'General case' 0 N--CA 1.473 0.679 0 O-C-N 124.067 0.855 . . . . 71.239999999999995 111.818 -171.329 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 56.3 mtt180 -69.67 -38.59 77.11 Favored 'General case' 0 CA--C 1.543 0.677 0 CA-C-N 116.151 -0.477 . . . . 75.120000000000005 110.343 176.674 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' TRP . . . . . . . . . . . . . 80.0 m95 -68.82 -27.92 66.28 Favored 'General case' 0 N--CA 1.488 1.44 0 N-CA-C 112.054 0.39 . . . . 71.030000000000001 112.054 174.419 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . 0.41 ' HG3' ' O ' ' A' ' 8' ' ' ILE . 56.1 mt-30 -64.12 -47.69 79.0 Favored 'General case' 0 N--CA 1.478 0.945 0 N-CA-C 109.083 -0.71 . . . . 74.140000000000001 109.083 172.581 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 15.7 tpt180 -54.24 -49.75 68.77 Favored 'General case' 0 CA--C 1.548 0.875 0 C-N-CA 124.036 0.934 . . . . 73.120000000000005 110.889 177.735 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 14' ' ' ILE . . . . . 0.451 HD11 HG23 ' A' ' 47' ' ' VAL . 96.9 mt -59.95 -52.56 59.7 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.894 0 C-N-CA 124.236 1.015 . . . . 74.140000000000001 111.582 -178.104 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -60.06 -45.2 93.64 Favored 'General case' 0 N--CA 1.474 0.746 0 C-N-CA 123.599 0.759 . . . . 72.049999999999997 112.037 -176.55 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 96.1 mt -69.27 -40.8 77.56 Favored 'General case' 0 N--CA 1.475 0.804 0 CA-C-N 114.956 -1.02 . . . . 72.420000000000002 111.107 -177.517 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . 0.497 ' O ' ' HG ' ' A' ' 21' ' ' LEU . 43.1 mt -62.19 -51.92 65.87 Favored 'General case' 0 N--CA 1.478 0.927 0 C-N-CA 122.798 0.439 . . . . 74.540000000000006 110.485 177.894 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 77.8 p -61.94 -40.41 95.43 Favored 'General case' 0 N--CA 1.475 0.817 0 C-N-CA 123.275 0.63 . . . . 71.010000000000005 111.501 -176.676 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 6.6 tp-100 -63.75 -42.24 97.87 Favored 'General case' 0 C--N 1.36 1.034 0 O-C-N 123.294 0.371 . . . . 75.030000000000001 110.428 176.694 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 65.5 m -60.52 -45.45 93.79 Favored 'General case' 0 CA--C 1.538 0.498 0 O-C-N 123.468 0.48 . . . . 52.039999999999999 110.712 176.248 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . 0.649 HD21 ' HA ' ' A' ' 33' ' ' LEU . 69.6 mt -63.29 -33.54 75.73 Favored 'General case' 0 N--CA 1.476 0.839 0 C-N-CA 123.347 0.659 . . . . 75.200000000000003 110.696 -179.092 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . 0.646 ' HA ' HD22 ' A' ' 78' ' ' LEU . 57.9 tp -67.56 -53.34 29.2 Favored 'General case' 0 CA--C 1.544 0.724 0 C-N-CA 123.183 0.593 . . . . 74.450000000000003 110.677 178.036 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . 0.417 ' O ' ' HG3' ' A' ' 27' ' ' ARG . 37.3 mt-10 -56.23 -47.87 77.62 Favored 'General case' 0 N--CA 1.481 1.093 0 C-N-CA 123.874 0.87 . . . . 54.119999999999997 110.556 179.035 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . 0.482 HD23 HD13 ' A' ' 32' ' ' LEU . 87.6 mt -66.02 -35.34 80.3 Favored 'General case' 0 C--O 1.217 -0.653 0 CA-C-N 114.961 -1.018 . . . . 74.530000000000001 110.996 -177.138 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . 0.482 ' HB3' HD22 ' A' ' 33' ' ' LEU . . . -65.04 -38.97 92.61 Favored 'General case' 0 N--CA 1.482 1.154 0 CA-C-O 121.019 0.438 . . . . 74.340000000000003 111.27 175.397 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 96.7 mt-30 -70.94 -27.72 63.97 Favored 'General case' 0 N--CA 1.48 1.041 0 CA-C-N 115.323 -0.853 . . . . 75.540000000000006 111.333 177.456 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . 0.445 ' HD2' HD22 ' A' ' 24' ' ' LEU . 96.9 mtt180 -78.07 -26.85 48.43 Favored 'General case' 0 N--CA 1.478 0.97 0 C-N-CA 123.385 0.674 . . . . 74.140000000000001 110.469 172.469 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 95.54 13.95 49.17 Favored Glycine 0 C--N 1.346 1.121 0 CA-C-N 115.992 -0.549 . . . . 72.549999999999997 113.37 -177.534 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . 0.411 ' HG2' ' HB2' ' A' ' 27' ' ' ARG . 8.7 mm-40 -84.88 59.38 5.55 Favored 'General case' 0 CA--C 1.553 1.076 0 C-N-CA 123.961 0.904 . . . . 70.530000000000001 110.326 176.713 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 30' ' ' TRP . . . . . . . . . . . . . 95.2 m95 -65.4 -22.3 66.77 Favored 'General case' 0 N--CA 1.485 1.302 0 C-N-CA 123.875 0.87 . . . . 74.540000000000006 111.714 -177.734 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 31' ' ' ASP . . . . . 0.4 ' O ' ' HG3' ' A' ' 35' ' ' GLN . 11.9 m-20 -53.56 -53.27 54.13 Favored 'General case' 0 C--N 1.35 0.62 0 O-C-N 123.753 0.658 . . . . 62.399999999999999 109.919 171.354 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . 0.482 HD13 HD23 ' A' ' 24' ' ' LEU . 78.5 mt -63.19 -27.25 69.24 Favored 'General case' 0 N--CA 1.475 0.788 0 O-C-N 124.082 0.864 . . . . 73.530000000000001 111.444 -175.198 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . 0.649 ' HA ' HD21 ' A' ' 21' ' ' LEU . 9.0 mp -69.2 -54.92 12.33 Favored 'General case' 0 N--CA 1.479 0.988 0 C-N-CA 122.551 0.34 . . . . 65.239999999999995 110.421 174.253 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 91.0 mt -63.96 -29.03 70.23 Favored 'General case' 0 N--CA 1.484 1.255 0 O-C-N 123.814 0.696 . . . . 74.329999999999998 112.017 -176.344 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 35' ' ' GLN . . . . . 0.4 ' HG3' ' O ' ' A' ' 31' ' ' ASP . 94.1 mt-30 -71.67 -43.32 66.24 Favored 'General case' 0 N--CA 1.476 0.87 0 C-N-CA 123.374 0.669 . . . . 73.430000000000007 110.7 176.889 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 81.9 mm-40 -85.56 -14.47 45.7 Favored 'General case' 0 N--CA 1.481 1.095 0 C-N-CA 123.166 0.586 . . . . 75.340000000000003 112.369 -178.219 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 41.2 tt0 -51.81 -55.79 17.82 Favored 'General case' 0 N--CA 1.479 1.004 0 C-N-CA 125.069 1.348 . . . . 72.340000000000003 112.54 -173.621 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 63.9 t -62.77 -44.61 99.63 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.895 0 C-N-CA 122.754 0.421 . . . . 71.530000000000001 111.101 -175.407 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 65.3 m -65.43 -38.62 90.45 Favored 'General case' 0 N--CA 1.481 1.086 0 C-N-CA 123.021 0.528 . . . . 63.130000000000003 111.029 -178.908 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 46.1 t80 -66.73 -54.46 22.66 Favored 'General case' 0 CA--C 1.539 0.554 0 CA-C-N 115.262 -0.881 . . . . 74.030000000000001 110.761 -178.924 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . 0.475 HD22 HD22 ' A' ' 92' ' ' LEU . 75.3 mt -62.11 -38.71 89.95 Favored 'General case' 0 N--CA 1.477 0.88 0 O-C-N 123.746 0.654 . . . . 73.239999999999995 110.375 -177.641 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 54.0 tt0 -53.53 -57.23 11.44 Favored 'General case' 0 C--O 1.247 0.925 0 C-N-CA 124.253 1.021 . . . . 63.409999999999997 110.329 174.682 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 43' ' ' SER . . . . . 0.524 ' O ' HG21 ' A' ' 47' ' ' VAL . 51.6 m -54.02 -60.65 3.05 Favored 'General case' 0 CA--C 1.544 0.713 0 O-C-N 124.56 1.163 . . . . 73.400000000000006 111.397 179.496 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 44' ' ' ILE . . . . . 0.433 HG13 HD12 ' A' ' 14' ' ' ILE . 19.0 tt -60.15 -40.82 84.6 Favored 'Isoleucine or valine' 0 C--O 1.257 1.493 0 C-N-CA 123.677 0.791 . . . . 73.25 112.974 -168.586 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . 0.436 ' HG2' ' O ' ' A' ' 41' ' ' LEU . 23.1 mm-40 -67.99 -45.55 73.79 Favored 'General case' 0 C--N 1.348 0.538 0 CA-C-N 116.521 -0.309 . . . . 75.219999999999999 110.189 178.036 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 41.4 m -62.25 -26.36 68.34 Favored 'General case' 0 CA--C 1.56 1.349 0 O-C-N 123.38 0.425 . . . . 74.209999999999994 112.031 178.66 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 47' ' ' VAL . . . . . 0.524 HG21 ' O ' ' A' ' 43' ' ' SER . 59.3 t -72.12 -46.57 58.06 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.434 0 C-N-CA 122.718 0.407 . . . . 72.099999999999994 110.502 175.933 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 48' ' ' MET . . . . . . . . . . . . . 71.6 mtm -67.74 -26.43 66.13 Favored 'General case' 0 N--CA 1.488 1.43 0 N-CA-C 111.77 0.285 . . . . 72.030000000000001 111.77 178.822 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 42.8 mt-10 -81.53 -20.6 39.69 Favored 'General case' 0 N--CA 1.479 0.987 0 C-N-CA 123.69 0.796 . . . . 75.140000000000001 111.192 175.451 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . 0.518 ' HZ1' ' HB2' ' A' ' 50' ' ' LYS . 0.2 OUTLIER -75.8 136.44 40.24 Favored 'General case' 0 C--O 1.244 0.781 0 N-CA-C 109.291 -0.633 . . . . 73.019999999999996 109.291 -179.706 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 7.2 tt0 -61.86 113.85 3.01 Favored 'General case' 0 C--O 1.241 0.656 0 O-C-N 123.448 0.467 . . . . 64.150000000000006 110.007 178.73 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 52' ' ' THR . . . . . 0.407 HG23 ' O ' ' A' ' 114' ' ' LEU . 89.3 m -65.26 128.47 93.82 Favored Pre-proline 0 CA--C 1.553 1.064 0 CA-C-N 115.769 -0.65 . . . . 74.219999999999999 109.71 173.883 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 53' ' ' PRO . . . . . 0.486 ' HG3' ' HA ' ' A' ' 4' ' ' THR . 29.3 Cg_endo -60.27 153.52 58.86 Favored 'Trans proline' 0 C--N 1.375 1.948 0 C-N-CA 122.915 2.41 . . . . 72.25 112.608 178.93 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 54' ' ' PRO . . . . . 0.414 ' HD3' ' HA ' ' A' ' 53' ' ' PRO . 5.0 Cg_exo -81.63 -49.16 0.05 OUTLIER 'Trans proline' 0 C--N 1.369 1.627 0 C-N-CA 123.117 2.544 . . . . 71.239999999999995 112.973 179.479 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . -78.53 80.9 1.39 Allowed Glycine 0 C--N 1.348 1.22 0 CA-C-N 116.498 -0.319 . . . . 73.200000000000003 112.509 -175.208 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 56' ' ' ILE . . . . . 0.612 HG21 HD23 ' A' ' 114' ' ' LEU . 74.2 mt -121.83 144.0 32.51 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.786 0 C-N-CA 123.977 0.911 . . . . 73.409999999999997 109.428 -179.039 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 66.0 p -99.88 170.25 8.65 Favored 'General case' 0 N--CA 1.479 1.014 0 C-N-CA 123.554 0.742 . . . . 72.209999999999994 111.005 177.466 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 13.3 tpt180 -64.65 -35.42 80.97 Favored 'General case' 0 C--N 1.357 0.897 0 C-N-CA 123.208 0.603 . . . . 64.209999999999994 111.439 178.164 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 20.4 m -59.9 -41.81 92.48 Favored 'General case' 0 N--CA 1.482 1.138 0 CA-C-O 121.175 0.512 . . . . 74.530000000000001 110.768 178.518 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 83.3 mt -66.93 -39.26 83.1 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.603 0 CA-C-N 114.996 -1.002 . . . . 75.140000000000001 110.03 176.109 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 61' ' ' GLN . . . . . 0.497 HE21 ' HA ' ' A' ' 110' ' ' SER . 52.3 tt0 -60.89 -35.72 77.36 Favored 'General case' 0 N--CA 1.481 1.076 0 C-N-CA 123.727 0.811 . . . . 74.299999999999997 111.16 176.876 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 57.8 m-20 -73.84 -45.42 51.33 Favored 'General case' 0 N--CA 1.478 0.958 0 C-N-CA 123.073 0.549 . . . . 74.209999999999994 111.468 -179.57 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 63' ' ' MET . . . . . . . . . . . . . 67.1 mtm -66.05 -51.36 58.95 Favored 'General case' 0 N--CA 1.481 1.119 0 C-N-CA 122.708 0.403 . . . . 74.349999999999994 110.889 -179.888 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 64' ' ' VAL . . . . . 0.41 ' O ' HG13 ' A' ' 68' ' ' ILE . 77.3 t -63.13 -59.56 4.17 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.538 0 C-N-CA 123.356 0.662 . . . . 74.310000000000002 111.364 -179.871 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . 0.48 ' HB3' HD21 ' A' ' 109' ' ' LEU . . . -69.14 -22.47 63.94 Favored 'General case' 0 N--CA 1.485 1.313 0 CA-C-N 118.491 0.587 . . . . 74.239999999999995 111.326 -176.606 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -67.42 -38.98 91.45 Favored Glycine 0 C--N 1.348 1.195 0 N-CA-C 111.886 -0.485 . . . . 74.239999999999995 111.886 170.752 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 67' ' ' TYR . . . . . 0.407 ' O ' HG21 ' A' ' 71' ' ' THR . 1.8 m-30 -74.92 -32.32 61.75 Favored 'General case' 0 C--O 1.241 0.636 0 C-N-CA 123.405 0.682 . . . . 70.329999999999998 112.034 175.603 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 68' ' ' ILE . . . . . 0.475 ' O ' ' HG ' ' A' ' 72' ' ' LEU . 19.5 mt -68.53 -38.79 79.65 Favored 'Isoleucine or valine' 0 C--N 1.357 0.894 0 N-CA-C 108.495 -0.928 . . . . 75.010000000000005 108.495 175.03 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 12.3 tmtt? -57.73 -48.81 78.55 Favored 'General case' 0 N--CA 1.48 1.034 0 C-N-CA 123.767 0.827 . . . . 73.420000000000002 108.791 175.63 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 70' ' ' GLN . . . . . 0.443 ' HG2' HD22 ' A' ' 74' ' ' ASN . 64.6 tt0 -53.58 -49.91 66.71 Favored 'General case' 0 CA--C 1.544 0.734 0 O-C-N 124.522 1.139 . . . . 72.040000000000006 110.718 178.652 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 71' ' ' THR . . . . . 0.407 HG21 ' O ' ' A' ' 67' ' ' TYR . 2.9 t -75.12 -21.56 58.78 Favored 'General case' 0 C--N 1.358 0.959 0 CA-C-O 119.293 -0.384 . . . . 75.329999999999998 111.925 -178.542 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 72' ' ' LEU . . . . . 0.475 ' HG ' ' O ' ' A' ' 68' ' ' ILE . 25.4 mt -61.36 -52.43 64.67 Favored 'General case' 0 N--CA 1.487 1.406 0 N-CA-C 108.852 -0.796 . . . . 71.439999999999998 108.852 173.064 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 5.3 m-20 -61.66 -57.39 12.19 Favored 'General case' 0 N--CA 1.475 0.785 0 O-C-N 124.064 0.853 . . . . 71.239999999999995 110.846 178.675 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 74' ' ' ASN . . . . . 0.475 ' HA ' HD21 ' A' ' 22' ' ' LEU . 79.9 m-20 -51.87 -54.43 29.27 Favored 'General case' 0 N--CA 1.484 1.247 0 C-N-CA 124.177 0.991 . . . . 74.030000000000001 111.434 -174.403 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . 0.59 ' O ' ' HG2' ' A' ' 79' ' ' LYS . 10.4 mm-40 -60.26 -57.16 13.98 Favored 'General case' 0 C--O 1.221 -0.427 0 CA-C-N 115.268 -0.878 . . . . 65.5 111.295 179.224 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 9.3 tt0 -62.61 -29.64 70.75 Favored 'General case' 0 N--CA 1.484 1.247 0 O-C-N 123.67 0.606 . . . . 65.510000000000005 112.182 -172.014 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 77.2 mt -72.23 -40.89 67.41 Favored 'General case' 0 N--CA 1.473 0.711 0 C-N-CA 123.613 0.765 . . . . 73.230000000000004 110.042 175.604 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . 0.646 HD22 ' HA ' ' A' ' 22' ' ' LEU . 71.9 mt -61.94 -36.9 82.78 Favored 'General case' 0 N--CA 1.488 1.435 0 C-N-CA 123.135 0.574 . . . . 72.219999999999999 111.559 173.158 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 79' ' ' LYS . . . . . 0.607 ' HD2' ' HA ' ' A' ' 88' ' ' GLU . 33.7 mmtm -69.21 -47.64 64.26 Favored 'General case' 0 N--CA 1.473 0.723 0 N-CA-C 109.18 -0.674 . . . . 73.140000000000001 109.18 -177.634 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -64.68 -29.09 74.28 Favored Glycine 0 C--N 1.35 1.315 0 CA-C-N 115.283 -0.872 . . . . 61.43 112.731 175.782 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 2.6 tt -69.82 -40.39 75.95 Favored 'General case' 0 CA--C 1.547 0.854 0 C-N-CA 123.724 0.81 . . . . 73.439999999999998 109.321 177.418 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 93.1 mt -70.75 -64.77 0.84 Allowed 'General case' 0 C--N 1.352 0.699 0 N-CA-C 109.468 -0.567 . . . . 74.319999999999993 109.468 179.196 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 16.6 mm100 -142.09 -72.85 0.32 Allowed 'General case' 0 CA--C 1.548 0.876 0 C-N-CA 123.905 0.882 . . . . 75.099999999999994 109.509 -179.792 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 80.7 mt-30 -138.32 160.1 40.35 Favored 'General case' 0 N--CA 1.488 1.466 0 C-N-CA 123.886 0.874 . . . . 74.25 109.725 -171.257 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 85' ' ' ARG . . . . . . . . . . . . . 16.5 ptm180 -62.68 -14.91 49.3 Favored 'General case' 0 N--CA 1.491 1.59 0 N-CA-C 113.339 0.866 . . . . 73.129999999999995 113.339 -172.276 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 84.8 mt -107.92 -12.76 15.11 Favored 'General case' 0 N--CA 1.484 1.237 0 C-N-CA 123.215 0.606 . . . . 75.549999999999997 112.524 177.145 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 19.2 t70 -67.78 97.74 0.66 Allowed 'General case' 0 N--CA 1.489 1.479 0 C-N-CA 123.553 0.741 . . . . 75.140000000000001 109.445 179.322 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 88' ' ' GLU . . . . . 0.607 ' HA ' ' HD2' ' A' ' 79' ' ' LYS . 50.4 mt-10 -68.16 159.28 31.35 Favored 'General case' 0 N--CA 1.476 0.846 0 C-N-CA 124.135 0.974 . . . . 75.25 112.184 -170.227 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 83.6 mt -55.85 -45.87 78.35 Favored 'General case' 0 N--CA 1.484 1.233 0 N-CA-C 108.862 -0.792 . . . . 75.209999999999994 108.862 173.046 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 46.8 t -154.96 146.33 22.99 Favored 'General case' 0 C--O 1.248 0.978 0 CA-C-N 113.869 -1.514 . . . . 70.239999999999995 107.287 169.1 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 52.6 m -61.04 111.18 1.58 Allowed 'General case' 0 N--CA 1.48 1.072 0 C-N-CA 123.204 0.602 . . . . 71.540000000000006 111.75 -173.248 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 92' ' ' LEU . . . . . 0.475 HD22 HD22 ' A' ' 41' ' ' LEU . 81.0 mt -59.1 -66.01 0.57 Allowed 'General case' 0 N--CA 1.481 1.087 0 C-N-CA 124.104 0.962 . . . . 72.25 111.112 -174.381 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 59.5 mt -98.42 -34.23 4.49 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.884 0 C-N-CA 123.52 0.728 . . . . 74.420000000000002 109.444 175.239 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 140.31 -28.0 2.49 Favored Glycine 0 C--N 1.337 0.627 0 N-CA-C 110.281 -1.127 . . . . 74.230000000000004 110.281 -173.309 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 21.6 mp0 -98.74 146.84 25.48 Favored 'General case' 0 C--O 1.245 0.85 0 N-CA-C 107.649 -1.241 . . . . 75.530000000000001 107.649 173.765 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 52.8 p -72.08 83.08 0.98 Allowed 'General case' 0 CA--C 1.545 0.753 0 CA-C-O 121.804 0.811 . . . . 74.129999999999995 110.249 179.516 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 7.1 t -107.17 3.46 25.69 Favored 'General case' 0 CA--C 1.541 0.621 0 CA-C-N 115.058 -0.974 . . . . 72.209999999999994 111.425 -171.078 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 98' ' ' ARG . . . . . 0.462 ' HG2' HD12 ' A' ' 92' ' ' LEU . 0.0 OUTLIER -59.93 -61.97 2.22 Favored 'General case' 0 N--CA 1.482 1.131 0 CA-C-N 117.959 0.345 . . . . 71.420000000000002 110.432 -170.384 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 1.4 tm0? -72.68 -41.12 65.69 Favored 'General case' 0 N--CA 1.467 0.378 0 CA-C-N 115.541 -0.754 . . . . 73.209999999999994 109.799 -174.478 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 40.3 ttmt -63.28 -55.08 27.73 Favored 'General case' 0 C--N 1.348 0.539 0 O-C-N 123.754 0.659 . . . . 73.420000000000002 111.26 -175.1 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 33.7 t -75.14 -28.48 60.17 Favored 'General case' 0 N--CA 1.476 0.845 0 C-N-CA 123.357 0.663 . . . . 65.049999999999997 111.733 -174.939 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 10.5 tp -75.84 -35.57 59.91 Favored 'General case' 0 CA--C 1.549 0.937 0 CA-C-N 118.18 0.445 . . . . 75.129999999999995 110.657 178.526 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 5.0 t-20 -78.86 -26.48 44.04 Favored 'General case' 0 N--CA 1.481 1.089 0 C-N-CA 123.428 0.691 . . . . 74.329999999999998 110.248 176.58 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 104' ' ' ASN . . . . . 0.413 ' ND2' HH11 ' A' ' 108' ' ' ARG . 24.6 t-20 -67.53 -50.42 58.76 Favored 'General case' 0 N--CA 1.476 0.862 0 C-N-CA 123.927 0.891 . . . . 72.310000000000002 109.386 173.543 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 105' ' ' ALA . . . . . 0.447 ' O ' ' HB2' ' A' ' 109' ' ' LEU . . . -56.23 -46.62 79.47 Favored 'General case' 0 C--N 1.35 0.596 0 CA-C-N 115.096 -0.956 . . . . 75.209999999999994 110.244 175.959 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 106' ' ' TYR . . . . . . . . . . . . . 6.4 t80 -57.6 -43.06 84.41 Favored 'General case' 0 N--CA 1.478 0.931 0 C-N-CA 124.539 1.135 . . . . 74.049999999999997 110.705 176.215 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -62.33 -51.55 55.68 Favored Glycine 0 C--N 1.348 1.232 0 O-C-N 123.595 0.56 . . . . 72.409999999999997 113.094 -176.453 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 108' ' ' ARG . . . . . 0.413 HH11 ' ND2' ' A' ' 104' ' ' ASN . 0.0 OUTLIER -67.81 -33.13 74.2 Favored 'General case' 0 C--O 1.251 1.137 0 C-N-CA 122.548 0.339 . . . . 62.520000000000003 110.459 177.717 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 109' ' ' LEU . . . . . 0.738 ' HA ' ' HA ' ' A' ' 114' ' ' LEU . 4.6 tp -61.92 -55.1 33.07 Favored 'General case' 0 C--N 1.354 0.774 0 O-C-N 124.213 0.945 . . . . 73.519999999999996 110.596 -177.733 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 110' ' ' SER . . . . . 0.497 ' HA ' HE21 ' A' ' 61' ' ' GLN . 17.2 m -78.62 -18.05 55.1 Favored 'General case' 0 CA--C 1.542 0.65 0 CA-C-N 114.965 -1.016 . . . . 72.219999999999999 110.526 179.084 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . -73.01 -62.41 3.15 Favored Glycine 0 C--N 1.359 1.836 0 CA-C-O 118.571 -1.127 . . . . 73.439999999999998 114.74 -176.565 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 112' ' ' MET . . . . . 0.429 ' HG2' ' HA ' ' A' ' 119' ' ' PRO . 2.8 tmm? -94.5 -63.93 1.13 Allowed 'General case' 0 N--CA 1.503 2.213 0 CA-C-N 119.487 1.644 . . . . 74.319999999999993 111.162 -175.139 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 2.5 tm? 170.75 60.8 0.0 OUTLIER 'General case' 0 N--CA 1.48 1.041 0 N-CA-C 105.487 -2.042 . . . . 75.530000000000001 105.487 -177.649 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 114' ' ' LEU . . . . . 0.738 ' HA ' ' HA ' ' A' ' 109' ' ' LEU . 5.4 mp 66.92 -5.68 0.64 Allowed 'General case' 0 N--CA 1.475 0.82 0 CA-C-N 113.02 -1.9 . . . . 74.120000000000005 115.33 171.53 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 115' ' ' VAL . . . . . . . . . . . . . 27.5 m -78.54 144.53 65.65 Favored Pre-proline 0 CA--C 1.558 1.268 0 C-N-CA 123.538 0.735 . . . . 71.299999999999997 110.72 179.884 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 24.2 Cg_exo -65.05 -12.25 33.77 Favored 'Trans proline' 0 C--N 1.381 2.242 0 C-N-CA 122.927 2.418 . . . . 74.439999999999998 112.886 174.902 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 24.8 t70 -55.35 -30.81 61.02 Favored 'General case' 0 CA--C 1.55 0.97 0 C-N-CA 125.293 1.437 . . . . 65.230000000000004 113.246 -178.242 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . 77.79 156.43 0.15 Allowed Pre-proline 0 N--CA 1.493 1.716 0 C-N-CA 124.889 1.276 . . . . 71.030000000000001 111.636 -177.759 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 119' ' ' PRO . . . . . 0.429 ' HA ' ' HG2' ' A' ' 112' ' ' MET . 71.5 Cg_endo -73.91 30.83 0.32 Allowed 'Trans proline' 0 C--N 1.384 2.444 0 C-N-CA 122.96 2.44 . . . . 74.129999999999995 115.077 179.004 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . -71.31 -71.76 1.0 Allowed Glycine 0 C--N 1.348 1.21 0 N-CA-C 112.081 -0.408 . . . . 62.240000000000002 112.081 178.394 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . -93.02 80.16 4.57 Favored 'General case' 0 N--CA 1.478 0.95 0 C-N-CA 123.312 0.645 . . . . 73.519999999999996 110.109 178.498 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 122' ' ' SER . . . . . . . . . . . . . 39.6 m . . . . . 0 CA--C 1.558 1.275 0 CA-C-N 115.316 -0.856 . . . . 64.409999999999997 110.927 -179.39 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 20.2 ptt? . . . . . 0 N--CA 1.479 1.005 0 CA-C-O 121.293 0.568 . . . . 75.219999999999999 109.888 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 52.0 p -56.79 -33.12 66.35 Favored 'General case' 0 N--CA 1.482 1.16 0 C-N-CA 123.52 0.728 . . . . 63.450000000000003 111.971 -176.012 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 59.2 p -63.39 -43.41 97.65 Favored 'General case' 0 CA--C 1.549 0.92 0 C-N-CA 123.502 0.721 . . . . 74.219999999999999 110.995 175.098 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 27.6 m -69.63 -37.53 76.85 Favored 'General case' 0 N--CA 1.478 0.934 0 C-N-CA 123.581 0.752 . . . . 63.340000000000003 111.581 179.211 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 89.3 t -64.47 -47.16 90.52 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.819 0 C-N-CA 123.078 0.551 . . . . 72.340000000000003 109.858 179.664 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 16.7 mm-40 -60.26 -42.44 95.34 Favored 'General case' 0 C--O 1.218 -0.595 0 O-C-N 123.897 0.748 . . . . 64.329999999999998 110.563 173.495 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 7' ' ' PHE . . . . . 0.401 ' CZ ' HG21 ' A' ' 52' ' ' THR . 35.7 t80 -59.19 -53.51 57.46 Favored 'General case' 0 CA--C 1.546 0.805 0 C-N-CA 123.626 0.77 . . . . 74.519999999999996 111.181 -176.851 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 52.0 mt -63.04 -45.89 97.62 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.033 0 C-N-CA 123.184 0.594 . . . . 73.409999999999997 110.311 179.226 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 3.4 t-20 -63.49 -32.99 74.6 Favored 'General case' 0 N--CA 1.48 1.028 0 C-N-CA 123.615 0.766 . . . . 75.310000000000002 111.454 -176.398 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . 0.476 ' O ' HG13 ' A' ' 14' ' ' ILE . 94.7 mtt180 -79.59 -29.39 41.16 Favored 'General case' 0 C--O 1.214 -0.775 0 CA-C-N 115.828 -0.624 . . . . 73.340000000000003 110.5 177.202 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' TRP . . . . . . . . . . . . . 79.3 m95 -76.6 -19.71 57.55 Favored 'General case' 0 N--CA 1.479 1.004 0 CA-C-O 119.186 -0.435 . . . . 73.299999999999997 111.053 171.362 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 51.3 mt-30 -68.73 -48.87 62.7 Favored 'General case' 0 N--CA 1.481 1.102 0 N-CA-C 108.196 -1.038 . . . . 75.040000000000006 108.196 168.265 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . 0.473 ' HB3' ' O ' ' A' ' 10' ' ' ARG . 17.6 tpt180 -48.25 -52.33 21.63 Favored 'General case' 0 CA--C 1.554 1.1 0 C-N-CA 124.939 1.296 . . . . 75.430000000000007 110.997 173.771 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 14' ' ' ILE . . . . . 0.476 HG13 ' O ' ' A' ' 10' ' ' ARG . 74.7 mt -69.08 -48.35 69.97 Favored 'Isoleucine or valine' 0 CA--C 1.558 1.267 0 C-N-CA 123.774 0.83 . . . . 71.409999999999997 111.267 -177.053 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -60.66 -48.4 81.93 Favored 'General case' 0 N--CA 1.487 1.424 0 C-N-CA 123.562 0.745 . . . . 72.409999999999997 111.964 -177.328 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 95.4 mt -69.26 -44.29 72.2 Favored 'General case' 0 CA--C 1.539 0.544 0 CA-C-N 115.079 -0.964 . . . . 73.049999999999997 111.046 -177.074 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . 0.417 ' O ' ' HG ' ' A' ' 21' ' ' LEU . 42.3 mt -68.45 -32.41 72.41 Favored 'General case' 0 N--CA 1.482 1.171 0 CA-C-O 119.129 -0.463 . . . . 70.129999999999995 112.091 -179.502 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 78.7 p -68.38 -43.64 76.9 Favored 'General case' 0 N--CA 1.481 1.115 0 CA-C-N 118.181 0.446 . . . . 65.299999999999997 110.129 176.299 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 6.8 tp-100 -63.58 -37.56 87.77 Favored 'General case' 0 C--N 1.355 0.839 0 O-C-N 123.858 0.724 . . . . 74.109999999999999 110.789 176.841 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 52.5 m -62.52 -53.49 54.02 Favored 'General case' 0 C--N 1.348 0.542 0 CA-C-N 115.85 -0.614 . . . . 72.129999999999995 110.075 176.364 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . 0.544 HD22 ' HA ' ' A' ' 33' ' ' LEU . 57.9 mt -58.0 -35.6 71.46 Favored 'General case' 0 N--CA 1.477 0.916 0 O-C-N 123.833 0.708 . . . . 71.319999999999993 111.224 -178.569 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . 0.64 HD23 ' HA ' ' A' ' 74' ' ' ASN . 53.5 tp -65.83 -57.25 8.39 Favored 'General case' 0 N--CA 1.475 0.817 0 O-C-N 123.364 0.415 . . . . 75.329999999999998 111.152 178.914 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . 0.457 ' O ' ' HG3' ' A' ' 27' ' ' ARG . 43.6 mt-10 -57.21 -50.76 71.85 Favored 'General case' 0 N--CA 1.481 1.076 0 O-C-N 123.628 0.58 . . . . 75.400000000000006 110.297 -179.366 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . 0.446 HD23 ' HD2' ' A' ' 27' ' ' ARG . 95.0 mt -61.11 -33.49 73.45 Favored 'General case' 0 N--CA 1.474 0.768 0 C-N-CA 124.469 1.107 . . . . 74.310000000000002 111.735 -178.747 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . 0.484 ' HB3' HD23 ' A' ' 33' ' ' LEU . . . -61.62 -48.52 80.54 Favored 'General case' 0 N--CA 1.477 0.882 0 CA-C-O 120.957 0.408 . . . . 72.030000000000001 110.378 173.869 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 81.3 mt-30 -67.62 -22.43 65.34 Favored 'General case' 0 CA--C 1.551 0.99 0 CA-C-N 115.156 -0.929 . . . . 72.340000000000003 111.607 178.848 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . 0.457 ' HG3' ' O ' ' A' ' 23' ' ' GLU . 73.3 mtt180 -85.72 -6.76 59.08 Favored 'General case' 0 N--CA 1.482 1.145 0 C-N-CA 124.062 0.945 . . . . 73.120000000000005 112.012 177.86 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 81.78 8.16 87.13 Favored Glycine 0 C--N 1.352 1.469 0 N-CA-C 113.612 0.205 . . . . 72.439999999999998 113.612 -178.397 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 36.8 mm-40 -82.26 60.98 5.26 Favored 'General case' 0 CA--C 1.545 0.757 0 C-N-CA 124.571 1.148 . . . . 72.340000000000003 111.404 179.912 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 30' ' ' TRP . . . . . 0.469 ' O ' ' HG ' ' A' ' 34' ' ' LEU . 45.9 m95 -65.99 -29.06 69.38 Favored 'General case' 0 N--CA 1.481 1.106 0 C-N-CA 122.992 0.517 . . . . 72.209999999999994 110.819 -177.154 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 -62.02 -46.96 86.9 Favored 'General case' 0 N--CA 1.475 0.791 0 C-N-CA 123.522 0.729 . . . . 73.120000000000005 109.771 177.295 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . 0.414 ' HB3' HD11 ' A' ' 24' ' ' LEU . 61.1 mt -62.14 -28.77 69.88 Favored 'General case' 0 N--CA 1.476 0.873 0 C-N-CA 123.068 0.547 . . . . 74.340000000000003 111.385 176.722 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . 0.544 ' HA ' HD22 ' A' ' 21' ' ' LEU . 10.7 mp -68.86 -42.03 77.61 Favored 'General case' 0 C--N 1.357 0.897 0 CA-C-O 119.047 -0.501 . . . . 74.400000000000006 110.742 171.769 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . 0.469 ' HG ' ' O ' ' A' ' 30' ' ' TRP . 83.8 mt -64.18 -43.54 94.79 Favored 'General case' 0 N--CA 1.487 1.387 0 C-N-CA 123.558 0.743 . . . . 71.409999999999997 111.565 -177.847 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 1.4 mp0 -65.43 -57.78 7.47 Favored 'General case' 0 N--CA 1.478 0.958 0 C-N-CA 123.137 0.575 . . . . 75.329999999999998 110.471 177.777 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 84.6 mm-40 -74.14 -11.31 60.27 Favored 'General case' 0 N--CA 1.479 0.99 0 C-N-CA 123.502 0.721 . . . . 74.430000000000007 112.723 -175.378 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 35.2 tt0 -53.65 -54.74 33.44 Favored 'General case' 0 N--CA 1.487 1.399 0 C-N-CA 123.876 0.87 . . . . 75.329999999999998 110.485 172.742 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 57.4 t -59.99 -47.94 89.77 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.514 0 O-C-N 124.248 0.968 . . . . 75.430000000000007 110.177 -179.344 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 16.3 m -55.6 -57.31 12.48 Favored 'General case' 0 CA--C 1.548 0.884 0 C-N-CA 124.037 0.935 . . . . 75.319999999999993 111.498 -179.265 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 28.5 t80 -63.87 -52.02 61.89 Favored 'General case' 0 CA--C 1.54 0.57 0 C-N-CA 124.97 1.308 . . . . 71.129999999999995 112.069 -173.73 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . 0.453 HD22 HD23 ' A' ' 92' ' ' LEU . 96.3 mt -72.22 -39.37 68.59 Favored 'General case' 0 N--CA 1.468 0.471 0 CA-C-N 115.969 -0.56 . . . . 72.209999999999994 111.659 -172.605 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 29.1 tt0 -60.0 -42.74 94.92 Favored 'General case' 0 CA--C 1.546 0.824 0 N-CA-C 109.68 -0.489 . . . . 73.109999999999999 109.68 173.866 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 43' ' ' SER . . . . . 0.422 ' O ' HG21 ' A' ' 47' ' ' VAL . 69.5 m -58.21 -54.84 42.48 Favored 'General case' 0 N--CA 1.483 1.189 0 C-N-CA 123.169 0.588 . . . . 73.120000000000005 112.151 176.892 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 44' ' ' ILE . . . . . 0.447 HG22 ' HA ' ' A' ' 41' ' ' LEU . 16.3 tt -62.83 -41.84 94.11 Favored 'Isoleucine or valine' 0 C--O 1.25 1.11 0 O-C-N 123.632 0.582 . . . . 73.299999999999997 111.146 -171.947 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . 0.49 ' O ' ' HG3' ' A' ' 49' ' ' GLU . 16.0 mm-40 -58.86 -51.02 71.82 Favored 'General case' 0 C--N 1.356 0.859 0 CA-C-N 115.801 -0.636 . . . . 72.430000000000007 110.166 174.812 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 46' ' ' THR . . . . . 0.503 ' O ' ' HD3' ' A' ' 50' ' ' LYS . 93.8 m -58.0 -36.31 72.48 Favored 'General case' 0 CA--C 1.55 0.976 0 O-C-N 124.319 1.012 . . . . 72.439999999999998 112.403 -178.115 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 47' ' ' VAL . . . . . 0.422 HG21 ' O ' ' A' ' 43' ' ' SER . 87.7 t -68.0 -45.42 83.69 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.063 0 C-N-CA 122.58 0.352 . . . . 64.349999999999994 110.167 177.721 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 48' ' ' MET . . . . . 0.584 ' HE1' ' NH2' ' A' ' 98' ' ' ARG . 65.8 mtm -76.0 -14.41 60.23 Favored 'General case' 0 N--CA 1.486 1.358 0 N-CA-C 112.989 0.737 . . . . 73.219999999999999 112.989 -177.799 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . 0.49 ' HG3' ' O ' ' A' ' 45' ' ' GLU . 69.0 mt-10 -70.53 -35.51 73.21 Favored 'General case' 0 N--CA 1.484 1.259 0 CA-C-O 120.839 0.352 . . . . 72.450000000000003 111.063 172.988 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . 0.503 ' HD3' ' O ' ' A' ' 46' ' ' THR . 13.4 mptt -90.21 166.84 13.13 Favored 'General case' 0 N--CA 1.477 0.915 0 C-N-CA 123.8 0.84 . . . . 63.240000000000002 110.65 -173.801 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 20.4 pt20 -71.92 146.78 47.59 Favored 'General case' 0 C--O 1.243 0.756 0 CA-C-N 115.431 -0.804 . . . . 72.230000000000004 110.635 -179.613 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 52' ' ' THR . . . . . 0.479 HG22 HD11 ' A' ' 56' ' ' ILE . 39.5 m -83.98 122.81 76.13 Favored Pre-proline 0 CA--C 1.546 0.807 0 N-CA-C 108.559 -0.904 . . . . 72.519999999999996 108.559 171.477 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 22.9 Cg_endo -57.38 157.06 23.32 Favored 'Trans proline' 0 C--N 1.379 2.149 0 C-N-CA 123.02 2.48 . . . . 73.430000000000007 113.411 -177.104 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 20.5 Cg_exo -68.22 -48.13 1.38 Allowed 'Trans proline' 0 C--N 1.371 1.755 0 C-N-CA 122.647 2.231 . . . . 71.120000000000005 112.354 174.394 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . -74.71 76.64 1.15 Allowed Glycine 0 C--N 1.351 1.378 0 CA-C-N 115.701 -0.681 . . . . 63.409999999999997 113.549 -175.97 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 56' ' ' ILE . . . . . 0.65 ' O ' ' HB ' ' A' ' 60' ' ' ILE . 26.6 mt -106.15 -14.14 9.26 Favored 'Isoleucine or valine' 0 C--O 1.202 -1.444 0 C-N-CA 123.583 0.753 . . . . 73.510000000000005 110.453 -179.989 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 73.6 p 38.82 -178.18 0.0 OUTLIER 'General case' 0 N--CA 1.506 2.338 0 N-CA-C 114.931 1.456 . . . . 73.129999999999995 114.931 -173.734 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 13.8 tpt85 -73.95 -37.04 64.67 Favored 'General case' 0 N--CA 1.476 0.854 0 O-C-N 120.482 -1.386 . . . . 74.5 108.378 171.194 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 33.4 m -62.51 -55.46 27.28 Favored 'General case' 0 C--O 1.246 0.875 0 C-N-CA 124.282 1.033 . . . . 73.099999999999994 111.93 -178.211 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 60' ' ' ILE . . . . . 0.65 ' HB ' ' O ' ' A' ' 56' ' ' ILE . 66.9 mt -75.03 -27.57 20.07 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.916 0 N-CA-C 109.046 -0.724 . . . . 75.230000000000004 109.046 -176.928 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 60.9 tt0 -57.23 -45.63 83.72 Favored 'General case' 0 C--N 1.376 1.732 0 CA-C-N 118.31 0.505 . . . . 73.040000000000006 110.862 171.915 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 65.9 m-20 -66.65 -41.78 87.7 Favored 'General case' 0 N--CA 1.472 0.666 0 O-C-N 123.591 0.557 . . . . 74.099999999999994 111.325 178.686 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 63' ' ' MET . . . . . . . . . . . . . 63.5 mtm -63.61 -54.78 30.53 Favored 'General case' 0 N--CA 1.486 1.343 0 O-C-N 123.318 0.386 . . . . 73.409999999999997 111.775 -179.455 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 64' ' ' VAL . . . . . 0.423 ' O ' HG13 ' A' ' 68' ' ' ILE . 73.5 t -59.04 -52.39 61.25 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.841 0 C-N-CA 123.719 0.808 . . . . 71.219999999999999 111.38 176.673 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -64.46 -26.87 68.63 Favored 'General case' 0 N--CA 1.487 1.406 0 C-N-CA 122.534 0.333 . . . . 65.200000000000003 111.47 -179.836 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 66' ' ' GLY . . . . . 0.407 ' O ' ' HG3' ' A' ' 70' ' ' GLN . . . -68.1 -40.55 88.22 Favored Glycine 0 C--N 1.342 0.915 0 N-CA-C 111.296 -0.722 . . . . 73.400000000000006 111.296 174.357 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 67' ' ' TYR . . . . . 0.479 ' O ' HG22 ' A' ' 71' ' ' THR . 19.0 m-30 -67.06 -41.05 87.13 Favored 'General case' 0 N--CA 1.468 0.453 0 C-N-CA 123.533 0.733 . . . . 74.540000000000006 110.914 175.425 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 68' ' ' ILE . . . . . 0.566 ' O ' ' HG ' ' A' ' 72' ' ' LEU . 48.5 mt -61.09 -40.89 87.26 Favored 'Isoleucine or valine' 0 C--N 1.358 0.939 0 O-C-N 123.904 0.752 . . . . 65.420000000000002 109.001 174.665 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 69' ' ' LYS . . . . . 0.539 ' HE2' ' HA ' ' A' ' 69' ' ' LYS . 0.6 OUTLIER -58.72 -42.94 89.91 Favored 'General case' 0 N--CA 1.474 0.758 0 C-N-CA 123.305 0.642 . . . . 74.329999999999998 110.128 179.738 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 70' ' ' GLN . . . . . 0.407 ' HG3' ' O ' ' A' ' 66' ' ' GLY . 75.7 mt-30 -58.91 -45.92 89.18 Favored 'General case' 0 N--CA 1.476 0.84 0 O-C-N 124.176 0.922 . . . . 74.420000000000002 111.082 175.01 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 71' ' ' THR . . . . . 0.479 HG22 ' O ' ' A' ' 67' ' ' TYR . 10.0 p -60.59 -39.29 87.55 Favored 'General case' 0 N--CA 1.486 1.367 0 CA-C-O 120.862 0.363 . . . . 75.439999999999998 110.291 -178.63 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 72' ' ' LEU . . . . . 0.566 ' HG ' ' O ' ' A' ' 68' ' ' ILE . 52.7 mt -64.33 -54.59 30.7 Favored 'General case' 0 C--N 1.355 0.828 0 CA-C-N 115.144 -0.935 . . . . 74.430000000000007 109.812 -178.128 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 15.8 m-20 -58.7 -59.37 5.51 Favored 'General case' 0 N--CA 1.487 1.414 0 O-C-N 123.558 0.536 . . . . 74.140000000000001 111.243 178.542 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 74' ' ' ASN . . . . . 0.64 ' HA ' HD23 ' A' ' 22' ' ' LEU . 87.0 m-20 -56.71 -57.88 10.51 Favored 'General case' 0 N--CA 1.479 1.02 0 C-N-CA 124.471 1.108 . . . . 64.310000000000002 112.019 -173.59 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . 0.51 ' O ' ' HG2' ' A' ' 79' ' ' LYS . 61.8 tt0 -73.02 -29.25 62.87 Favored 'General case' 0 CA--C 1.545 0.78 0 CA-C-O 118.696 -0.668 . . . . 74.439999999999998 111.129 -172.694 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 7.0 tt0 -66.97 -38.43 86.07 Favored 'General case' 0 N--CA 1.491 1.578 0 CA-C-N 118.444 0.566 . . . . 70.439999999999998 110.763 173.536 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 92.6 mt -66.19 -30.56 71.05 Favored 'General case' 0 N--CA 1.471 0.583 0 N-CA-C 109.993 -0.373 . . . . 75.200000000000003 109.993 175.571 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . 0.592 HD21 ' HA ' ' A' ' 22' ' ' LEU . 85.3 mt -71.98 -35.01 69.37 Favored 'General case' 0 N--CA 1.479 1.019 0 C-N-CA 123.111 0.564 . . . . 75.409999999999997 111.912 170.437 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 79' ' ' LYS . . . . . 0.699 ' HD2' ' HA ' ' A' ' 86' ' ' LEU . 35.5 mmtm -60.7 -43.92 97.17 Favored 'General case' 0 N--CA 1.485 1.28 0 N-CA-C 109.19 -0.67 . . . . 74.430000000000007 109.19 174.997 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -75.23 -33.44 53.88 Favored Glycine 0 C--N 1.346 1.117 0 CA-C-N 114.674 -1.148 . . . . 52.329999999999998 113.643 -179.431 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 5.4 tt -73.24 -60.13 2.39 Favored 'General case' 0 N--CA 1.477 0.91 0 C-N-CA 123.367 0.667 . . . . 74.230000000000004 109.407 -178.247 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 74.3 mt -65.74 -49.4 68.56 Favored 'General case' 0 CA--C 1.544 0.738 0 CA-C-N 114.909 -1.041 . . . . 73.319999999999993 112.113 -171.018 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 19.5 tp60 -136.01 8.43 3.23 Favored 'General case' 0 N--CA 1.489 1.497 0 N-CA-C 112.705 0.632 . . . . 74.230000000000004 112.705 -169.845 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 23.8 mt-30 66.63 4.59 3.44 Favored 'General case' 0 N--CA 1.492 1.651 0 C-N-CA 124.412 1.085 . . . . 75.040000000000006 113.562 176.62 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 85' ' ' ARG . . . . . 0.608 ' HG3' ' H ' ' A' ' 86' ' ' LEU . 0.6 OUTLIER -167.17 -176.32 3.28 Favored 'General case' 0 CA--C 1.544 0.733 0 N-CA-C 109.007 -0.738 . . . . 71.349999999999994 109.007 -175.49 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 86' ' ' LEU . . . . . 0.699 ' HA ' ' HD2' ' A' ' 79' ' ' LYS . 72.9 mt -69.48 82.2 0.4 Allowed 'General case' 0 CA--C 1.55 0.951 0 C-N-CA 123.635 0.774 . . . . 72.019999999999996 112.813 -168.015 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 20.4 t70 -95.59 116.78 29.32 Favored 'General case' 0 C--O 1.24 0.573 0 C-N-CA 124.223 1.009 . . . . 75.150000000000006 109.031 174.475 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 33.4 mm-40 -85.48 11.94 9.48 Favored 'General case' 0 CA--C 1.544 0.712 0 C-N-CA 123.257 0.623 . . . . 64.129999999999995 112.457 -170.475 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 80.1 mt 56.7 -139.43 0.91 Allowed 'General case' 0 CA--C 1.558 1.278 0 C-N-CA 123.324 0.65 . . . . 73.230000000000004 110.154 -179.4 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 4.8 m -117.09 140.98 48.84 Favored 'General case' 0 N--CA 1.476 0.826 0 N-CA-C 109.108 -0.701 . . . . 64.430000000000007 109.108 173.524 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 34.7 t 77.68 41.09 0.14 Allowed 'General case' 0 N--CA 1.492 1.635 0 C-N-CA 125.066 1.346 . . . . 74.420000000000002 112.243 176.756 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 92' ' ' LEU . . . . . 0.478 HD22 HH12 ' A' ' 98' ' ' ARG . 33.0 mt -124.31 177.09 6.05 Favored 'General case' 0 N--CA 1.486 1.348 0 C-N-CA 123.792 0.837 . . . . 73.109999999999999 109.222 163.021 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 36.7 mt -68.71 145.52 13.38 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.943 0 C-N-CA 123.729 0.812 . . . . 72.219999999999999 109.617 176.473 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -64.64 138.63 40.41 Favored Glycine 0 C--N 1.348 1.2 0 O-C-N 123.551 0.532 . . . . 53.140000000000001 113.996 -175.881 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 6.9 tt0 61.56 88.19 0.09 Allowed 'General case' 0 CA--C 1.554 1.12 0 C-N-CA 125.127 1.371 . . . . 64.099999999999994 113.103 173.007 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 45.2 m 47.03 68.01 0.7 Allowed 'General case' 0 N--CA 1.486 1.337 0 C-N-CA 125.017 1.327 . . . . 71.340000000000003 114.114 163.922 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 12.0 t -96.48 -34.22 11.57 Favored 'General case' 0 N--CA 1.474 0.753 0 C-N-CA 122.49 0.316 . . . . 71.530000000000001 111.399 -177.25 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 98' ' ' ARG . . . . . 0.584 ' NH2' ' HE1' ' A' ' 48' ' ' MET . 0.2 OUTLIER -62.61 -51.16 68.4 Favored 'General case' 0 C--N 1.353 0.752 0 O-C-N 123.584 0.552 . . . . 75.010000000000005 112.488 -161.486 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 22.7 tp60 -55.66 -55.58 30.53 Favored 'General case' 0 CA--C 1.545 0.765 0 O-C-N 124.159 0.912 . . . . 75.420000000000002 111.157 -176.519 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 24.1 tptp -70.88 -51.84 23.82 Favored 'General case' 0 CA--C 1.54 0.58 0 CA-C-N 115.585 -0.734 . . . . 71.319999999999993 111.153 -171.573 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 40.6 t -69.05 -38.36 79.08 Favored 'General case' 0 N--CA 1.474 0.748 0 C-N-CA 123.698 0.799 . . . . 73.219999999999999 112.353 -173.236 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 13.9 tp -83.5 -33.63 25.5 Favored 'General case' 0 N--CA 1.476 0.86 0 C-N-CA 122.485 0.314 . . . . 64.239999999999995 110.866 -174.405 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 27.9 t-20 -69.09 -34.23 74.79 Favored 'General case' 0 N--CA 1.482 1.158 0 N-CA-C 110.109 -0.33 . . . . 72.5 110.109 171.723 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 104' ' ' ASN . . . . . 0.445 ' O ' ' HG2' ' A' ' 108' ' ' ARG . 27.4 t-20 -60.88 -46.19 91.6 Favored 'General case' 0 N--CA 1.478 0.957 0 C-N-CA 123.16 0.584 . . . . 75.150000000000006 109.479 171.671 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -57.09 -42.79 81.38 Favored 'General case' 0 N--CA 1.477 0.887 0 O-C-N 124.018 0.824 . . . . 51.219999999999999 111.24 178.841 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 106' ' ' TYR . . . . . . . . . . . . . 9.1 t80 -58.47 -51.56 69.34 Favored 'General case' 0 CA--C 1.547 0.848 0 O-C-N 123.737 0.648 . . . . 74.340000000000003 110.276 175.384 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -65.79 -38.59 94.54 Favored Glycine 0 C--N 1.353 1.521 0 O-C-N 123.909 0.755 . . . . 72.099999999999994 113.232 -174.568 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 108' ' ' ARG . . . . . 0.445 ' HG2' ' O ' ' A' ' 104' ' ' ASN . 21.3 mmt180 -70.2 -35.62 74.03 Favored 'General case' 0 C--N 1.348 0.526 0 C-N-CA 122.998 0.519 . . . . 74.040000000000006 109.62 179.248 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 109' ' ' LEU . . . . . 0.449 ' HA ' ' N ' ' A' ' 114' ' ' LEU . 53.2 tp -63.81 -52.69 59.07 Favored 'General case' 0 N--CA 1.48 1.058 0 C-N-CA 122.803 0.441 . . . . 74.420000000000002 110.216 175.782 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 16.2 t -62.91 -37.44 86.97 Favored 'General case' 0 CA--C 1.54 0.581 0 O-C-N 125.109 1.506 . . . . 71.239999999999995 111.03 -172.677 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . -91.05 -62.08 1.24 Allowed Glycine 0 C--N 1.35 1.326 0 CA-C-O 119.919 -0.378 . . . . 75.230000000000004 113.869 178.252 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 112' ' ' MET . . . . . . . . . . . . . 7.3 tpt -93.18 -65.81 0.97 Allowed 'General case' 0 N--CA 1.487 1.425 0 N-CA-C 113.167 0.802 . . . . 73.420000000000002 113.167 -168.213 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 113' ' ' LEU . . . . . 0.567 ' HB3' HG22 ' A' ' 115' ' ' VAL . 14.4 tp 168.08 16.75 0.0 OUTLIER 'General case' 0 N--CA 1.504 2.271 0 C-N-CA 124.336 1.055 . . . . 74.010000000000005 110.917 -173.911 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 114' ' ' LEU . . . . . 0.449 ' N ' ' HA ' ' A' ' 109' ' ' LEU . 0.7 OUTLIER 68.3 18.01 9.21 Favored 'General case' 0 N--CA 1.502 2.13 0 C-N-CA 125.158 1.383 . . . . 71.209999999999994 110.098 -171.633 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 115' ' ' VAL . . . . . 0.567 HG22 ' HB3' ' A' ' 113' ' ' LEU . 27.4 m -107.98 105.94 57.46 Favored Pre-proline 0 CA--C 1.557 1.242 0 N-CA-C 107.83 -1.174 . . . . 74.409999999999997 107.83 173.379 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 72.6 Cg_endo -80.8 88.86 1.35 Allowed 'Trans proline' 0 C--N 1.375 1.954 0 C-N-CA 122.336 2.024 . . . . 71.200000000000003 112.134 179.948 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 2.3 m-20 -66.34 -54.35 25.65 Favored 'General case' 0 N--CA 1.475 0.808 0 CA-C-N 114.995 -1.002 . . . . 72.310000000000002 110.322 174.94 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -155.95 134.91 7.68 Favored Pre-proline 0 CA--C 1.541 0.623 0 CA-C-N 114.854 -1.066 . . . . 64.109999999999999 109.662 -177.125 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 119' ' ' PRO . . . . . . . . . . . . . 49.3 Cg_exo -59.18 117.89 4.7 Favored 'Trans proline' 0 C--N 1.371 1.715 0 C-N-CA 122.583 2.189 . . . . 71.5 111.716 168.757 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . -79.11 -178.08 50.53 Favored Glycine 0 C--N 1.349 1.284 0 O-C-N 123.151 0.282 . . . . 62.140000000000001 113.2 179.955 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . -64.57 94.97 0.13 Allowed 'General case' 0 N--CA 1.478 0.945 0 C-N-CA 123.739 0.816 . . . . 75.319999999999993 111.574 -177.494 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 122' ' ' SER . . . . . . . . . . . . . 20.8 m . . . . . 0 C--O 1.248 0.983 0 C-N-CA 124.209 1.003 . . . . 73.310000000000002 109.269 176.23 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 23.4 ttt . . . . . 0 N--CA 1.48 1.027 0 CA-C-O 119.773 -0.156 . . . . 71.109999999999999 111.083 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 87.1 m -52.0 -49.16 63.85 Favored 'General case' 0 N--CA 1.484 1.228 0 C-N-CA 123.387 0.675 . . . . 73.310000000000002 111.865 -178.08 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 22.9 m -63.08 -35.37 80.04 Favored 'General case' 0 N--CA 1.471 0.596 0 C-N-CA 123.708 0.803 . . . . 55.520000000000003 111.479 -178.901 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 4' ' ' THR . . . . . 0.539 HG21 HD12 ' A' ' 60' ' ' ILE . 5.0 m -68.42 -47.9 66.06 Favored 'General case' 0 CA--C 1.544 0.732 0 C-N-CA 123.461 0.704 . . . . 71.150000000000006 110.875 179.37 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 76.5 t -65.23 -39.51 85.66 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.979 0 C-N-CA 123.595 0.758 . . . . 71.519999999999996 110.484 -178.2 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 39.0 mm-40 -59.73 -49.23 78.53 Favored 'General case' 0 C--N 1.35 0.615 0 C-N-CA 123.291 0.636 . . . . 72.540000000000006 110.218 172.479 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 29.3 t80 -59.35 -45.78 90.45 Favored 'General case' 0 CA--C 1.551 1.0 0 C-N-CA 124.296 1.038 . . . . 74.340000000000003 110.873 -176.188 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . 0.456 HD13 HG21 ' A' ' 60' ' ' ILE . 77.7 mt -66.8 -42.95 90.0 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.914 0 C-N-CA 123.943 0.897 . . . . 74.109999999999999 110.693 179.635 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 28.5 t-20 -66.64 -34.18 77.31 Favored 'General case' 0 N--CA 1.485 1.32 0 C-N-CA 123.531 0.732 . . . . 75.540000000000006 111.355 -178.16 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 75.9 mtt180 -68.57 -41.42 79.72 Favored 'General case' 0 CA--C 1.537 0.469 0 CA-C-N 115.601 -0.727 . . . . 74.430000000000007 109.383 174.521 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 11' ' ' TRP . . . . . 0.48 ' HH2' ' HG ' ' A' ' 102' ' ' LEU . 42.5 m95 -65.66 -29.26 69.8 Favored 'General case' 0 N--CA 1.477 0.884 0 O-C-N 123.458 0.474 . . . . 73.25 111.632 173.905 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 50.1 mt-30 -61.91 -50.08 73.61 Favored 'General case' 0 C--N 1.359 0.987 0 N-CA-C 108.568 -0.901 . . . . 73.219999999999999 108.568 172.506 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 14.6 tpt180 -57.67 -49.25 77.12 Favored 'General case' 0 CA--C 1.545 0.785 0 O-C-N 124.103 0.877 . . . . 74.319999999999993 111.411 -179.078 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 65.6 mt -63.59 -48.34 87.28 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.359 0 C-N-CA 123.427 0.691 . . . . 72.510000000000005 111.051 -177.897 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . 0.437 ' HB2' ' OE1' ' A' ' 70' ' ' GLN . . . -60.72 -47.79 84.69 Favored 'General case' 0 N--CA 1.478 0.934 0 C-N-CA 124.296 1.038 . . . . 72.129999999999995 111.412 -177.813 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 96.3 mt -74.69 -34.13 62.59 Favored 'General case' 0 N--CA 1.481 1.11 0 CA-C-N 114.756 -1.111 . . . . 75.0 111.452 -176.531 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . 0.48 ' O ' ' HG ' ' A' ' 21' ' ' LEU . 18.6 mt -63.95 -54.97 26.27 Favored 'General case' 0 C--N 1.36 1.058 0 N-CA-C 109.41 -0.589 . . . . 65.219999999999999 109.41 175.745 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 79.6 p -59.63 -35.38 74.28 Favored 'General case' 0 CA--C 1.544 0.749 0 O-C-N 123.894 0.746 . . . . 73.099999999999994 111.276 -178.568 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 6.2 tp-100 -62.29 -49.16 76.76 Favored 'General case' 0 N--CA 1.478 0.932 0 C-N-CA 123.503 0.721 . . . . 74.400000000000006 110.907 174.673 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 57.1 m -60.58 -43.21 97.57 Favored 'General case' 0 N--CA 1.472 0.665 0 C-N-CA 123.33 0.652 . . . . 54.009999999999998 110.444 177.023 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . 0.678 HD23 ' HA ' ' A' ' 33' ' ' LEU . 77.2 mt -68.75 -28.81 67.14 Favored 'General case' 0 C--N 1.346 0.415 0 C-N-CA 123.959 0.904 . . . . 74.450000000000003 110.288 -177.015 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . 0.581 ' HA ' HD23 ' A' ' 78' ' ' LEU . 35.8 tp -68.65 -51.26 43.9 Favored 'General case' 0 C--N 1.354 0.779 0 O-C-N 123.859 0.725 . . . . 62.520000000000003 109.652 175.928 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 76.2 mm-40 -51.87 -54.61 27.21 Favored 'General case' 0 N--CA 1.478 0.94 0 O-C-N 124.091 0.869 . . . . 74.219999999999999 110.526 175.799 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . 0.542 ' HB3' ' HB2' ' A' ' 29' ' ' GLU . 95.5 mt -64.2 -37.27 86.87 Favored 'General case' 0 CA--C 1.545 0.768 0 CA-C-N 114.505 -1.225 . . . . 74.219999999999999 111.46 -174.196 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . 0.557 ' HB3' HD23 ' A' ' 33' ' ' LEU . . . -66.7 -38.12 86.09 Favored 'General case' 0 N--CA 1.489 1.511 0 C-N-CA 122.837 0.455 . . . . 71.299999999999997 111.378 177.73 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 87.1 mt-30 -67.01 -26.76 66.95 Favored 'General case' 0 N--CA 1.478 0.96 0 C-N-CA 123.84 0.856 . . . . 71.329999999999998 110.833 175.481 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 59.2 mtt180 -88.51 -15.19 35.89 Favored 'General case' 0 N--CA 1.481 1.091 0 C-N-CA 124.025 0.93 . . . . 74.319999999999993 111.874 175.086 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 81.44 35.77 22.15 Favored Glycine 0 C--N 1.352 1.443 0 C-N-CA 123.01 0.338 . . . . 60.43 113.285 178.999 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . 0.542 ' HB2' ' HB3' ' A' ' 24' ' ' LEU . 13.6 mm-40 -97.83 59.89 1.48 Allowed 'General case' 0 CA--C 1.545 0.774 0 C-N-CA 124.806 1.243 . . . . 74.239999999999995 109.527 -177.551 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 30' ' ' TRP . . . . . . . . . . . . . 61.3 m95 -53.58 -38.71 64.17 Favored 'General case' 0 N--CA 1.485 1.319 0 C-N-CA 124.245 1.018 . . . . 71.519999999999996 112.028 -174.421 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 31' ' ' ASP . . . . . 0.427 ' O ' ' HG3' ' A' ' 35' ' ' GLN . 4.2 m-20 -58.0 -50.15 74.39 Favored 'General case' 0 N--CA 1.483 1.186 0 C-N-CA 123.743 0.817 . . . . 72.299999999999997 110.652 -179.272 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 95.7 mt -62.89 -31.52 72.58 Favored 'General case' 0 N--CA 1.479 0.993 0 C-N-CA 123.93 0.892 . . . . 74.230000000000004 111.755 -176.778 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . 0.678 ' HA ' HD23 ' A' ' 21' ' ' LEU . 11.2 mp -66.26 -45.78 79.35 Favored 'General case' 0 N--CA 1.478 0.956 0 C-N-CA 123.045 0.538 . . . . 75.329999999999998 110.54 173.131 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 81.1 mt -69.31 -24.77 63.98 Favored 'General case' 0 CA--C 1.548 0.897 0 CA-C-N 115.84 -0.618 . . . . 75.530000000000001 111.712 179.43 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 35' ' ' GLN . . . . . 0.427 ' HG3' ' O ' ' A' ' 31' ' ' ASP . 95.1 mt-30 -77.84 -32.42 52.13 Favored 'General case' 0 N--CA 1.474 0.752 0 C-N-CA 122.822 0.449 . . . . 74.329999999999998 111.24 178.067 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 36' ' ' GLN . . . . . 0.555 ' HB2' HD21 ' A' ' 21' ' ' LEU . 87.0 mm-40 -90.67 -14.63 31.89 Favored 'General case' 0 N--CA 1.483 1.183 0 C-N-CA 123.101 0.56 . . . . 74.510000000000005 112.37 174.746 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 42.2 tt0 -47.83 -56.37 7.62 Favored 'General case' 0 N--CA 1.488 1.462 0 C-N-CA 124.104 0.962 . . . . 71.400000000000006 112.871 -176.998 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 91.9 t -60.88 -43.9 96.65 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.869 0 C-N-CA 123.057 0.543 . . . . 74.450000000000003 111.684 -175.3 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 44.7 p -68.47 -34.75 76.49 Favored 'General case' 0 N--CA 1.473 0.723 0 C-N-CA 122.903 0.481 . . . . 65.450000000000003 111.148 -178.725 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 66.2 t80 -69.02 -51.74 35.93 Favored 'General case' 0 CA--C 1.541 0.61 0 C-N-CA 123.707 0.803 . . . . 75.200000000000003 110.027 -179.478 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 72.7 mt -63.73 -43.46 96.45 Favored 'General case' 0 N--CA 1.473 0.71 0 O-C-N 124.254 0.972 . . . . 71.209999999999994 110.834 -179.284 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 53.3 tt0 -67.57 -45.81 74.52 Favored 'General case' 0 N--CA 1.476 0.837 0 C-N-CA 123.027 0.531 . . . . 75.010000000000005 111.102 -176.903 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 43' ' ' SER . . . . . 0.48 ' O ' HG21 ' A' ' 47' ' ' VAL . 68.7 m -65.74 -42.43 90.98 Favored 'General case' 0 N--CA 1.474 0.757 0 O-C-N 123.312 0.383 . . . . 61.439999999999998 111.457 -178.941 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 15.7 tt -69.45 -35.74 68.25 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.019 0 O-C-N 123.077 0.235 . . . . 75.109999999999999 110.704 -178.147 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 9.6 mm-40 -59.12 -44.91 92.03 Favored 'General case' 0 C--N 1.359 1.019 0 C-N-CA 123.428 0.691 . . . . 73.5 110.527 171.726 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 90.0 m -58.61 -45.3 89.47 Favored 'General case' 0 CA--C 1.544 0.738 0 O-C-N 124.277 0.986 . . . . 74.129999999999995 111.261 178.604 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 47' ' ' VAL . . . . . 0.48 HG21 ' O ' ' A' ' 43' ' ' SER . 57.8 t -64.04 -47.85 88.53 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.172 0 C-N-CA 123.108 0.563 . . . . 73.019999999999996 111.443 -178.468 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 48' ' ' MET . . . . . 0.484 ' HE2' HD13 ' A' ' 92' ' ' LEU . 73.6 mtm -73.51 -24.02 60.1 Favored 'General case' 0 N--CA 1.48 1.034 0 CA-C-N 115.95 -0.568 . . . . 73.230000000000004 111.642 -177.397 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 9.8 tp10 -82.16 -35.33 28.52 Favored 'General case' 0 N--CA 1.475 0.777 0 C-N-CA 122.847 0.459 . . . . 72.510000000000005 110.396 178.169 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 12.3 mptt -84.62 151.46 24.48 Favored 'General case' 0 N--CA 1.479 0.991 0 C-N-CA 123.475 0.71 . . . . 72.239999999999995 110.874 -176.971 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 8.7 tt0 -76.23 132.9 40.18 Favored 'General case' 0 CA--C 1.543 0.707 0 CA-C-N 114.76 -1.109 . . . . 65.439999999999998 110.921 -175.131 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 24.1 m -74.46 125.65 89.58 Favored Pre-proline 0 CA--C 1.551 0.989 0 C-N-CA 123.712 0.805 . . . . 72.420000000000002 109.079 170.314 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 73.7 Cg_endo -72.45 152.05 54.19 Favored 'Trans proline' 0 C--N 1.373 1.864 0 C-N-CA 122.075 1.85 . . . . 75.129999999999995 112.777 -178.903 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 54' ' ' PRO . . . . . 0.542 ' HA ' HG21 ' A' ' 115' ' ' VAL . 52.8 Cg_exo -58.72 -44.94 32.43 Favored 'Trans proline' 0 C--N 1.378 2.099 0 C-N-CA 123.716 2.944 . . . . 74.209999999999994 113.583 176.427 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . -63.83 80.38 0.05 OUTLIER Glycine 0 C--N 1.351 1.409 0 O-C-N 124.342 1.027 . . . . 61.299999999999997 114.117 -176.849 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 72.5 mt -130.49 111.61 21.08 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.673 0 C-N-CA 124.804 1.242 . . . . 72.510000000000005 108.752 178.522 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 57' ' ' THR . . . . . 0.426 ' H ' HD13 ' A' ' 60' ' ' ILE . 74.2 p -80.23 175.14 10.91 Favored 'General case' 0 N--CA 1.471 0.577 0 C-N-CA 123.47 0.708 . . . . 75.209999999999994 109.454 172.544 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 26.3 tpt180 -63.94 -38.96 93.01 Favored 'General case' 0 CA--C 1.541 0.622 0 CA-C-O 119.428 -0.32 . . . . 72.530000000000001 110.398 177.538 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 21.9 m -59.41 -47.39 85.62 Favored 'General case' 0 CA--C 1.548 0.889 0 C-N-CA 122.987 0.515 . . . . 71.219999999999999 110.854 178.252 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 60' ' ' ILE . . . . . 0.539 HD12 HG21 ' A' ' 4' ' ' THR . 93.5 mt -61.09 -42.17 92.18 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.149 0 C-N-CA 123.623 0.769 . . . . 63.409999999999997 110.372 176.159 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 64.4 tt0 -62.54 -38.7 91.01 Favored 'General case' 0 CA--C 1.547 0.837 0 C-N-CA 124.024 0.929 . . . . 73.430000000000007 111.092 -179.171 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 63.9 m-20 -67.68 -43.52 80.0 Favored 'General case' 0 N--CA 1.48 1.028 0 C-N-CA 123.433 0.693 . . . . 73.140000000000001 110.79 177.686 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 63' ' ' MET . . . . . . . . . . . . . 72.3 mtm -64.46 -52.39 58.23 Favored 'General case' 0 N--CA 1.48 1.054 0 O-C-N 123.72 0.638 . . . . 73.209999999999994 111.447 -178.356 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 64' ' ' VAL . . . . . 0.461 ' O ' HG13 ' A' ' 68' ' ' ILE . 92.4 t -60.71 -50.42 80.53 Favored 'Isoleucine or valine' 0 C--N 1.353 0.739 0 C-N-CA 123.71 0.804 . . . . 74.439999999999998 110.372 -179.747 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -61.91 -36.5 81.52 Favored 'General case' 0 N--CA 1.484 1.231 0 O-C-N 123.432 0.457 . . . . 72.310000000000002 111.327 179.78 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -64.25 -38.81 96.41 Favored Glycine 0 C--N 1.345 1.038 0 O-C-N 123.73 0.644 . . . . 54.439999999999998 112.402 178.41 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 67' ' ' TYR . . . . . 0.512 ' O ' HG21 ' A' ' 71' ' ' THR . 17.9 m-30 -72.58 -42.32 64.71 Favored 'General case' 0 N--CA 1.471 0.577 0 C-N-CA 123.277 0.631 . . . . 74.349999999999994 111.452 179.371 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 68' ' ' ILE . . . . . 0.51 ' O ' ' HG ' ' A' ' 72' ' ' LEU . 68.0 mt -56.49 -52.22 55.52 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.112 0 N-CA-C 108.652 -0.87 . . . . 75.510000000000005 108.652 175.207 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 69' ' ' LYS . . . . . 0.561 ' HB2' ' HE2' ' A' ' 106' ' ' TYR . 13.5 tmtt? -53.35 -45.8 69.3 Favored 'General case' 0 N--CA 1.476 0.842 0 C-N-CA 125.25 1.42 . . . . 75.140000000000001 110.345 179.125 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 70' ' ' GLN . . . . . 0.437 ' OE1' ' HB2' ' A' ' 15' ' ' ALA . 61.4 tt0 -61.39 -49.1 78.25 Favored 'General case' 0 C--N 1.349 0.557 0 CA-C-N 115.428 -0.806 . . . . 75.319999999999993 111.328 -176.158 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 71' ' ' THR . . . . . 0.512 HG21 ' O ' ' A' ' 67' ' ' TYR . 1.0 OUTLIER -73.18 -23.59 60.44 Favored 'General case' 0 N--CA 1.474 0.736 0 CA-C-O 119.469 -0.3 . . . . 64.150000000000006 110.874 -178.871 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 72' ' ' LEU . . . . . 0.51 ' HG ' ' O ' ' A' ' 68' ' ' ILE . 37.4 mt -61.21 -55.61 30.2 Favored 'General case' 0 C--N 1.363 1.16 0 N-CA-C 108.878 -0.786 . . . . 73.219999999999999 108.878 173.175 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 73' ' ' ASP . . . . . 0.414 ' O ' ' HG ' ' A' ' 77' ' ' LEU . 4.5 m-20 -55.09 -61.89 2.02 Favored 'General case' 0 N--CA 1.482 1.133 0 O-C-N 124.505 1.128 . . . . 75.319999999999993 111.001 177.373 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 74' ' ' ASN . . . . . 0.533 ' HA ' HD22 ' A' ' 22' ' ' LEU . 83.0 m-20 -53.5 -54.7 33.41 Favored 'General case' 0 N--CA 1.478 0.933 0 O-C-N 124.506 1.129 . . . . 74.510000000000005 112.294 -172.292 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . 0.419 ' HG2' ' HZ2' ' A' ' 79' ' ' LYS . 5.4 tt0 -73.03 -32.77 65.31 Favored 'General case' 0 CA--C 1.547 0.832 0 O-C-N 123.211 0.32 . . . . 72.430000000000007 111.516 -174.634 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 9.0 tt0 -64.9 -37.15 86.69 Favored 'General case' 0 N--CA 1.484 1.266 0 CA-C-O 120.764 0.316 . . . . 73.329999999999998 110.197 175.43 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . 0.414 ' HG ' ' O ' ' A' ' 73' ' ' ASP . 96.8 mt -68.72 -34.92 76.45 Favored 'General case' 0 CA--C 1.539 0.539 0 CA-C-N 116.057 -0.52 . . . . 72.230000000000004 110.198 176.142 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . 0.581 HD23 ' HA ' ' A' ' 22' ' ' LEU . 57.3 mt -61.04 -39.88 91.47 Favored 'General case' 0 N--CA 1.483 1.193 0 C-N-CA 122.89 0.476 . . . . 74.349999999999994 111.03 171.675 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 79' ' ' LYS . . . . . 0.528 ' HD2' ' HA ' ' A' ' 86' ' ' LEU . 48.8 mmtm -65.01 -45.57 84.97 Favored 'General case' 0 C--O 1.22 -0.449 0 CA-C-N 116.416 -0.356 . . . . 74.019999999999996 110.334 178.224 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -71.32 -25.24 75.83 Favored Glycine 0 CA--C 1.531 1.081 0 O-C-N 124.104 0.877 . . . . 74.150000000000006 113.851 -179.294 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 6.4 tt -86.05 -64.26 1.18 Allowed 'General case' 0 N--CA 1.48 1.052 0 C-N-CA 123.312 0.645 . . . . 73.219999999999999 109.613 -178.002 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 25.6 mt -69.38 -48.87 59.87 Favored 'General case' 0 N--CA 1.479 1.008 0 C-N-CA 123.914 0.885 . . . . 73.340000000000003 112.167 -168.511 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 15.5 mm-40 -120.86 -2.43 9.79 Favored 'General case' 0 N--CA 1.488 1.457 0 N-CA-C 112.809 0.67 . . . . 70.439999999999998 112.809 -174.496 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 7.8 tt0 65.39 11.7 7.55 Favored 'General case' 0 CA--C 1.566 1.585 0 C-N-CA 124.796 1.238 . . . . 74.219999999999999 112.076 179.89 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 85' ' ' ARG . . . . . . . . . . . . . 48.7 ttt180 -175.05 162.93 3.13 Favored 'General case' 0 N--CA 1.486 1.336 0 C-N-CA 124.21 1.004 . . . . 75.540000000000006 109.762 -173.897 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 86' ' ' LEU . . . . . 0.528 ' HA ' ' HD2' ' A' ' 79' ' ' LYS . 92.0 mt -55.42 115.51 2.33 Favored 'General case' 0 C--N 1.358 0.948 0 C-N-CA 123.699 0.799 . . . . 75.230000000000004 109.916 166.255 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 35.0 t70 -154.39 -76.88 0.11 Allowed 'General case' 0 CA--C 1.543 0.675 0 N-CA-C 109.701 -0.481 . . . . 73.5 109.701 -177.133 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 48.2 mt-10 -112.96 167.42 10.53 Favored 'General case' 0 N--CA 1.485 1.298 0 C-N-CA 123.455 0.702 . . . . 75.310000000000002 111.102 178.745 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 87.3 mt 62.65 38.15 12.34 Favored 'General case' 0 N--CA 1.486 1.347 0 C-N-CA 125.119 1.368 . . . . 61.409999999999997 110.143 -168.326 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 32.3 p -159.41 15.1 0.15 Allowed 'General case' 0 N--CA 1.481 1.117 0 CA-C-N 115.58 -0.737 . . . . 71.040000000000006 112.029 -179.827 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 67.6 p -77.64 78.29 4.15 Favored 'General case' 0 CA--C 1.547 0.844 0 CA-C-O 121.757 0.789 . . . . 74.209999999999994 109.48 177.33 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 92' ' ' LEU . . . . . 0.484 HD13 ' HE2' ' A' ' 48' ' ' MET . 75.7 mt -87.95 -81.2 0.25 Allowed 'General case' 0 CA--C 1.54 0.582 0 CA-C-N 114.961 -1.018 . . . . 72.5 110.852 -175.277 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 62.6 mt -90.05 -40.01 12.57 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.69 0 N-CA-C 108.259 -1.015 . . . . 74.319999999999993 108.259 174.161 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 178.92 -56.67 0.09 OUTLIER Glycine 0 C--N 1.345 1.032 0 CA-C-N 114.446 -1.252 . . . . 75.329999999999998 110.176 177.037 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 13.8 pt20 -81.27 175.32 10.7 Favored 'General case' 0 C--O 1.244 0.784 0 C-N-CA 123.626 0.77 . . . . 73.120000000000005 110.764 176.811 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 35.0 p -83.99 51.67 2.11 Favored 'General case' 0 CA--C 1.552 1.042 0 C-N-CA 124.369 1.067 . . . . 73.420000000000002 110.666 177.937 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 15.2 t -67.56 -9.76 45.62 Favored 'General case' 0 N--CA 1.479 1.01 0 C-N-CA 124.189 0.996 . . . . 70.549999999999997 112.837 -174.325 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 98' ' ' ARG . . . . . 0.587 HH11 HD23 ' A' ' 102' ' ' LEU . 2.0 tmm_? -51.28 -50.34 59.47 Favored 'General case' 0 N--CA 1.479 1.003 0 C-N-CA 125.265 1.426 . . . . 74.409999999999997 111.506 -176.439 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 24.7 tm0? -57.26 -53.3 59.71 Favored 'General case' 0 N--CA 1.474 0.752 0 C-N-CA 124.025 0.93 . . . . 74.430000000000007 110.053 -176.887 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 61.5 tttp -65.02 -49.16 71.25 Favored 'General case' 0 C--O 1.218 -0.567 0 O-C-N 124.016 0.823 . . . . 74.299999999999997 111.425 -176.589 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 51.1 m -60.27 -43.98 95.72 Favored 'General case' 0 CA--C 1.542 0.649 0 C-N-CA 123.587 0.755 . . . . 72.329999999999998 111.584 -173.877 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 102' ' ' LEU . . . . . 0.587 HD23 HH11 ' A' ' 98' ' ' ARG . 10.8 mp -78.45 -35.64 46.48 Favored 'General case' 0 N--CA 1.48 1.026 0 N-CA-C 112.306 0.484 . . . . 71.209999999999994 112.306 -179.08 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 26.9 t-20 -69.41 -37.84 77.65 Favored 'General case' 0 N--CA 1.484 1.254 0 CA-C-O 121.035 0.445 . . . . 63.450000000000003 110.392 179.727 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -73.72 -36.51 65.21 Favored 'General case' 0 N--CA 1.47 0.561 0 CA-C-N 115.615 -0.721 . . . . 74.239999999999995 109.164 176.768 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -61.56 -36.76 81.53 Favored 'General case' 0 C--N 1.358 0.937 0 O-C-N 123.605 0.566 . . . . 73.530000000000001 110.892 173.715 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 106' ' ' TYR . . . . . 0.561 ' HE2' ' HB2' ' A' ' 69' ' ' LYS . 2.3 t80 -67.45 -42.03 83.75 Favored 'General case' 0 CA--C 1.541 0.614 0 N-CA-C 108.964 -0.754 . . . . 73.420000000000002 108.964 176.762 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -67.01 -31.79 78.97 Favored Glycine 0 CA--C 1.535 1.283 0 O-C-N 123.59 0.556 . . . . 54.240000000000002 113.449 177.809 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 52.6 mtp180 -71.7 -41.59 68.43 Favored 'General case' 0 N--CA 1.474 0.759 0 C-N-CA 123.694 0.798 . . . . 75.25 109.643 176.668 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 34.8 tp -66.73 -46.59 75.01 Favored 'General case' 0 C--N 1.351 0.635 0 O-C-N 124.248 0.968 . . . . 71.150000000000006 110.021 -179.471 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 33.8 t -66.07 -36.16 82.45 Favored 'General case' 0 CA--C 1.536 0.439 0 C-N-CA 124.221 1.008 . . . . 73.519999999999996 110.548 177.556 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . -77.84 -66.18 1.8 Allowed Glycine 0 C--N 1.36 1.878 0 C-N-CA 120.692 -0.766 . . . . 73.5 112.702 -176.728 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 112' ' ' MET . . . . . . . . . . . . . 41.7 mmm -99.13 -72.89 0.64 Allowed 'General case' 0 N--CA 1.481 1.101 0 CA-C-N 118.315 1.057 . . . . 72.319999999999993 111.647 172.524 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER 171.4 33.27 0.0 OUTLIER 'General case' 0 N--CA 1.487 1.415 0 C-N-CA 125.85 1.66 . . . . 75.549999999999997 109.666 -178.66 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 11.5 tp 75.76 -10.99 1.18 Allowed 'General case' 0 N--CA 1.491 1.604 0 C-N-CA 125.242 1.417 . . . . 73.209999999999994 113.941 170.011 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 115' ' ' VAL . . . . . 0.542 HG21 ' HA ' ' A' ' 54' ' ' PRO . 60.8 t -73.49 -55.7 3.42 Favored Pre-proline 0 N--CA 1.486 1.368 0 CA-C-O 118.555 -0.736 . . . . 74.540000000000006 110.246 -177.347 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 116' ' ' PRO . . . . . 0.416 ' HD3' ' HB ' ' A' ' 115' ' ' VAL . 89.0 Cg_endo -85.67 161.57 10.75 Favored 'Trans proline' 0 C--N 1.38 2.207 0 CA-C-N 120.911 1.361 . . . . 65.329999999999998 111.225 169.925 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 5.3 p-10 -79.9 -30.16 40.02 Favored 'General case' 0 N--CA 1.475 0.803 0 CA-C-N 116.136 -0.484 . . . . 74.409999999999997 109.988 176.42 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -74.31 143.75 80.32 Favored Pre-proline 0 CA--C 1.552 1.027 0 C-N-CA 123.518 0.727 . . . . 70.230000000000004 110.524 176.919 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 119' ' ' PRO . . . . . . . . . . . . . 84.8 Cg_endo -76.87 -179.23 5.19 Favored 'Trans proline' 0 C--N 1.374 1.911 0 C-N-CA 122.714 2.276 . . . . 71.439999999999998 111.879 176.268 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . -174.01 -126.84 0.95 Allowed Glycine 0 C--N 1.336 0.565 0 N-CA-C 110.325 -1.11 . . . . 62.219999999999999 110.325 -178.97 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . -159.77 145.65 15.79 Favored 'General case' 0 N--CA 1.477 0.903 0 C-N-CA 123.541 0.736 . . . . 74.109999999999999 109.508 174.892 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 122' ' ' SER . . . . . . . . . . . . . 40.3 t . . . . . 0 CA--C 1.546 0.798 0 N-CA-C 107.957 -1.127 . . . . 75.109999999999999 107.957 -178.058 . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 25.0 ptm . . . . . 0 N--CA 1.485 1.28 0 N-CA-C 111.936 0.347 . . . . 71.420000000000002 111.936 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 28.6 m -62.69 -40.19 96.36 Favored 'General case' 0 N--CA 1.482 1.127 0 C-N-CA 122.931 0.492 . . . . 74.200000000000003 111.531 -176.111 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 14.3 m -65.59 -35.99 82.44 Favored 'General case' 0 N--CA 1.476 0.871 0 C-N-CA 122.964 0.505 . . . . 75.010000000000005 110.467 176.331 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 4' ' ' THR . . . . . 0.543 ' HA ' ' HG2' ' A' ' 53' ' ' PRO . 33.5 m -66.4 -50.0 64.93 Favored 'General case' 0 C--N 1.361 1.086 0 C-N-CA 123.602 0.761 . . . . 74.099999999999994 111.3 179.241 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 59.0 t -60.45 -40.02 82.91 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.084 0 C-N-CA 123.401 0.68 . . . . 74.019999999999996 110.022 179.173 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . 0.475 ' O ' ' HG3' ' A' ' 10' ' ' ARG . 0.2 OUTLIER -63.68 -41.42 98.15 Favored 'General case' 0 CA--C 1.548 0.895 0 CA-C-N 115.326 -0.852 . . . . 75.299999999999997 110.293 176.823 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 7' ' ' PHE . . . . . 0.584 ' HD1' HH11 ' A' ' 10' ' ' ARG . 39.4 t80 -69.44 -40.71 77.04 Favored 'General case' 0 N--CA 1.483 1.198 0 C-N-CA 123.968 0.907 . . . . 73.230000000000004 111.316 -176.665 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . 0.459 ' O ' ' HG3' ' A' ' 12' ' ' GLN . 76.7 mt -60.73 -42.48 92.26 Favored 'Isoleucine or valine' 0 C--N 1.353 0.733 0 N-CA-C 108.593 -0.892 . . . . 73.209999999999994 108.593 172.863 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 3.3 t-20 -66.46 -27.62 67.95 Favored 'General case' 0 N--CA 1.475 0.823 0 O-C-N 124.354 1.034 . . . . 75.230000000000004 111.426 -179.835 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . 0.648 ' HB3' HG23 ' A' ' 47' ' ' VAL . 53.8 mtt180 -71.36 -39.02 71.54 Favored 'General case' 0 N--CA 1.475 0.802 0 C-N-CA 123.442 0.697 . . . . 74.230000000000004 110.764 174.465 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 11' ' ' TRP . . . . . 0.441 ' CD1' HG13 ' A' ' 64' ' ' VAL . 92.1 m95 -75.17 -24.18 57.84 Favored 'General case' 0 N--CA 1.477 0.875 0 CA-C-N 116.25 -0.432 . . . . 73.099999999999994 111.654 173.871 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . 0.491 ' HG2' ' CE2' ' A' ' 67' ' ' TYR . 55.7 mt-30 -68.59 -39.74 80.81 Favored 'General case' 0 N--CA 1.473 0.692 0 N-CA-C 108.743 -0.836 . . . . 74.129999999999995 108.743 170.11 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 22.4 tpt180 -60.19 -53.51 56.84 Favored 'General case' 0 CA--C 1.545 0.759 0 C-N-CA 124.174 0.99 . . . . 75.209999999999994 110.658 178.748 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 14' ' ' ILE . . . . . 0.459 HG21 ' OG1' ' A' ' 71' ' ' THR . 49.1 mt -66.32 -42.74 91.22 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.006 0 O-C-N 123.338 0.399 . . . . 75.340000000000003 110.45 -178.466 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . 0.651 ' HA ' ' HB ' ' A' ' 71' ' ' THR . . . -60.34 -48.04 83.46 Favored 'General case' 0 N--CA 1.486 1.337 0 C-N-CA 123.249 0.619 . . . . 72.219999999999999 112.1 -178.776 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 92.1 mt -70.11 -44.36 69.14 Favored 'General case' 0 N--CA 1.481 1.098 0 O-C-N 124.304 1.003 . . . . 72.319999999999993 110.856 -175.985 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . 0.483 ' O ' ' HG ' ' A' ' 21' ' ' LEU . 49.3 mt -62.62 -53.43 54.68 Favored 'General case' 0 C--N 1.354 0.799 0 O-C-N 123.606 0.566 . . . . 72.219999999999999 110.527 179.982 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 94.9 p -60.8 -37.84 83.31 Favored 'General case' 0 N--CA 1.479 0.975 0 C-N-CA 123.338 0.655 . . . . 72.200000000000003 111.432 -178.51 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 6.9 tp-100 -62.65 -48.11 80.78 Favored 'General case' 0 C--N 1.36 1.025 0 O-C-N 123.939 0.775 . . . . 72.150000000000006 110.348 177.699 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 65.2 m -58.91 -49.04 79.29 Favored 'General case' 0 C--O 1.213 -0.855 0 O-C-N 123.944 0.777 . . . . 41.399999999999999 110.3 176.405 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . 0.568 HD21 ' HA ' ' A' ' 33' ' ' LEU . 79.7 mt -64.43 -31.33 72.5 Favored 'General case' 0 N--CA 1.475 0.807 0 C-N-CA 123.93 0.892 . . . . 75.049999999999997 111.28 -176.471 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . 0.591 ' HA ' HD23 ' A' ' 78' ' ' LEU . 69.9 tp -67.42 -55.42 13.74 Favored 'General case' 0 C--N 1.353 0.738 0 C-N-CA 123.191 0.596 . . . . 73.349999999999994 109.766 176.996 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 45.5 mt-10 -55.05 -50.69 68.47 Favored 'General case' 0 C--N 1.352 0.689 0 O-C-N 124.635 1.209 . . . . 70.299999999999997 110.549 179.933 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . 0.471 ' HB3' ' HB2' ' A' ' 29' ' ' GLU . 93.7 mt -63.38 -36.22 82.98 Favored 'General case' 0 CA--C 1.544 0.736 0 C-N-CA 124.508 1.123 . . . . 71.329999999999998 111.251 -177.46 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -63.9 -41.16 97.77 Favored 'General case' 0 N--CA 1.485 1.277 0 C-N-CA 122.87 0.468 . . . . 73.239999999999995 111.279 174.948 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 86.3 mt-30 -71.41 -23.38 61.86 Favored 'General case' 0 N--CA 1.483 1.195 0 C-N-CA 123.892 0.877 . . . . 73.319999999999993 111.289 177.958 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 89.0 mtt180 -91.98 -11.59 35.66 Favored 'General case' 0 N--CA 1.481 1.113 0 C-N-CA 123.943 0.897 . . . . 75.319999999999993 111.685 176.649 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 88.21 6.98 73.95 Favored Glycine 0 C--N 1.349 1.284 0 CA-C-O 119.924 -0.375 . . . . 73.109999999999999 113.941 178.549 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . 0.471 ' HB2' ' HB3' ' A' ' 24' ' ' LEU . 44.2 mm-40 -79.01 55.91 1.87 Allowed 'General case' 0 N--CA 1.484 1.23 0 C-N-CA 124.805 1.242 . . . . 65.420000000000002 111.643 176.424 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 30' ' ' TRP . . . . . 0.597 ' HH2' HD22 ' A' ' 81' ' ' LEU . 93.8 m95 -64.17 -27.51 69.12 Favored 'General case' 0 N--CA 1.481 1.08 0 C-N-CA 124.162 0.985 . . . . 72.099999999999994 111.904 -177.492 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 4.9 m-20 -56.94 -47.86 79.67 Favored 'General case' 0 CA--C 1.539 0.536 0 C-N-CA 124.12 0.968 . . . . 73.319999999999993 110.353 176.275 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 98.4 mt -64.84 -26.8 68.49 Favored 'General case' 0 CA--C 1.546 0.826 0 CA-C-N 115.574 -0.739 . . . . 74.409999999999997 111.204 179.983 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . 0.568 ' HA ' HD21 ' A' ' 21' ' ' LEU . 9.8 mp -68.93 -39.63 79.5 Favored 'General case' 0 N--CA 1.484 1.249 0 C-N-CA 122.465 0.306 . . . . 73.109999999999999 110.458 171.34 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . 0.414 ' HG ' ' O ' ' A' ' 30' ' ' TRP . 75.7 mt -66.69 -37.92 85.71 Favored 'General case' 0 N--CA 1.487 1.385 0 O-C-N 123.585 0.553 . . . . 74.409999999999997 111.975 -179.681 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 1.3 mp0 -71.67 -49.19 42.0 Favored 'General case' 0 N--CA 1.485 1.315 0 C-N-CA 122.638 0.375 . . . . 74.340000000000003 110.957 177.598 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 36' ' ' GLN . . . . . 0.457 ' HB2' HD22 ' A' ' 21' ' ' LEU . 87.4 mm-40 -74.42 -13.44 60.72 Favored 'General case' 0 N--CA 1.478 0.955 0 C-N-CA 123.22 0.608 . . . . 72.230000000000004 111.96 -179.563 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . 0.505 ' O ' ' HG ' ' A' ' 41' ' ' LEU . 32.4 tt0 -48.51 -61.14 2.17 Favored 'General case' 0 N--CA 1.486 1.332 0 C-N-CA 124.672 1.189 . . . . 72.420000000000002 111.885 177.584 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 66.0 t -53.55 -46.27 59.91 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.346 0 O-C-N 124.322 1.014 . . . . 74.239999999999995 111.235 -176.517 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 44.6 m -65.66 -38.51 89.51 Favored 'General case' 0 CA--C 1.544 0.748 0 CA-C-N 114.99 -1.005 . . . . 74.230000000000004 111.727 179.818 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 40.0 t80 -69.29 -46.08 68.04 Favored 'General case' 0 N--CA 1.476 0.87 0 C-N-CA 123.056 0.542 . . . . 75.209999999999994 110.564 -177.758 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . 0.505 ' HG ' ' O ' ' A' ' 37' ' ' GLU . 49.9 mt -55.75 -51.79 66.15 Favored 'General case' 0 C--N 1.355 0.829 0 O-C-N 124.673 1.233 . . . . 71.319999999999993 109.81 177.382 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 50.1 tt0 -54.54 -48.02 72.48 Favored 'General case' 0 C--N 1.355 0.812 0 CA-C-N 114.62 -1.173 . . . . 73.019999999999996 111.017 179.404 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 43' ' ' SER . . . . . 0.52 ' O ' HG22 ' A' ' 47' ' ' VAL . 67.5 m -59.03 -62.18 2.08 Favored 'General case' 0 C--N 1.349 0.552 0 O-C-N 124.057 0.848 . . . . 75.219999999999999 111.307 -177.721 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 44' ' ' ILE . . . . . 0.43 HG12 ' HE2' ' A' ' 48' ' ' MET . 14.6 tt -64.52 -34.78 71.84 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.955 0 O-C-N 123.571 0.544 . . . . 72.0 111.628 -171.46 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . 0.528 ' HG2' HD23 ' A' ' 92' ' ' LEU . 17.6 mm-40 -58.93 -53.02 63.15 Favored 'General case' 0 N--CA 1.484 1.237 0 C-N-CA 122.663 0.385 . . . . 70.030000000000001 110.539 171.947 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 87.2 m -56.43 -40.31 74.54 Favored 'General case' 0 C--N 1.358 0.949 0 C-N-CA 123.502 0.721 . . . . 74.430000000000007 111.486 -178.654 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 47' ' ' VAL . . . . . 0.648 HG23 ' HB3' ' A' ' 10' ' ' ARG . 44.9 t -70.36 -41.22 78.43 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.078 0 C-N-CA 123.406 0.682 . . . . 73.329999999999998 111.293 -177.055 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 48' ' ' MET . . . . . 0.43 ' HE2' HG12 ' A' ' 44' ' ' ILE . 77.3 mtm -71.34 -30.8 66.62 Favored 'General case' 0 N--CA 1.486 1.361 0 C-N-CA 122.505 0.322 . . . . 75.319999999999993 111.667 179.519 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 62.3 mt-10 -82.57 -8.3 59.61 Favored 'General case' 0 N--CA 1.482 1.167 0 C-N-CA 123.314 0.646 . . . . 73.329999999999998 111.334 176.332 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . 0.532 ' HB2' ' HZ2' ' A' ' 50' ' ' LYS . 0.1 OUTLIER -90.41 139.9 30.23 Favored 'General case' 0 N--CA 1.469 0.502 0 C-N-CA 123.002 0.521 . . . . 72.319999999999993 110.407 -176.002 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 7.7 tt0 -68.78 140.97 55.31 Favored 'General case' 0 CA--C 1.537 0.477 0 C-N-CA 124.172 0.989 . . . . 74.209999999999994 109.893 174.784 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 52' ' ' THR . . . . . 0.407 ' HA ' ' HD3' ' A' ' 53' ' ' PRO . 25.2 m -83.76 128.18 64.5 Favored Pre-proline 0 CA--C 1.547 0.844 0 N-CA-C 109.548 -0.538 . . . . 63.399999999999999 109.548 174.709 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 53' ' ' PRO . . . . . 0.543 ' HG2' ' HA ' ' A' ' 4' ' ' THR . 25.7 Cg_exo -65.57 155.07 70.89 Favored 'Trans proline' 0 C--N 1.376 1.99 0 C-N-CA 123.086 2.524 . . . . 73.439999999999998 113.548 -179.422 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 54' ' ' PRO . . . . . 0.421 ' HA ' HD12 ' A' ' 113' ' ' LEU . 37.9 Cg_endo -66.1 -47.46 3.47 Favored 'Trans proline' 0 C--N 1.382 2.292 0 C-N-CA 123.165 2.577 . . . . 73.430000000000007 112.687 176.736 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . -75.34 78.89 1.09 Allowed Glycine 0 C--N 1.343 0.938 0 O-C-N 123.748 0.655 . . . . 72.200000000000003 113.882 -172.824 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 65.4 mt -116.88 117.16 54.49 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.651 0 N-CA-C 108.134 -1.062 . . . . 72.140000000000001 108.134 173.99 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 62.8 p -95.92 -168.05 1.69 Allowed 'General case' 0 N--CA 1.476 0.866 0 C-N-CA 123.663 0.785 . . . . 75.109999999999999 110.024 179.11 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 32.5 tpt180 -58.82 -63.76 1.18 Allowed 'General case' 0 C--N 1.355 0.819 0 C-N-CA 124.025 0.93 . . . . 74.420000000000002 110.271 175.355 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 13.1 m -59.84 -38.04 80.94 Favored 'General case' 0 C--N 1.353 0.73 0 O-C-N 123.989 0.805 . . . . 72.219999999999999 111.655 -175.111 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 60' ' ' ILE . . . . . 0.464 HD11 HG23 ' A' ' 4' ' ' THR . 94.5 mt -61.62 -48.79 87.11 Favored 'Isoleucine or valine' 0 C--N 1.357 0.923 0 O-C-N 123.833 0.708 . . . . 75.439999999999998 110.28 176.71 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 49.8 tt0 -59.26 -41.69 89.41 Favored 'General case' 0 N--CA 1.479 1.022 0 C-N-CA 123.259 0.623 . . . . 75.340000000000003 111.261 -179.211 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 23.6 m-20 -74.04 -32.81 63.5 Favored 'General case' 0 N--CA 1.476 0.833 0 N-CA-C 112.297 0.48 . . . . 63.439999999999998 112.297 -178.54 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 63' ' ' MET . . . . . . . . . . . . . 67.8 mtm -71.51 -43.55 66.29 Favored 'General case' 0 N--CA 1.486 1.374 0 CA-C-N 118.194 0.452 . . . . 74.209999999999994 110.432 177.408 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 64' ' ' VAL . . . . . 0.468 ' O ' HG13 ' A' ' 68' ' ' ILE . 78.9 t -63.65 -61.64 1.58 Allowed 'Isoleucine or valine' 0 CA--C 1.54 0.576 0 O-C-N 123.936 0.772 . . . . 73.420000000000002 109.443 177.68 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -63.26 -26.45 68.79 Favored 'General case' 0 N--CA 1.485 1.287 0 C-N-CA 123.433 0.693 . . . . 75.140000000000001 112.442 -179.201 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -66.17 -46.69 78.11 Favored Glycine 0 C--N 1.343 0.958 0 N-CA-C 111.581 -0.607 . . . . 74.329999999999998 111.581 174.797 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 67' ' ' TYR . . . . . 0.491 ' CE2' ' HG2' ' A' ' 12' ' ' GLN . 12.6 m-30 -77.15 -23.17 51.67 Favored 'General case' 0 N--CA 1.468 0.446 0 CA-C-O 118.8 -0.619 . . . . 65.239999999999995 112.12 178.095 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 68' ' ' ILE . . . . . 0.468 HG13 ' O ' ' A' ' 64' ' ' VAL . 49.4 mt -68.96 -53.68 24.72 Favored 'Isoleucine or valine' 0 C--N 1.363 1.156 0 N-CA-C 108.04 -1.096 . . . . 73.239999999999995 108.04 172.472 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 69' ' ' LYS . . . . . 0.494 ' HB2' ' HE2' ' A' ' 106' ' ' TYR . 49.9 tptt -54.14 -46.18 72.15 Favored 'General case' 0 N--CA 1.487 1.394 0 C-N-CA 123.641 0.776 . . . . 75.430000000000007 110.962 178.106 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 62.9 tt0 -57.84 -50.2 74.09 Favored 'General case' 0 CA--C 1.537 0.456 0 O-C-N 124.3 1.0 . . . . 72.349999999999994 109.99 179.532 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 71' ' ' THR . . . . . 0.651 ' HB ' ' HA ' ' A' ' 15' ' ' ALA . 11.5 t -74.16 -20.44 60.22 Favored 'General case' 0 C--O 1.207 -1.179 0 CA-C-O 118.539 -0.743 . . . . 72.019999999999996 111.632 -178.818 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 72' ' ' LEU . . . . . 0.542 HD23 ' HB3' ' A' ' 102' ' ' LEU . 17.9 mt -70.15 -40.04 74.98 Favored 'General case' 0 N--CA 1.484 1.237 0 CA-C-N 118.622 0.646 . . . . 74.140000000000001 109.436 175.464 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 71.5 m-20 -66.88 -52.54 42.17 Favored 'General case' 0 C--N 1.342 0.266 0 O-C-N 123.898 0.749 . . . . 65.0 109.799 178.808 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 74' ' ' ASN . . . . . 0.504 ' HA ' HD23 ' A' ' 22' ' ' LEU . 53.9 m-20 -58.04 -50.45 73.39 Favored 'General case' 0 N--CA 1.479 1.025 0 C-N-CA 123.661 0.785 . . . . 73.239999999999995 110.932 -179.523 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . 0.485 ' O ' ' HG2' ' A' ' 79' ' ' LYS . 4.8 tp10 -57.35 -60.2 3.99 Favored 'General case' 0 N--CA 1.473 0.724 0 C-N-CA 124.162 0.985 . . . . 72.319999999999993 110.564 179.674 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 7.8 tt0 -61.29 -35.48 77.45 Favored 'General case' 0 N--CA 1.479 1.002 0 C-N-CA 123.985 0.914 . . . . 73.420000000000002 111.658 -171.525 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . 0.414 ' O ' ' HB2' ' A' ' 81' ' ' LEU . 63.5 mt -60.35 -51.29 70.13 Favored 'General case' 0 C--N 1.357 0.902 0 O-C-N 123.862 0.726 . . . . 75.129999999999995 109.426 173.579 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . 0.591 HD23 ' HA ' ' A' ' 22' ' ' LEU . 75.6 mt -59.03 -39.4 81.83 Favored 'General case' 0 N--CA 1.484 1.246 0 O-C-N 123.765 0.666 . . . . 75.209999999999994 112.45 177.952 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 79' ' ' LYS . . . . . 0.485 ' HG2' ' O ' ' A' ' 75' ' ' GLU . 7.8 mmpt? -65.5 -40.19 92.76 Favored 'General case' 0 CA--C 1.546 0.802 0 N-CA-C 109.618 -0.512 . . . . 72.519999999999996 109.618 -178.079 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -85.5 -8.87 79.99 Favored Glycine 0 C--N 1.349 1.257 0 CA-C-N 115.347 -0.842 . . . . 72.219999999999999 113.586 176.291 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . 0.597 HD22 ' HH2' ' A' ' 30' ' ' TRP . 2.5 tt -81.99 -41.85 20.18 Favored 'General case' 0 N--CA 1.479 0.996 0 C-N-CA 123.114 0.565 . . . . 73.409999999999997 109.635 178.693 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 82' ' ' LEU . . . . . 0.435 ' HB2' ' HB2' ' A' ' 87' ' ' ASP . 97.1 mt -57.78 -63.33 1.28 Allowed 'General case' 0 N--CA 1.482 1.144 0 N-CA-C 112.68 0.622 . . . . 70.230000000000004 112.68 -173.976 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 43.0 mt-30 -135.59 29.83 3.21 Favored 'General case' 0 N--CA 1.496 1.838 0 C-N-CA 122.663 0.385 . . . . 74.450000000000003 111.0 -179.625 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 6.1 tp-100 71.17 16.28 6.3 Favored 'General case' 0 N--CA 1.492 1.654 0 C-N-CA 124.328 1.051 . . . . 74.510000000000005 113.05 169.499 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 85' ' ' ARG . . . . . . . . . . . . . 65.8 mtp85 -129.25 -120.61 0.23 Allowed 'General case' 0 N--CA 1.487 1.396 0 O-C-N 121.593 -0.692 . . . . 73.200000000000003 110.595 -178.02 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 91.2 mt -133.81 55.37 1.9 Allowed 'General case' 0 N--CA 1.478 0.949 0 N-CA-C 107.676 -1.231 . . . . 72.299999999999997 107.676 178.797 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 87' ' ' ASP . . . . . 0.435 ' HB2' ' HB2' ' A' ' 82' ' ' LEU . 6.2 m-20 -78.93 167.64 20.84 Favored 'General case' 0 N--CA 1.472 0.65 0 CA-C-N 113.36 -1.746 . . . . 70.430000000000007 111.19 -173.736 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 14.4 tp10 -136.48 147.18 47.03 Favored 'General case' 0 N--CA 1.485 1.324 0 N-CA-C 109.315 -0.624 . . . . 65.319999999999993 109.315 179.556 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 98.1 mt -55.02 -38.86 68.46 Favored 'General case' 0 C--N 1.358 0.954 0 O-C-N 124.248 0.967 . . . . 75.310000000000002 110.688 177.611 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 23.0 t -137.39 -124.01 0.14 Allowed 'General case' 0 CA--C 1.549 0.938 0 N-CA-C 107.738 -1.208 . . . . 64.5 107.738 175.599 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 71.1 m -145.31 141.53 28.62 Favored 'General case' 0 N--CA 1.473 0.717 0 CA-C-N 119.263 0.938 . . . . 75.319999999999993 109.637 170.963 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 92' ' ' LEU . . . . . 0.528 HD23 ' HG2' ' A' ' 45' ' ' GLU . 20.8 mt -97.91 -134.03 0.24 Allowed 'General case' 0 N--CA 1.474 0.767 0 C-N-CA 123.808 0.843 . . . . 72.400000000000006 109.003 173.55 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 65.3 mt -42.52 -48.24 1.1 Allowed 'Isoleucine or valine' 0 C--N 1.367 1.368 0 C-N-CA 124.151 0.98 . . . . 65.219999999999999 110.341 167.915 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 169.87 -133.97 3.0 Favored Glycine 0 C--N 1.344 1.009 0 CA-C-N 115.534 -0.757 . . . . 62.329999999999998 111.424 171.211 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -69.91 154.72 41.59 Favored 'General case' 0 CA--C 1.548 0.871 0 C-N-CA 123.077 0.551 . . . . 70.530000000000001 110.919 173.493 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 19.6 m 66.12 -82.91 0.03 OUTLIER 'General case' 0 N--CA 1.48 1.068 0 C-N-CA 125.15 1.38 . . . . 73.340000000000003 110.749 -175.766 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 97' ' ' THR . . . . . 0.435 ' HB ' ' HD3' ' A' ' 98' ' ' ARG . 28.6 m 47.02 -82.35 0.01 OUTLIER 'General case' 0 CA--C 1.553 1.072 0 C-N-CA 126.23 1.812 . . . . 55.200000000000003 114.795 175.676 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 98' ' ' ARG . . . . . 0.539 ' HD3' ' H ' ' A' ' 98' ' ' ARG . 0.8 OUTLIER -57.48 -56.44 21.79 Favored 'General case' 0 N--CA 1.477 0.919 0 C-N-CA 124.593 1.157 . . . . 75.5 111.539 -164.993 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 51.3 tt0 -61.28 -54.89 38.27 Favored 'General case' 0 CA--C 1.539 0.547 0 CA-C-N 114.672 -1.149 . . . . 71.510000000000005 110.596 -174.142 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 87.9 tttt -64.99 -53.65 42.85 Favored 'General case' 0 N--CA 1.476 0.854 0 O-C-N 123.719 0.637 . . . . 73.219999999999999 111.704 -176.034 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 44.8 t -57.48 -49.26 76.87 Favored 'General case' 0 N--CA 1.478 0.938 0 C-N-CA 123.773 0.829 . . . . 72.329999999999998 111.772 -174.747 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 102' ' ' LEU . . . . . 0.542 ' HB3' HD23 ' A' ' 72' ' ' LEU . 9.4 mp -77.49 -27.03 51.78 Favored 'General case' 0 CA--C 1.556 1.187 0 O-C-N 123.586 0.554 . . . . 74.450000000000003 111.55 -176.203 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 24.9 t-20 -70.1 -41.35 74.12 Favored 'General case' 0 N--CA 1.49 1.574 0 C-N-CA 122.64 0.376 . . . . 74.120000000000005 111.119 173.946 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -68.89 -41.22 78.59 Favored 'General case' 0 N--CA 1.476 0.871 0 C-N-CA 123.536 0.734 . . . . 71.299999999999997 109.194 178.035 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -60.08 -40.11 88.42 Favored 'General case' 0 C--N 1.352 0.694 0 O-C-N 124.07 0.856 . . . . 54.240000000000002 110.478 176.284 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 106' ' ' TYR . . . . . 0.494 ' HE2' ' HB2' ' A' ' 69' ' ' LYS . 4.6 t80 -64.2 -49.5 71.76 Favored 'General case' 0 N--CA 1.475 0.784 0 C-N-CA 123.695 0.798 . . . . 73.239999999999995 110.596 178.278 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -63.96 -40.49 98.31 Favored Glycine 0 C--N 1.353 1.513 0 O-C-N 123.431 0.457 . . . . 31.440000000000001 113.019 -175.65 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 93.8 mtt180 -74.49 -30.22 61.74 Favored 'General case' 0 N--CA 1.469 0.49 0 C-N-CA 123.446 0.698 . . . . 74.239999999999995 110.603 178.239 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 52.4 tp -64.17 -45.06 90.09 Favored 'General case' 0 N--CA 1.484 1.238 0 C-N-CA 123.368 0.667 . . . . 75.209999999999994 110.272 173.895 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 39.8 t -63.0 -48.75 77.47 Favored 'General case' 0 CA--C 1.538 0.484 0 O-C-N 124.558 1.161 . . . . 63.350000000000001 110.149 -179.521 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . -81.22 -61.45 2.1 Favored Glycine 0 C--N 1.349 1.295 0 C-N-CA 121.243 -0.503 . . . . 73.340000000000003 113.515 -176.565 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 112' ' ' MET . . . . . . . . . . . . . 64.6 mmm -93.44 -65.72 0.97 Allowed 'General case' 0 N--CA 1.484 1.271 0 N-CA-C 114.127 1.158 . . . . 72.040000000000006 114.127 -173.351 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 113' ' ' LEU . . . . . 0.439 ' O ' ' HB2' ' A' ' 114' ' ' LEU . 5.8 tt 179.94 -36.29 0.01 OUTLIER 'General case' 0 N--CA 1.474 0.771 0 C-N-CA 124.099 0.96 . . . . 74.109999999999999 108.517 -168.947 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 114' ' ' LEU . . . . . 0.439 ' HB2' ' O ' ' A' ' 113' ' ' LEU . 3.5 tt 147.84 -16.08 0.0 OUTLIER 'General case' 0 N--CA 1.498 1.936 0 C-N-CA 129.263 3.025 . . . . 73.150000000000006 106.367 178.284 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 115' ' ' VAL . . . . . . . . . . . . . 23.6 m -74.32 137.96 75.03 Favored Pre-proline 0 CA--C 1.551 1.012 0 CA-C-N 115.247 -0.888 . . . . 75.439999999999998 110.423 179.231 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 3.4 Cg_exo -74.81 122.53 7.35 Favored 'Trans proline' 0 C--N 1.377 2.047 0 C-N-CA 122.557 2.171 . . . . 72.400000000000006 110.828 176.428 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 14.1 t70 -133.92 -68.56 0.56 Allowed 'General case' 0 N--CA 1.475 0.802 0 N-CA-C 107.383 -1.34 . . . . 74.129999999999995 107.383 -179.826 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -116.24 115.35 40.4 Favored Pre-proline 0 C--O 1.239 0.541 0 N-CA-C 107.766 -1.198 . . . . 74.239999999999995 107.766 169.822 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 119' ' ' PRO . . . . . . . . . . . . . 31.2 Cg_endo -62.3 -29.92 80.51 Favored 'Trans proline' 0 C--N 1.372 1.804 0 C-N-CA 122.45 2.1 . . . . 75.010000000000005 112.102 173.605 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . 167.9 165.85 25.99 Favored Glycine 0 C--N 1.348 1.216 0 N-CA-C 111.848 -0.501 . . . . 72.200000000000003 111.848 177.287 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . -156.9 100.58 1.9 Allowed 'General case' 0 N--CA 1.475 0.8 0 C-N-CA 123.733 0.813 . . . . 73.450000000000003 109.807 178.759 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 122' ' ' SER . . . . . . . . . . . . . 29.3 t . . . . . 0 CA--C 1.553 1.079 0 N-CA-C 108.396 -0.964 . . . . 73.310000000000002 108.396 176.625 . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 1' ' ' MET . . . . . 0.432 ' HE1' HD11 ' A' ' 60' ' ' ILE . 22.1 ttt . . . . . 0 N--CA 1.485 1.313 0 CA-C-O 119.628 -0.225 . . . . 65.420000000000002 110.777 . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 36.8 p -52.36 -45.84 65.91 Favored 'General case' 0 N--CA 1.487 1.378 0 C-N-CA 123.736 0.815 . . . . 75.340000000000003 112.394 -175.221 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 17.4 m -67.81 -33.47 74.87 Favored 'General case' 0 CA--C 1.552 1.051 0 C-N-CA 123.46 0.704 . . . . 73.219999999999999 111.497 -178.547 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 4' ' ' THR . . . . . 0.52 HG23 HD12 ' A' ' 60' ' ' ILE . 60.2 m -70.94 -41.18 71.49 Favored 'General case' 0 N--CA 1.475 0.793 0 C-N-CA 123.705 0.802 . . . . 73.329999999999998 110.739 177.536 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 95.5 t -66.67 -37.56 79.78 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.835 0 C-N-CA 123.353 0.661 . . . . 70.209999999999994 109.62 -179.168 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . 0.405 ' O ' ' HG3' ' A' ' 10' ' ' ARG . 57.2 mt-10 -62.49 -48.69 78.46 Favored 'General case' 0 C--N 1.356 0.861 0 O-C-N 123.727 0.642 . . . . 70.409999999999997 110.242 171.344 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 30.4 t80 -61.34 -46.17 91.36 Favored 'General case' 0 N--CA 1.481 1.102 0 C-N-CA 124.268 1.027 . . . . 74.340000000000003 111.249 -174.086 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 82.9 mt -65.57 -41.31 90.49 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.785 0 C-N-CA 123.789 0.835 . . . . 70.409999999999997 109.741 176.208 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 3.7 t-20 -65.6 -28.17 68.94 Favored 'General case' 0 N--CA 1.484 1.26 0 C-N-CA 123.02 0.528 . . . . 62.009999999999998 111.426 179.452 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . 0.405 ' HG3' ' O ' ' A' ' 6' ' ' GLU . 62.4 mtt85 -70.11 -46.9 63.84 Favored 'General case' 0 C--O 1.224 -0.244 0 N-CA-C 109.168 -0.679 . . . . 74.0 109.168 174.504 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 11' ' ' TRP . . . . . 0.412 ' CD1' HG11 ' A' ' 64' ' ' VAL . 91.1 m95 -68.86 -20.96 64.29 Favored 'General case' 0 N--CA 1.478 0.935 0 O-C-N 123.385 0.428 . . . . 62.0 111.818 175.731 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 53.9 mt-30 -65.97 -52.19 51.72 Favored 'General case' 0 N--CA 1.477 0.921 0 N-CA-C 108.016 -1.105 . . . . 73.409999999999997 108.016 169.323 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 14.8 tpt180 -55.61 -44.86 77.44 Favored 'General case' 0 CA--C 1.547 0.856 0 O-C-N 124.267 0.98 . . . . 73.129999999999995 111.224 -179.368 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 14' ' ' ILE . . . . . 0.528 HD11 HG13 ' A' ' 44' ' ' ILE . 77.8 mt -70.41 -50.25 47.3 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.81 0 C-N-CA 123.775 0.83 . . . . 72.450000000000003 111.096 -177.011 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -58.54 -44.57 89.66 Favored 'General case' 0 N--CA 1.485 1.275 0 C-N-CA 123.688 0.795 . . . . 73.420000000000002 111.263 -178.8 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 95.1 mt -71.92 -43.58 65.09 Favored 'General case' 0 N--CA 1.475 0.821 0 CA-C-N 114.514 -1.221 . . . . 71.420000000000002 110.918 -177.879 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . 0.417 ' O ' ' HG ' ' A' ' 21' ' ' LEU . 17.7 mt -63.1 -44.59 95.26 Favored 'General case' 0 N--CA 1.487 1.396 0 CA-C-O 119.227 -0.416 . . . . 64.450000000000003 110.992 178.772 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 81.0 p -65.08 -39.58 93.41 Favored 'General case' 0 N--CA 1.474 0.773 0 C-N-CA 123.006 0.522 . . . . 74.209999999999994 110.667 -178.961 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 6.6 tp-100 -59.66 -47.98 83.46 Favored 'General case' 0 C--N 1.359 1.014 0 O-C-N 123.894 0.746 . . . . 74.409999999999997 110.33 174.47 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 68.1 m -58.37 -52.94 63.51 Favored 'General case' 0 C--O 1.208 -1.116 0 CA-C-N 115.456 -0.793 . . . . 74.140000000000001 110.481 177.701 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . 0.551 HD22 ' HA ' ' A' ' 33' ' ' LEU . 89.1 mt -65.92 -24.71 66.88 Favored 'General case' 0 N--CA 1.474 0.736 0 C-N-CA 124.197 0.999 . . . . 72.200000000000003 111.486 -175.145 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . 0.655 ' HA ' HD22 ' A' ' 78' ' ' LEU . 57.4 tp -69.88 -53.81 16.34 Favored 'General case' 0 C--N 1.356 0.873 0 N-CA-C 109.814 -0.439 . . . . 75.430000000000007 109.814 174.357 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . 0.414 ' O ' ' HG3' ' A' ' 27' ' ' ARG . 40.8 mt-10 -57.27 -49.94 74.47 Favored 'General case' 0 N--CA 1.48 1.067 0 O-C-N 123.968 0.792 . . . . 74.109999999999999 110.161 178.628 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . 0.519 ' HB3' ' HB2' ' A' ' 29' ' ' GLU . 95.0 mt -59.4 -42.23 91.27 Favored 'General case' 0 CA--C 1.536 0.438 0 C-N-CA 125.244 1.418 . . . . 72.439999999999998 110.878 -178.218 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . 0.553 ' HB1' HD22 ' A' ' 33' ' ' LEU . . . -58.73 -48.62 80.52 Favored 'General case' 0 N--CA 1.48 1.032 0 C-N-CA 122.613 0.365 . . . . 73.430000000000007 110.753 175.78 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 96.1 mt-30 -63.04 -30.25 71.45 Favored 'General case' 0 CA--C 1.55 0.945 0 O-C-N 124.063 0.852 . . . . 73.120000000000005 111.407 -179.591 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . 0.414 ' HG3' ' O ' ' A' ' 23' ' ' GLU . 90.4 mtt180 -78.83 -28.05 44.36 Favored 'General case' 0 N--CA 1.483 1.207 0 C-N-CA 123.688 0.795 . . . . 74.219999999999999 111.082 178.216 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 98.73 22.53 13.66 Favored Glycine 0 C--N 1.352 1.436 0 C-N-CA 123.117 0.389 . . . . 50.229999999999997 113.603 -176.493 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . 0.519 ' HB2' ' HB3' ' A' ' 24' ' ' LEU . 14.8 mm-40 -86.52 54.27 3.1 Favored 'General case' 0 CA--C 1.552 1.044 0 C-N-CA 125.04 1.336 . . . . 74.439999999999998 110.396 177.72 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 30' ' ' TRP . . . . . 0.522 ' HH2' HD23 ' A' ' 81' ' ' LEU . 57.2 m95 -59.49 -33.84 71.84 Favored 'General case' 0 N--CA 1.486 1.34 0 C-N-CA 124.257 1.023 . . . . 71.219999999999999 112.009 -171.952 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 3.7 m-20 -58.62 -41.42 85.88 Favored 'General case' 0 N--CA 1.474 0.736 0 C-N-CA 124.462 1.105 . . . . 75.239999999999995 110.697 -178.407 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 86.0 mt -69.78 -31.83 69.99 Favored 'General case' 0 N--CA 1.472 0.647 0 CA-C-N 115.141 -0.936 . . . . 72.150000000000006 110.955 -177.369 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . 0.553 HD22 ' HB1' ' A' ' 25' ' ' ALA . 10.1 mp -67.71 -43.94 78.85 Favored 'General case' 0 N--CA 1.482 1.146 0 C-N-CA 122.934 0.494 . . . . 75.239999999999995 110.466 174.35 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . 0.409 ' HG ' ' O ' ' A' ' 30' ' ' TRP . 73.1 mt -67.07 -37.58 84.25 Favored 'General case' 0 N--CA 1.484 1.238 0 O-C-N 123.606 0.566 . . . . 61.32 111.767 -177.53 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 98.5 mt-30 -70.91 -54.1 12.64 Favored 'General case' 0 N--CA 1.477 0.889 0 C-N-CA 123.025 0.53 . . . . 75.140000000000001 110.172 177.969 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 83.6 mm-40 -68.34 -16.45 63.94 Favored 'General case' 0 N--CA 1.474 0.741 0 CA-C-O 118.484 -0.769 . . . . 74.129999999999995 112.382 -178.622 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 33.3 tt0 -50.39 -46.3 56.01 Favored 'General case' 0 N--CA 1.48 1.068 0 C-N-CA 123.306 0.642 . . . . 74.510000000000005 111.348 176.947 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 60.5 t -62.32 -55.67 22.51 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.752 0 C-N-CA 123.336 0.655 . . . . 72.519999999999996 111.403 -176.022 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 29.4 p -68.52 -39.62 81.11 Favored 'General case' 0 N--CA 1.478 0.95 0 C-N-CA 123.614 0.766 . . . . 63.009999999999998 111.675 -175.957 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 45.6 t80 -64.83 -49.31 71.12 Favored 'General case' 0 N--CA 1.477 0.92 0 C-N-CA 124.189 0.996 . . . . 75.420000000000002 111.063 -177.412 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . 0.475 ' HA ' HG22 ' A' ' 44' ' ' ILE . 86.8 mt -72.77 -34.09 66.73 Favored 'General case' 0 C--O 1.243 0.76 0 O-C-N 123.721 0.638 . . . . 71.329999999999998 111.066 -178.566 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 53.2 tt0 -57.36 -51.85 67.72 Favored 'General case' 0 C--N 1.353 0.736 0 O-C-N 123.666 0.604 . . . . 74.530000000000001 109.513 173.625 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 43' ' ' SER . . . . . 0.536 ' O ' HG21 ' A' ' 47' ' ' VAL . 69.0 m -56.94 -56.39 22.31 Favored 'General case' 0 C--N 1.351 0.664 0 O-C-N 124.479 1.112 . . . . 65.030000000000001 110.423 179.865 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 44' ' ' ILE . . . . . 0.528 HG13 HD11 ' A' ' 14' ' ' ILE . 14.3 tt -62.61 -38.54 81.78 Favored 'Isoleucine or valine' 0 C--O 1.252 1.236 0 C-N-CA 123.553 0.741 . . . . 54.030000000000001 112.205 -168.687 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 31.9 mm-40 -69.62 -37.78 76.97 Favored 'General case' 0 C--N 1.359 0.993 0 O-C-N 123.114 0.258 . . . . 74.420000000000002 110.508 174.819 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 87.6 m -65.46 -28.4 69.19 Favored 'General case' 0 CA--C 1.557 1.214 0 C-N-CA 123.44 0.696 . . . . 65.0 111.762 176.166 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 47' ' ' VAL . . . . . 0.536 HG21 ' O ' ' A' ' 43' ' ' SER . 12.9 t -77.23 -42.45 31.09 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.396 0 O-C-N 122.086 -0.384 . . . . 75.049999999999997 110.074 179.123 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 48' ' ' MET . . . . . . . . . . . . . 74.3 mtm -74.43 -13.63 60.74 Favored 'General case' 0 N--CA 1.482 1.135 0 CA-C-N 116.294 -0.412 . . . . 73.530000000000001 110.936 173.927 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 15.8 tp10 -80.47 -35.21 35.18 Favored 'General case' 0 N--CA 1.477 0.877 0 C-N-CA 123.457 0.703 . . . . 73.140000000000001 109.649 169.171 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 13.9 mptt -70.52 123.58 22.15 Favored 'General case' 0 N--CA 1.472 0.649 0 N-CA-C 109.156 -0.683 . . . . 75.140000000000001 109.156 175.611 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 8.8 tt0 -62.71 150.46 41.07 Favored 'General case' 0 C--O 1.242 0.672 0 CA-C-N 115.049 -0.978 . . . . 72.420000000000002 110.289 178.316 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 52' ' ' THR . . . . . 0.413 HG23 ' HG ' ' A' ' 113' ' ' LEU . 11.3 m -58.56 116.23 14.45 Favored Pre-proline 0 CA--C 1.552 1.037 0 N-CA-C 109.737 -0.468 . . . . 64.329999999999998 109.737 174.452 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 46.5 Cg_endo -64.93 156.08 64.34 Favored 'Trans proline' 0 C--N 1.373 1.848 0 C-N-CA 122.378 2.052 . . . . 75.510000000000005 112.414 -177.196 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 46.8 Cg_exo -57.49 -46.4 27.73 Favored 'Trans proline' 0 C--N 1.378 2.102 0 C-N-CA 123.249 2.632 . . . . 70.040000000000006 112.875 179.167 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . -77.47 71.13 2.34 Favored Glycine 0 C--N 1.348 1.206 0 CA-C-N 115.597 -0.728 . . . . 75.299999999999997 114.343 -175.511 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 19.8 mm -103.56 108.39 24.39 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.6 0 N-CA-C 107.93 -1.137 . . . . 74.140000000000001 107.93 170.595 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 64.5 p -89.67 176.31 6.91 Favored 'General case' 0 C--O 1.247 0.946 0 N-CA-C 108.349 -0.982 . . . . 72.400000000000006 108.349 167.725 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 34.2 tpt85 -61.5 -50.67 71.8 Favored 'General case' 0 CA--C 1.543 0.702 0 N-CA-C 109.747 -0.464 . . . . 74.549999999999997 109.747 179.813 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 37.4 m -58.02 -39.94 79.6 Favored 'General case' 0 CA--C 1.543 0.71 0 O-C-N 124.083 0.865 . . . . 51.43 111.64 179.207 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 60' ' ' ILE . . . . . 0.52 HD12 HG23 ' A' ' 4' ' ' THR . 81.2 mt -63.02 -46.48 96.16 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.094 0 C-N-CA 123.664 0.786 . . . . 74.120000000000005 110.784 178.387 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 56.6 tt0 -57.18 -42.71 81.66 Favored 'General case' 0 N--CA 1.478 0.947 0 C-N-CA 123.541 0.736 . . . . 64.530000000000001 110.918 177.573 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 44.3 m-20 -70.61 -38.99 74.03 Favored 'General case' 0 N--CA 1.48 1.033 0 CA-C-N 116.025 -0.534 . . . . 71.099999999999994 112.151 179.571 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 63' ' ' MET . . . . . . . . . . . . . 72.6 mtm -69.67 -42.37 74.25 Favored 'General case' 0 N--CA 1.485 1.318 0 C-N-CA 122.509 0.324 . . . . 62.219999999999999 110.774 -177.816 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 64' ' ' VAL . . . . . 0.512 ' O ' HG13 ' A' ' 68' ' ' ILE . 79.4 t -64.07 -56.7 15.08 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.519 0 O-C-N 123.994 0.809 . . . . 72.430000000000007 109.421 177.499 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -63.33 -29.58 70.87 Favored 'General case' 0 N--CA 1.486 1.339 0 C-N-CA 122.871 0.468 . . . . 73.319999999999993 112.012 -179.158 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -67.16 -40.85 92.64 Favored Glycine 0 C--N 1.347 1.168 0 N-CA-C 111.659 -0.576 . . . . 74.239999999999995 111.659 175.84 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 67' ' ' TYR . . . . . 0.469 ' O ' HG21 ' A' ' 71' ' ' THR . 15.4 m-30 -69.21 -39.85 78.34 Favored 'General case' 0 C--O 1.241 0.639 0 C-N-CA 123.425 0.69 . . . . 74.540000000000006 110.999 175.943 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 68' ' ' ILE . . . . . 0.521 ' O ' ' HG ' ' A' ' 72' ' ' LEU . 36.9 mt -60.11 -44.71 95.67 Favored 'Isoleucine or valine' 0 C--N 1.365 1.256 0 N-CA-C 108.286 -1.005 . . . . 74.040000000000006 108.286 176.152 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 69' ' ' LYS . . . . . 0.469 ' HB2' ' HE2' ' A' ' 106' ' ' TYR . 51.5 tptt -58.07 -45.26 87.38 Favored 'General case' 0 N--CA 1.476 0.856 0 C-N-CA 123.82 0.848 . . . . 73.239999999999995 110.683 179.166 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 70' ' ' GLN . . . . . 0.415 ' HG2' ' ND2' ' A' ' 74' ' ' ASN . 60.5 tt0 -60.02 -45.97 91.02 Favored 'General case' 0 C--N 1.352 0.688 0 O-C-N 123.798 0.687 . . . . 75.099999999999994 110.413 -179.676 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 71' ' ' THR . . . . . 0.469 HG21 ' O ' ' A' ' 67' ' ' TYR . 1.8 t -75.57 -22.74 56.71 Favored 'General case' 0 C--N 1.355 0.814 0 CA-C-O 119.196 -0.431 . . . . 75.230000000000004 111.259 -178.584 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 72' ' ' LEU . . . . . 0.521 ' HG ' ' O ' ' A' ' 68' ' ' ILE . 34.2 mt -64.03 -53.33 51.69 Favored 'General case' 0 C--N 1.361 1.101 0 N-CA-C 108.794 -0.817 . . . . 75.120000000000005 108.794 173.871 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 66.9 m-20 -64.39 -52.92 55.83 Favored 'General case' 0 N--CA 1.475 0.779 0 O-C-N 123.906 0.754 . . . . 74.349999999999994 111.24 -177.077 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 74' ' ' ASN . . . . . 0.423 ' HA ' HD23 ' A' ' 22' ' ' LEU . 90.3 m-20 -55.58 -54.0 49.44 Favored 'General case' 0 N--CA 1.482 1.17 0 O-C-N 124.164 0.915 . . . . 75.5 111.188 -177.964 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . 0.467 ' HG2' ' HE2' ' A' ' 79' ' ' LYS . 13.8 tt0 -73.31 -30.09 63.14 Favored 'General case' 0 CA--C 1.553 1.077 0 CA-C-N 115.723 -0.672 . . . . 72.420000000000002 110.857 -173.225 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 10.1 tt0 -69.1 -39.08 79.19 Favored 'General case' 0 N--CA 1.488 1.472 0 C-N-CA 123.458 0.703 . . . . 75.200000000000003 110.568 177.284 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 90.4 mt -63.37 -40.08 96.28 Favored 'General case' 0 C--N 1.351 0.671 0 CA-C-N 115.516 -0.766 . . . . 73.129999999999995 109.251 172.478 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . 0.655 HD22 ' HA ' ' A' ' 22' ' ' LEU . 50.2 mt -60.56 -37.07 80.08 Favored 'General case' 0 N--CA 1.478 0.958 0 O-C-N 123.904 0.752 . . . . 75.439999999999998 112.12 175.112 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 79' ' ' LYS . . . . . 0.467 ' HE2' ' HG2' ' A' ' 75' ' ' GLU . 66.4 mmtt -63.99 -54.79 28.82 Favored 'General case' 0 N--CA 1.476 0.853 0 N-CA-C 108.747 -0.835 . . . . 74.349999999999994 108.747 176.493 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -59.87 -26.95 63.67 Favored Glycine 0 C--N 1.358 1.764 0 O-C-N 124.214 0.946 . . . . 53.409999999999997 113.72 -179.767 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . 0.522 HD23 ' HH2' ' A' ' 30' ' ' TRP . 8.5 tt -77.91 -40.71 38.94 Favored 'General case' 0 CA--C 1.545 0.76 0 C-N-CA 124.258 1.023 . . . . 71.209999999999994 109.755 179.711 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 58.1 mt -76.11 -63.35 1.34 Allowed 'General case' 0 N--CA 1.478 0.968 0 C-N-CA 122.447 0.299 . . . . 72.340000000000003 111.435 -178.624 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 38.0 tt0 -155.94 7.59 0.22 Allowed 'General case' 0 N--CA 1.485 1.324 0 N-CA-C 111.978 0.362 . . . . 54.340000000000003 111.978 -172.247 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 47.2 mt-30 61.91 13.06 5.25 Favored 'General case' 0 N--CA 1.49 1.536 0 C-N-CA 124.769 1.228 . . . . 75.349999999999994 112.618 -170.845 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 85' ' ' ARG . . . . . . . . . . . . . 51.3 mtt180 -134.25 167.08 21.34 Favored 'General case' 0 N--CA 1.479 0.984 0 C-N-CA 123.562 0.745 . . . . 73.25 110.912 -169.784 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 86' ' ' LEU . . . . . 0.493 HD11 ' HA ' ' A' ' 96' ' ' SER . 81.8 mt -100.01 44.57 1.01 Allowed 'General case' 0 CA--C 1.547 0.836 0 C-N-CA 124.322 1.049 . . . . 74.120000000000005 111.514 -173.375 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 4.2 m-20 -78.56 -73.31 0.33 Allowed 'General case' 0 N--CA 1.479 0.991 0 N-CA-C 109.306 -0.628 . . . . 72.120000000000005 109.306 172.235 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 52.3 mt-10 -92.07 155.07 18.33 Favored 'General case' 0 N--CA 1.476 0.858 0 C-N-CA 123.945 0.898 . . . . 74.239999999999995 110.765 -178.395 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . 0.496 HD12 HD23 ' A' ' 33' ' ' LEU . 86.7 mt 58.41 26.13 13.76 Favored 'General case' 0 N--CA 1.484 1.242 0 C-N-CA 125.074 1.349 . . . . 75.200000000000003 110.572 -170.559 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 36.9 t -147.86 18.73 1.14 Allowed 'General case' 0 CA--C 1.551 0.993 0 C-N-CA 124.153 0.981 . . . . 72.420000000000002 110.636 -176.093 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 10.9 m -72.58 94.53 1.72 Allowed 'General case' 0 CA--C 1.549 0.919 0 N-CA-C 108.937 -0.764 . . . . 72.439999999999998 108.937 171.862 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 92' ' ' LEU . . . . . 0.508 HD12 ' HE ' ' A' ' 98' ' ' ARG . 11.2 mt -125.32 -83.61 0.64 Allowed 'General case' 0 N--CA 1.483 1.191 0 CA-C-O 121.505 0.669 . . . . 74.129999999999995 110.437 -176.244 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 65.5 mt -148.87 -51.46 0.08 OUTLIER 'Isoleucine or valine' 0 N--CA 1.476 0.839 0 N-CA-C 106.179 -1.785 . . . . 62.439999999999998 106.179 -164.93 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -131.63 -175.74 14.12 Favored Glycine 0 C--N 1.352 1.426 0 CA-C-N 114.032 -1.44 . . . . 63.039999999999999 112.568 -178.627 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 34.9 tt0 -74.15 -71.25 0.34 Allowed 'General case' 0 N--CA 1.473 0.719 0 C-N-CA 125.145 1.378 . . . . 72.510000000000005 111.708 -170.829 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 96' ' ' SER . . . . . 0.493 ' HA ' HD11 ' A' ' 86' ' ' LEU . 33.4 p -94.66 10.78 33.58 Favored 'General case' 0 C--O 1.241 0.609 0 C-N-CA 123.428 0.691 . . . . 75.319999999999993 111.63 -173.869 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 88.4 m -52.59 -39.51 61.67 Favored 'General case' 0 C--N 1.361 1.071 0 C-N-CA 124.544 1.138 . . . . 60.130000000000003 111.976 177.833 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 98' ' ' ARG . . . . . 0.883 HH12 HD21 ' A' ' 102' ' ' LEU . 4.0 tpm_? -56.89 -61.68 2.27 Favored 'General case' 0 N--CA 1.469 0.515 0 C-N-CA 123.275 0.63 . . . . 74.120000000000005 112.039 -168.145 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 8.4 tt0 -83.66 -42.57 16.52 Favored 'General case' 0 CA--C 1.534 0.362 0 CA-C-N 115.063 -0.972 . . . . 71.519999999999996 110.28 -169.526 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 8.0 tmtm? -62.81 -55.61 24.8 Favored 'General case' 0 N--CA 1.476 0.835 0 O-C-N 124.106 0.879 . . . . 73.430000000000007 109.529 -177.332 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 46.6 t -72.79 -35.37 67.38 Favored 'General case' 0 N--CA 1.478 0.931 0 CA-C-O 118.622 -0.704 . . . . 74.340000000000003 111.916 -174.896 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 102' ' ' LEU . . . . . 0.883 HD21 HH12 ' A' ' 98' ' ' ARG . 21.6 tp -67.96 -47.35 68.87 Favored 'General case' 0 C--N 1.368 1.402 0 CA-C-N 118.93 0.786 . . . . 75.340000000000003 111.212 179.748 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 59.7 t30 -74.08 -24.35 59.48 Favored 'General case' 0 N--CA 1.478 0.93 0 CA-C-N 115.796 -0.638 . . . . 74.120000000000005 110.792 -178.754 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 104' ' ' ASN . . . . . 0.417 ' O ' ' HG2' ' A' ' 108' ' ' ARG . 7.7 t30 -71.13 -39.16 72.16 Favored 'General case' 0 N--CA 1.479 1.016 0 C-N-CA 122.531 0.332 . . . . 75.209999999999994 110.223 170.781 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -63.09 -37.92 89.13 Favored 'General case' 0 N--CA 1.483 1.2 0 C-N-CA 123.047 0.539 . . . . 54.520000000000003 110.306 178.204 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 106' ' ' TYR . . . . . 0.469 ' HE2' ' HB2' ' A' ' 69' ' ' LYS . 3.5 t80 -57.93 -52.07 67.01 Favored 'General case' 0 C--N 1.356 0.876 0 CA-C-N 114.941 -1.027 . . . . 75.400000000000006 108.973 168.85 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -60.51 -31.95 76.29 Favored Glycine 0 C--N 1.352 1.423 0 O-C-N 124.056 0.848 . . . . 75.340000000000003 113.673 -176.235 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 108' ' ' ARG . . . . . 0.417 ' HG2' ' O ' ' A' ' 104' ' ' ASN . 5.1 mmp_? -76.69 -36.42 57.26 Favored 'General case' 0 C--N 1.344 0.344 0 N-CA-C 109.259 -0.645 . . . . 73.310000000000002 109.259 177.871 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 42.1 tp -68.75 -30.69 69.35 Favored 'General case' 0 N--CA 1.489 1.489 0 C-N-CA 123.015 0.526 . . . . 73.120000000000005 111.152 177.235 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 38.5 t -77.66 -39.04 46.34 Favored 'General case' 0 CA--C 1.543 0.699 0 CA-C-N 115.014 -0.994 . . . . 72.019999999999996 109.584 178.105 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . -90.07 -64.03 1.25 Allowed Glycine 0 C--N 1.36 1.904 0 CA-C-O 119.571 -0.572 . . . . 72.109999999999999 114.272 -177.36 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 112' ' ' MET . . . . . 0.42 ' HG2' ' O ' ' A' ' 116' ' ' PRO . 11.2 tpt -96.79 -70.56 0.71 Allowed 'General case' 0 N--CA 1.489 1.501 0 CA-C-N 118.104 0.952 . . . . 74.510000000000005 113.272 -178.548 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 113' ' ' LEU . . . . . 0.413 ' HG ' HG23 ' A' ' 52' ' ' THR . 22.0 tp 170.11 41.69 0.0 OUTLIER 'General case' 0 N--CA 1.495 1.822 0 C-N-CA 124.195 0.998 . . . . 75.439999999999998 109.389 -177.125 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 5.3 tt 75.66 -21.49 0.3 Allowed 'General case' 0 N--CA 1.504 2.248 0 C-N-CA 126.36 1.864 . . . . 74.549999999999997 111.575 179.668 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 115' ' ' VAL . . . . . . . . . . . . . 28.7 m -83.57 163.39 49.76 Favored Pre-proline 0 CA--C 1.562 1.415 0 C-N-CA 124.263 1.025 . . . . 70.129999999999995 108.561 170.555 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 116' ' ' PRO . . . . . 0.42 ' O ' ' HG2' ' A' ' 112' ' ' MET . 37.5 Cg_endo -63.29 179.46 0.86 Allowed 'Trans proline' 0 C--N 1.377 2.045 0 C-N-CA 122.2 1.933 . . . . 73.239999999999995 112.559 174.786 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 18.1 t70 -49.5 -66.02 0.47 Allowed 'General case' 0 N--CA 1.487 1.417 0 C-N-CA 124.892 1.277 . . . . 70.349999999999994 112.525 -172.56 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -127.07 84.12 64.29 Favored Pre-proline 0 N--CA 1.477 0.88 0 C-N-CA 123.595 0.758 . . . . 74.439999999999998 110.077 177.956 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 119' ' ' PRO . . . . . 0.416 ' HB3' ' HG2' ' A' ' 116' ' ' PRO . 45.5 Cg_endo -85.36 -11.36 7.27 Favored 'Trans proline' 0 C--N 1.378 2.102 0 C-N-CA 123.093 2.529 . . . . 63.409999999999997 112.742 177.815 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . 78.9 1.63 84.99 Favored Glycine 0 C--N 1.352 1.447 0 CA-C-N 116.141 -0.481 . . . . 72.409999999999997 113.829 -177.449 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . -70.04 100.06 1.55 Allowed 'General case' 0 CA--C 1.544 0.715 0 C-N-CA 123.308 0.643 . . . . 70.200000000000003 110.634 -177.696 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 122' ' ' SER . . . . . . . . . . . . . 29.8 p . . . . . 0 C--O 1.252 1.185 0 C-N-CA 123.44 0.696 . . . . 74.409999999999997 110.205 179.113 . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 25.5 ptm . . . . . 0 N--CA 1.482 1.167 0 N-CA-C 110.621 -0.14 . . . . 72.329999999999998 110.621 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 40.3 p -57.06 -46.32 82.54 Favored 'General case' 0 N--CA 1.479 0.996 0 C-N-CA 123.802 0.841 . . . . 71.099999999999994 112.356 -175.784 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 23.5 m -70.79 -25.42 62.87 Favored 'General case' 0 N--CA 1.473 0.724 0 C-N-CA 123.265 0.626 . . . . 65.129999999999995 111.331 -179.518 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 25.5 m -75.56 -40.63 56.48 Favored 'General case' 0 C--N 1.35 0.602 0 C-N-CA 123.426 0.691 . . . . 64.329999999999998 110.839 178.1 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 92.8 t -67.85 -34.9 70.15 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.849 0 C-N-CA 123.543 0.737 . . . . 73.140000000000001 109.538 175.285 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . 0.509 ' O ' ' HG3' ' A' ' 10' ' ' ARG . 10.5 tm-20 -71.91 -32.32 67.27 Favored 'General case' 0 N--CA 1.472 0.668 0 C-N-CA 124.179 0.992 . . . . 72.109999999999999 110.226 176.504 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 7' ' ' PHE . . . . . 0.409 ' O ' ' HB2' ' A' ' 10' ' ' ARG . 62.3 t80 -70.68 -43.48 69.0 Favored 'General case' 0 N--CA 1.48 1.03 0 C-N-CA 123.871 0.868 . . . . 64.5 110.72 177.47 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . 0.515 HD11 HG22 ' A' ' 60' ' ' ILE . 84.5 mt -62.34 -39.21 83.38 Favored 'Isoleucine or valine' 0 C--O 1.212 -0.898 0 N-CA-C 109.178 -0.675 . . . . 75.140000000000001 109.178 173.326 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 3.3 t-20 -61.09 -38.03 84.81 Favored 'General case' 0 N--CA 1.483 1.177 0 C-N-CA 124.043 0.937 . . . . 73.209999999999994 111.086 175.866 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . 0.533 ' HB3' HG22 ' A' ' 47' ' ' VAL . 73.4 mtt180 -56.77 -53.77 53.94 Favored 'General case' 0 N--CA 1.475 0.811 0 O-C-N 123.82 0.7 . . . . 75.230000000000004 109.925 174.625 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 11' ' ' TRP . . . . . 0.407 ' CD1' HG11 ' A' ' 64' ' ' VAL . 99.7 m95 -75.59 -23.27 56.45 Favored 'General case' 0 N--CA 1.471 0.58 0 CA-C-N 114.918 -1.037 . . . . 75.540000000000006 113.107 -176.062 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 51.4 mt-30 -62.88 -46.7 86.6 Favored 'General case' 0 N--CA 1.47 0.556 0 N-CA-C 108.134 -1.061 . . . . 75.530000000000001 108.134 169.841 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 10.9 tpt180 -63.99 -48.39 76.58 Favored 'General case' 0 CA--C 1.54 0.59 0 CA-C-N 114.695 -1.139 . . . . 73.25 111.226 -175.721 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 14' ' ' ILE . . . . . 0.471 HD13 HG13 ' A' ' 44' ' ' ILE . 48.2 mt -64.62 -48.91 82.83 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.316 0 O-C-N 123.194 0.309 . . . . 71.25 110.287 -179.978 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . 0.576 ' HA ' ' HB ' ' A' ' 71' ' ' THR . . . -54.41 -45.56 72.97 Favored 'General case' 0 C--N 1.36 1.046 0 O-C-N 123.983 0.802 . . . . 74.299999999999997 111.163 -178.969 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 84.4 mt -78.73 -36.52 43.11 Favored 'General case' 0 N--CA 1.476 0.858 0 CA-C-N 114.989 -1.005 . . . . 55.340000000000003 112.124 -174.311 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . 0.436 ' O ' ' HG ' ' A' ' 21' ' ' LEU . 64.3 mt -67.54 -45.36 75.91 Favored 'General case' 0 N--CA 1.487 1.375 0 CA-C-N 118.057 0.39 . . . . 71.349999999999994 110.395 179.813 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 77.8 p -67.49 -37.25 82.58 Favored 'General case' 0 N--CA 1.477 0.901 0 C-N-CA 123.211 0.604 . . . . 74.109999999999999 110.79 176.794 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 6.9 tp-100 -61.13 -42.29 98.27 Favored 'General case' 0 C--N 1.357 0.906 0 O-C-N 123.701 0.626 . . . . 70.319999999999993 110.612 175.407 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 69.2 m -60.31 -49.5 77.36 Favored 'General case' 0 C--N 1.347 0.461 0 O-C-N 124.069 0.856 . . . . 73.420000000000002 109.686 176.37 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . 0.706 HD23 ' HA ' ' A' ' 33' ' ' LEU . 26.2 mt -61.36 -33.36 73.5 Favored 'General case' 0 CA--C 1.547 0.85 0 O-C-N 124.014 0.821 . . . . 71.310000000000002 110.917 -178.919 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . 0.71 ' HA ' HD22 ' A' ' 78' ' ' LEU . 56.0 tp -67.29 -54.01 24.62 Favored 'General case' 0 N--CA 1.482 1.139 0 C-N-CA 123.271 0.629 . . . . 73.409999999999997 110.692 179.74 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 42.5 mt-10 -56.53 -49.6 74.32 Favored 'General case' 0 N--CA 1.474 0.752 0 C-N-CA 124.335 1.054 . . . . 73.140000000000001 110.735 178.95 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . 0.407 HD23 HD12 ' A' ' 32' ' ' LEU . 91.5 mt -67.24 -33.74 75.98 Favored 'General case' 0 C--O 1.217 -0.62 0 CA-C-N 114.987 -1.006 . . . . 75.310000000000002 111.21 -176.133 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . 0.492 ' HB3' HD23 ' A' ' 33' ' ' LEU . . . -67.65 -42.62 81.92 Favored 'General case' 0 N--CA 1.483 1.208 0 C-N-CA 122.867 0.467 . . . . 74.420000000000002 111.594 177.699 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 97.1 mt-30 -70.97 -23.86 62.3 Favored 'General case' 0 N--CA 1.475 0.812 0 CA-C-N 115.532 -0.758 . . . . 73.299999999999997 111.069 176.678 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 79.0 mtt180 -78.68 -21.13 48.67 Favored 'General case' 0 N--CA 1.479 0.999 0 C-N-CA 123.562 0.745 . . . . 74.200000000000003 110.588 170.71 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 91.77 9.55 62.52 Favored Glycine 0 C--N 1.348 1.216 0 C-N-CA 123.05 0.357 . . . . 72.340000000000003 113.332 179.485 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 18.6 mm-40 -82.81 61.27 5.78 Favored 'General case' 0 CA--C 1.547 0.828 0 C-N-CA 124.622 1.169 . . . . 75.219999999999999 110.687 177.775 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 30' ' ' TRP . . . . . 0.402 ' O ' ' HG ' ' A' ' 34' ' ' LEU . 59.6 m95 -63.91 -29.71 70.86 Favored 'General case' 0 N--CA 1.484 1.25 0 C-N-CA 123.863 0.865 . . . . 74.209999999999994 110.999 -176.788 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 -56.21 -47.31 78.65 Favored 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 124.265 1.026 . . . . 64.310000000000002 110.287 175.718 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . 0.407 HD12 HD23 ' A' ' 24' ' ' LEU . 35.5 mt -64.59 -31.03 72.07 Favored 'General case' 0 N--CA 1.474 0.733 0 CA-C-N 115.16 -0.927 . . . . 72.0 110.927 -179.0 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . 0.706 ' HA ' HD23 ' A' ' 21' ' ' LEU . 10.5 mp -62.42 -49.01 77.19 Favored 'General case' 0 N--CA 1.477 0.884 0 N-CA-C 109.76 -0.459 . . . . 71.329999999999998 109.76 171.554 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . 0.402 ' HG ' ' O ' ' A' ' 30' ' ' TRP . 80.5 mt -58.01 -41.47 83.19 Favored 'General case' 0 N--CA 1.484 1.257 0 O-C-N 123.856 0.722 . . . . 74.150000000000006 112.397 -177.195 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 1.4 mp0 -73.81 -56.55 4.84 Favored 'General case' 0 N--CA 1.488 1.438 0 C-N-CA 122.859 0.464 . . . . 74.439999999999998 111.778 178.572 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 84.7 mm-40 -66.04 -19.71 65.94 Favored 'General case' 0 N--CA 1.488 1.46 0 C-N-CA 122.965 0.506 . . . . 74.549999999999997 111.793 -175.205 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . 0.456 ' O ' ' HG ' ' A' ' 41' ' ' LEU . 22.7 tt0 -60.02 -36.98 78.43 Favored 'General case' 0 C--N 1.358 0.969 0 C-N-CA 123.291 0.636 . . . . 73.099999999999994 111.277 179.578 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 62.2 t -53.1 -48.95 52.62 Favored 'Isoleucine or valine' 0 CA--C 1.556 1.182 0 C-N-CA 123.341 0.656 . . . . 74.340000000000003 110.764 -179.24 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 70.9 m -72.65 -33.2 66.43 Favored 'General case' 0 CA--C 1.537 0.444 0 CA-C-N 115.129 -0.941 . . . . 74.120000000000005 111.617 177.618 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 33.2 t80 -62.12 -40.75 96.97 Favored 'General case' 0 N--CA 1.481 1.08 0 C-N-CA 122.786 0.434 . . . . 73.150000000000006 110.984 176.24 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . 0.456 ' HG ' ' O ' ' A' ' 37' ' ' GLU . 56.0 mt -69.74 -52.78 22.43 Favored 'General case' 0 C--O 1.245 0.857 0 C-N-CA 123.953 0.901 . . . . 72.140000000000001 109.859 -178.28 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 53.2 tt0 -55.81 -49.97 71.8 Favored 'General case' 0 C--N 1.358 0.954 0 CA-C-N 114.882 -1.054 . . . . 73.510000000000005 110.832 -179.112 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 43' ' ' SER . . . . . 0.521 ' O ' HG21 ' A' ' 47' ' ' VAL . 66.1 m -60.94 -56.28 22.93 Favored 'General case' 0 C--N 1.348 0.541 0 O-C-N 123.991 0.807 . . . . 70.540000000000006 111.055 -178.78 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 44' ' ' ILE . . . . . 0.589 HG12 ' HE1' ' A' ' 48' ' ' MET . 11.9 tt -58.97 -42.77 87.09 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.192 0 O-C-N 123.692 0.62 . . . . 74.340000000000003 111.558 -171.806 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . 0.441 ' HG2' HD22 ' A' ' 92' ' ' LEU . 54.9 mm-40 -63.65 -44.96 92.3 Favored 'General case' 0 C--N 1.359 0.99 0 C-N-CA 122.705 0.402 . . . . 75.109999999999999 111.039 177.263 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 46' ' ' THR . . . . . 0.409 HG21 ' HZ1' ' A' ' 50' ' ' LYS . 99.2 m -55.93 -42.58 76.33 Favored 'General case' 0 N--CA 1.479 1.003 0 O-C-N 123.638 0.586 . . . . 75.530000000000001 111.248 177.55 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 47' ' ' VAL . . . . . 0.533 HG22 ' HB3' ' A' ' 10' ' ' ARG . 96.2 t -63.67 -46.45 94.69 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.701 0 C-N-CA 124.018 0.927 . . . . 75.040000000000006 111.074 -179.579 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 48' ' ' MET . . . . . 0.589 ' HE1' HG12 ' A' ' 44' ' ' ILE . 77.2 mtm -71.52 -25.89 62.43 Favored 'General case' 0 N--CA 1.478 0.939 0 CA-C-N 115.432 -0.804 . . . . 72.310000000000002 112.469 -176.55 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 54.9 mt-10 -94.3 -18.79 21.28 Favored 'General case' 0 N--CA 1.485 1.284 0 N-CA-C 112.544 0.572 . . . . 72.310000000000002 112.544 179.605 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . 0.409 ' HZ1' HG21 ' A' ' 46' ' ' THR . 1.3 mptm? -91.38 146.33 23.9 Favored 'General case' 0 N--CA 1.483 1.213 0 C-N-CA 122.981 0.512 . . . . 75.140000000000001 109.861 179.387 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 4.9 pt20 -70.75 143.54 51.21 Favored 'General case' 0 CA--C 1.537 0.479 0 C-N-CA 123.503 0.721 . . . . 74.239999999999995 112.806 -167.888 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 95.2 m -80.16 118.26 71.58 Favored Pre-proline 0 CA--C 1.55 0.949 0 C-N-CA 124.413 1.085 . . . . 74.219999999999999 108.735 172.007 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 31.8 Cg_endo -61.99 153.37 69.18 Favored 'Trans proline' 0 C--N 1.374 1.884 0 C-N-CA 122.28 1.987 . . . . 74.319999999999993 112.14 -179.266 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 45.6 Cg_endo -68.27 -46.86 1.88 Allowed 'Trans proline' 0 C--N 1.371 1.757 0 C-N-CA 122.612 2.208 . . . . 62.119999999999997 112.216 179.236 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . -74.24 79.4 0.91 Allowed Glycine 0 C--N 1.349 1.28 0 O-C-N 123.591 0.557 . . . . 72.409999999999997 113.23 -176.571 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 56' ' ' ILE . . . . . 0.452 ' HB ' HD21 ' A' ' 113' ' ' LEU . 66.9 mt -128.49 107.84 16.56 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.79 0 C-N-CA 124.858 1.263 . . . . 74.239999999999995 107.704 175.554 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 38.4 p -82.4 -178.44 7.05 Favored 'General case' 0 CA--C 1.542 0.662 0 C-N-CA 123.506 0.722 . . . . 64.420000000000002 110.989 -179.678 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 25.1 tpt180 -53.71 -55.61 24.6 Favored 'General case' 0 N--CA 1.475 0.802 0 C-N-CA 124.892 1.277 . . . . 74.329999999999998 111.884 -177.329 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 17.5 m -59.6 -40.31 87.06 Favored 'General case' 0 N--CA 1.478 0.954 0 O-C-N 123.782 0.676 . . . . 74.430000000000007 112.107 -177.542 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 60' ' ' ILE . . . . . 0.515 HG22 HD11 ' A' ' 8' ' ' ILE . 66.4 mt -66.42 -40.8 87.52 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.75 0 O-C-N 123.941 0.775 . . . . 74.439999999999998 110.61 178.625 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 61.1 tt0 -64.17 -38.62 91.73 Favored 'General case' 0 CA--C 1.543 0.711 0 C-N-CA 124.288 1.035 . . . . 75.120000000000005 110.524 -179.049 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 43.4 m-20 -72.8 -38.14 67.32 Favored 'General case' 0 N--CA 1.476 0.868 0 CA-C-N 115.661 -0.699 . . . . 71.439999999999998 111.731 177.815 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 63' ' ' MET . . . . . . . . . . . . . 74.1 mtm -65.23 -48.23 74.04 Favored 'General case' 0 N--CA 1.486 1.327 0 C-N-CA 122.291 0.236 . . . . 72.439999999999998 110.963 177.841 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 64' ' ' VAL . . . . . 0.498 ' O ' HG13 ' A' ' 68' ' ' ILE . 75.7 t -61.87 -55.93 21.06 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.589 0 C-N-CA 123.554 0.742 . . . . 65.010000000000005 110.729 179.188 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -63.59 -27.36 69.19 Favored 'General case' 0 N--CA 1.485 1.32 0 C-N-CA 122.416 0.286 . . . . 74.540000000000006 111.368 -179.396 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -67.23 -40.11 92.28 Favored Glycine 0 C--N 1.349 1.271 0 O-C-N 123.66 0.6 . . . . 51.420000000000002 112.063 174.677 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 18.6 m-30 -71.39 -35.44 71.04 Favored 'General case' 0 N--CA 1.472 0.656 0 C-N-CA 123.499 0.72 . . . . 73.230000000000004 111.624 176.866 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 68' ' ' ILE . . . . . 0.511 ' O ' ' HG ' ' A' ' 72' ' ' LEU . 20.3 mt -63.55 -48.92 84.72 Favored 'Isoleucine or valine' 0 C--N 1.358 0.947 0 N-CA-C 108.162 -1.051 . . . . 74.019999999999996 108.162 176.541 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 69' ' ' LYS . . . . . 0.537 ' HB2' ' HE2' ' A' ' 106' ' ' TYR . 46.6 tptt -53.74 -47.71 70.36 Favored 'General case' 0 N--CA 1.481 1.079 0 C-N-CA 124.239 1.016 . . . . 71.450000000000003 110.879 176.76 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 62.4 tt0 -60.99 -46.04 92.37 Favored 'General case' 0 CA--C 1.535 0.39 0 O-C-N 124.094 0.871 . . . . 73.120000000000005 110.97 -177.638 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 71' ' ' THR . . . . . 0.576 ' HB ' ' HA ' ' A' ' 15' ' ' ALA . 13.1 t -79.16 -21.29 46.66 Favored 'General case' 0 C--N 1.352 0.683 0 CA-C-O 118.904 -0.57 . . . . 72.319999999999993 111.45 -176.017 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 72' ' ' LEU . . . . . 0.511 ' HG ' ' O ' ' A' ' 68' ' ' ILE . 25.2 mt -75.98 -31.72 59.13 Favored 'General case' 0 N--CA 1.486 1.354 0 N-CA-C 109.802 -0.444 . . . . 72.010000000000005 109.802 173.385 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 97.8 m-20 -70.33 -51.12 32.44 Favored 'General case' 0 N--CA 1.469 0.491 0 O-C-N 123.744 0.652 . . . . 73.420000000000002 109.842 174.723 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 67.4 m-20 -57.35 -42.96 83.0 Favored 'General case' 0 N--CA 1.479 0.997 0 O-C-N 123.96 0.788 . . . . 73.329999999999998 109.912 178.314 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 53.5 tp10 -58.54 -56.37 23.03 Favored 'General case' 0 N--CA 1.473 0.68 0 C-N-CA 124.494 1.117 . . . . 75.120000000000005 110.712 177.202 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 10.1 tt0 -65.67 -39.05 90.91 Favored 'General case' 0 N--CA 1.477 0.897 0 C-N-CA 122.724 0.41 . . . . 72.510000000000005 111.786 -174.441 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 92.9 mt -64.58 -47.74 77.55 Favored 'General case' 0 N--CA 1.478 0.934 0 C-N-CA 123.349 0.66 . . . . 75.219999999999999 110.524 179.881 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . 0.71 HD22 ' HA ' ' A' ' 22' ' ' LEU . 42.5 mt -61.01 -61.86 2.27 Favored 'General case' 0 N--CA 1.482 1.128 0 C-N-CA 123.968 0.907 . . . . 73.209999999999994 111.985 178.68 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 79' ' ' LYS . . . . . 0.495 ' HB3' ' H ' ' A' ' 87' ' ' ASP . 43.9 mmtm -67.17 -38.04 84.75 Favored 'General case' 0 CA--C 1.543 0.679 0 CA-C-N 113.872 -1.513 . . . . 74.400000000000006 110.356 -171.563 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -68.94 -29.69 72.44 Favored Glycine 0 C--N 1.343 0.939 0 CA-C-N 115.822 -0.626 . . . . 71.109999999999999 113.037 175.957 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 8.5 tt -63.14 -44.79 94.56 Favored 'General case' 0 N--CA 1.475 0.81 0 N-CA-C 109.044 -0.725 . . . . 71.010000000000005 109.044 171.016 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 82' ' ' LEU . . . . . 0.425 ' HG ' ' O ' ' A' ' 78' ' ' LEU . 67.4 mt -66.3 -66.39 0.56 Allowed 'General case' 0 N--CA 1.477 0.875 0 O-C-N 123.663 0.602 . . . . 72.099999999999994 110.497 -178.411 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 23.5 mt-30 -148.8 -62.93 0.24 Allowed 'General case' 0 N--CA 1.482 1.171 0 C-N-CA 124.335 1.054 . . . . 74.129999999999995 110.447 179.508 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 10.8 pt20 -135.58 151.78 50.61 Favored 'General case' 0 N--CA 1.492 1.667 0 C-N-CA 123.273 0.629 . . . . 72.209999999999994 111.27 -169.497 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 85' ' ' ARG . . . . . . . . . . . . . 7.3 ptp85 -48.86 -31.38 7.07 Favored 'General case' 0 N--CA 1.497 1.918 0 C-N-CA 125.288 1.435 . . . . 73.120000000000005 114.064 -172.212 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 85.4 mt -126.7 79.28 1.86 Allowed 'General case' 0 N--CA 1.472 0.632 0 N-CA-C 107.631 -1.248 . . . . 74.150000000000006 107.631 174.807 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 87' ' ' ASP . . . . . 0.495 ' H ' ' HB3' ' A' ' 79' ' ' LYS . 23.2 t70 -94.85 152.01 18.75 Favored 'General case' 0 N--CA 1.475 0.809 0 C-N-CA 124.581 1.152 . . . . 74.219999999999999 110.46 -174.769 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 8.0 mp0 -94.84 95.62 8.8 Favored 'General case' 0 C--O 1.242 0.665 0 CA-C-N 115.523 -0.762 . . . . 64.25 109.857 -175.454 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 75.2 mt -64.49 -66.24 0.57 Allowed 'General case' 0 N--CA 1.48 1.029 0 N-CA-C 107.437 -1.32 . . . . 73.299999999999997 107.437 165.604 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 40.2 m -126.34 0.23 7.01 Favored 'General case' 0 N--CA 1.481 1.082 0 C-N-CA 124.372 1.069 . . . . 72.129999999999995 110.145 167.218 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 11.9 t 68.16 -179.63 0.22 Allowed 'General case' 0 N--CA 1.483 1.186 0 C-N-CA 125.2 1.4 . . . . 75.019999999999996 112.13 178.77 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 92' ' ' LEU . . . . . 0.441 HD22 ' HG2' ' A' ' 45' ' ' GLU . 40.5 mt -123.85 -72.45 0.68 Allowed 'General case' 0 N--CA 1.478 0.944 0 C-N-CA 123.83 0.852 . . . . 74.430000000000007 109.598 176.158 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 93' ' ' ILE . . . . . 0.478 ' HB ' ' HA ' ' A' ' 97' ' ' THR . 35.2 mt -120.44 146.39 25.38 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.06 0 C-N-CA 124.093 0.957 . . . . 72.450000000000003 109.072 -177.755 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -64.46 126.7 33.46 Favored Glycine 0 C--N 1.344 0.988 0 O-C-N 123.316 0.385 . . . . 63.219999999999999 112.585 177.09 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 17.4 mt-30 66.18 -85.76 0.03 OUTLIER 'General case' 0 N--CA 1.477 0.905 0 C-N-CA 125.038 1.335 . . . . 73.299999999999997 111.584 179.247 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 22.7 m -92.39 102.94 15.42 Favored 'General case' 0 N--CA 1.467 0.384 0 C-N-CA 123.547 0.739 . . . . 61.020000000000003 109.624 -177.908 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 97' ' ' THR . . . . . 0.586 HG23 ' H ' ' A' ' 99' ' ' GLN . 97.1 m -93.16 155.64 17.34 Favored 'General case' 0 CA--C 1.55 0.949 0 C-N-CA 123.869 0.868 . . . . 75.129999999999995 109.916 173.036 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 30.7 mmt180 -58.16 -13.26 4.56 Favored 'General case' 0 CA--C 1.556 1.181 0 C-N-CA 125.291 1.436 . . . . 72.340000000000003 113.016 175.554 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 99' ' ' GLN . . . . . 0.586 ' H ' HG23 ' A' ' 97' ' ' THR . 12.5 pt20 -57.89 -29.8 65.34 Favored 'General case' 0 N--CA 1.491 1.601 0 C-N-CA 124.34 1.056 . . . . 74.430000000000007 112.069 176.444 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 27.5 ttpp -68.3 -46.47 70.21 Favored 'General case' 0 N--CA 1.478 0.944 0 N-CA-C 109.061 -0.718 . . . . 74.219999999999999 109.061 173.65 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 48.7 m -72.1 -12.68 61.31 Favored 'General case' 0 N--CA 1.479 1.011 0 C-N-CA 124.307 1.043 . . . . 70.299999999999997 111.941 174.897 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 102' ' ' LEU . . . . . 0.545 HD12 ' SD ' ' A' ' 48' ' ' MET . 24.7 tp -76.49 -48.26 20.11 Favored 'General case' 0 N--CA 1.483 1.188 0 C-N-CA 124.751 1.22 . . . . 75.319999999999993 109.19 177.098 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 9.2 t30 -65.53 -37.87 87.99 Favored 'General case' 0 CA--C 1.553 1.087 0 CA-C-N 114.672 -1.149 . . . . 72.25 110.536 173.433 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 104' ' ' ASN . . . . . 0.406 ' O ' ' HG2' ' A' ' 108' ' ' ARG . 24.5 t-20 -70.03 -32.54 70.74 Favored 'General case' 0 N--CA 1.478 0.947 0 CA-C-N 115.611 -0.722 . . . . 63.409999999999997 110.936 175.952 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -63.69 -40.23 96.29 Favored 'General case' 0 N--CA 1.48 1.072 0 C-N-CA 123.572 0.749 . . . . 75.140000000000001 110.165 175.853 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 106' ' ' TYR . . . . . 0.537 ' HE2' ' HB2' ' A' ' 69' ' ' LYS . 2.9 t80 -57.34 -51.97 67.24 Favored 'General case' 0 C--N 1.353 0.758 0 O-C-N 124.274 0.983 . . . . 71.510000000000005 109.443 172.016 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -53.19 -55.01 26.4 Favored Glycine 0 C--N 1.353 1.49 0 O-C-N 124.133 0.896 . . . . 42.509999999999998 114.204 -177.179 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 108' ' ' ARG . . . . . 0.625 ' HG3' ' HA ' ' A' ' 114' ' ' LEU . 17.2 ptp180 -66.6 -31.43 72.12 Favored 'General case' 0 CA--C 1.548 0.897 0 C-N-CA 123.295 0.638 . . . . 75.319999999999993 111.905 178.983 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 109' ' ' LEU . . . . . 0.518 ' HA ' ' N ' ' A' ' 114' ' ' LEU . 56.4 tp -68.05 -45.81 72.87 Favored 'General case' 0 N--CA 1.484 1.247 0 C-N-CA 122.645 0.378 . . . . 75.420000000000002 111.096 176.505 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 11.6 t -72.23 -29.54 64.04 Favored 'General case' 0 CA--C 1.54 0.595 0 CA-C-N 115.344 -0.843 . . . . 44.539999999999999 109.84 -174.659 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . -88.03 -62.96 1.4 Allowed Glycine 0 C--N 1.36 1.905 0 CA-C-O 119.364 -0.687 . . . . 72.420000000000002 113.844 -179.928 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 112' ' ' MET . . . . . 0.593 ' HG3' ' HB3' ' A' ' 117' ' ' ASP . 1.0 OUTLIER -98.99 -69.92 0.75 Allowed 'General case' 0 N--CA 1.485 1.31 0 CA-C-N 118.622 1.211 . . . . 74.450000000000003 112.065 177.576 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 113' ' ' LEU . . . . . 0.452 HD21 ' HB ' ' A' ' 56' ' ' ILE . 0.9 OUTLIER 163.29 51.2 0.0 OUTLIER 'General case' 0 N--CA 1.497 1.899 0 C-N-CA 125.746 1.618 . . . . 75.519999999999996 108.228 -174.322 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 114' ' ' LEU . . . . . 0.625 ' HA ' ' HG3' ' A' ' 108' ' ' ARG . 0.3 OUTLIER 69.31 11.52 8.15 Favored 'General case' 0 N--CA 1.487 1.414 0 C-N-CA 125.574 1.55 . . . . 74.310000000000002 112.934 171.221 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 115' ' ' VAL . . . . . . . . . . . . . 25.0 m -127.19 140.67 38.5 Favored Pre-proline 0 CA--C 1.552 1.022 0 C-N-CA 123.499 0.72 . . . . 74.340000000000003 109.102 171.499 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 24.3 Cg_exo -63.79 99.83 0.28 Allowed 'Trans proline' 0 C--N 1.378 2.1 0 C-N-CA 122.766 2.31 . . . . 75.230000000000004 111.219 174.347 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 117' ' ' ASP . . . . . 0.593 ' HB3' ' HG3' ' A' ' 112' ' ' MET . 32.4 t70 -167.09 21.82 0.03 OUTLIER 'General case' 0 N--CA 1.483 1.192 0 C-N-CA 124.007 0.923 . . . . 74.519999999999996 109.487 -175.662 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -63.26 137.45 97.07 Favored Pre-proline 0 N--CA 1.482 1.146 0 C-N-CA 123.465 0.706 . . . . 61.539999999999999 112.314 -172.735 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 119' ' ' PRO . . . . . . . . . . . . . 23.1 Cg_exo -64.91 147.71 89.43 Favored 'Trans proline' 0 C--N 1.38 2.194 0 C-N-CA 123.187 2.591 . . . . 74.239999999999995 112.68 -179.691 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . -73.61 -13.61 80.16 Favored Glycine 0 CA--C 1.529 0.932 0 CA-C-N 115.889 -0.596 . . . . 62.219999999999999 113.016 175.18 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . -135.13 112.02 10.18 Favored 'General case' 0 CA--C 1.536 0.44 0 C-N-CA 124.594 1.158 . . . . 62.549999999999997 108.731 175.606 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 122' ' ' SER . . . . . . . . . . . . . 22.8 m . . . . . 0 C--O 1.25 1.106 0 N-CA-C 107.876 -1.157 . . . . 71.200000000000003 107.876 176.447 . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 23.5 ttt . . . . . 0 N--CA 1.488 1.439 0 CA-C-O 119.475 -0.298 . . . . 73.25 111.326 . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 27.2 p -47.13 -39.02 12.61 Favored 'General case' 0 N--CA 1.497 1.885 0 N-CA-C 113.634 0.975 . . . . 74.140000000000001 113.634 -174.25 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 16.6 m -65.19 -45.35 85.16 Favored 'General case' 0 N--CA 1.478 0.932 0 C-N-CA 123.249 0.62 . . . . 73.109999999999999 111.464 178.384 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 4' ' ' THR . . . . . 0.518 ' HA ' ' HG3' ' A' ' 53' ' ' PRO . 5.2 m -70.96 -37.21 72.78 Favored 'General case' 0 N--CA 1.476 0.863 0 C-N-CA 123.351 0.66 . . . . 65.319999999999993 111.822 179.947 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 69.9 t -62.1 -47.58 92.48 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.84 0 C-N-CA 123.258 0.623 . . . . 74.310000000000002 109.758 178.529 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 44.9 mm-40 -57.27 -51.72 68.21 Favored 'General case' 0 N--CA 1.473 0.718 0 CA-C-N 115.778 -0.646 . . . . 54.109999999999999 110.927 172.205 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 40.7 t80 -57.32 -50.3 73.36 Favored 'General case' 0 CA--C 1.552 1.024 0 C-N-CA 124.197 0.999 . . . . 74.239999999999995 111.849 -173.853 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . 0.407 ' O ' ' HG3' ' A' ' 12' ' ' GLN . 83.6 mt -62.38 -46.25 96.87 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.065 0 C-N-CA 123.977 0.911 . . . . 71.349999999999994 110.237 177.337 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 25.1 t-20 -67.09 -27.69 67.57 Favored 'General case' 0 N--CA 1.486 1.351 0 C-N-CA 123.781 0.833 . . . . 73.120000000000005 112.032 -176.441 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . 0.459 ' O ' HG13 ' A' ' 14' ' ' ILE . 96.5 mtt180 -76.23 -38.41 56.39 Favored 'General case' 0 N--CA 1.469 0.484 0 N-CA-C 109.041 -0.726 . . . . 74.209999999999994 109.041 175.325 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 11' ' ' TRP . . . . . 0.518 ' HH2' ' HG ' ' A' ' 102' ' ' LEU . 57.0 m95 -67.42 -29.65 69.19 Favored 'General case' 0 N--CA 1.484 1.274 0 C-N-CA 123.055 0.542 . . . . 75.120000000000005 111.696 172.152 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . 0.407 ' HG3' ' O ' ' A' ' 8' ' ' ILE . 52.7 mt-30 -64.08 -49.45 72.2 Favored 'General case' 0 N--CA 1.472 0.65 0 N-CA-C 107.671 -1.233 . . . . 74.129999999999995 107.671 171.773 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 53.5 ttt180 -60.85 -43.25 98.59 Favored 'General case' 0 CA--C 1.548 0.898 0 CA-C-N 114.996 -1.002 . . . . 75.5 111.382 -176.303 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 14' ' ' ILE . . . . . 0.459 HG13 ' O ' ' A' ' 10' ' ' ARG . 64.2 mt -66.52 -47.41 83.74 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.388 0 C-N-CA 122.731 0.412 . . . . 74.209999999999994 109.899 178.782 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . 0.599 ' HA ' ' HB ' ' A' ' 71' ' ' THR . . . -58.63 -43.71 89.8 Favored 'General case' 0 N--CA 1.486 1.343 0 C-N-CA 123.888 0.875 . . . . 72.310000000000002 111.824 -179.53 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 96.4 mt -81.83 -34.55 30.13 Favored 'General case' 0 N--CA 1.483 1.176 0 CA-C-N 114.613 -1.176 . . . . 74.030000000000001 111.112 -173.591 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . 0.466 ' O ' ' HG ' ' A' ' 21' ' ' LEU . 25.3 mt -65.18 -51.76 59.06 Favored 'General case' 0 N--CA 1.486 1.352 0 N-CA-C 109.589 -0.523 . . . . 75.230000000000004 109.589 176.0 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 80.9 p -63.6 -37.32 86.9 Favored 'General case' 0 N--CA 1.48 1.028 0 C-N-CA 123.389 0.675 . . . . 74.299999999999997 111.557 -179.484 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 6.4 tp-100 -58.58 -50.14 74.91 Favored 'General case' 0 N--CA 1.476 0.866 0 O-C-N 123.613 0.57 . . . . 75.420000000000002 110.582 173.685 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 70.9 m -58.0 -49.91 75.21 Favored 'General case' 0 C--O 1.207 -1.161 0 CA-C-N 115.167 -0.924 . . . . 74.25 110.18 176.923 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . 0.578 HD22 ' HA ' ' A' ' 33' ' ' LEU . 92.4 mt -63.21 -29.88 71.14 Favored 'General case' 0 N--CA 1.474 0.772 0 C-N-CA 123.783 0.833 . . . . 74.409999999999997 111.393 -175.627 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . 0.565 ' HA ' HD22 ' A' ' 78' ' ' LEU . 58.9 tp -68.56 -53.95 19.69 Favored 'General case' 0 C--O 1.252 1.19 0 C-N-CA 123.063 0.545 . . . . 62.030000000000001 110.221 176.903 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . 0.534 ' HB3' ' HE ' ' A' ' 27' ' ' ARG . 46.1 mt-10 -55.37 -51.2 67.58 Favored 'General case' 0 N--CA 1.475 0.798 0 CA-C-N 114.775 -1.102 . . . . 75.329999999999998 110.024 177.749 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . 0.42 HD22 HD11 ' A' ' 32' ' ' LEU . 95.4 mt -60.6 -39.73 89.21 Favored 'General case' 0 N--CA 1.476 0.873 0 C-N-CA 125.382 1.473 . . . . 72.099999999999994 111.589 -176.683 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . 0.498 ' HB3' HD21 ' A' ' 33' ' ' LEU . . . -59.76 -48.87 79.95 Favored 'General case' 0 N--CA 1.481 1.106 0 C-N-CA 123.097 0.559 . . . . 74.109999999999999 110.823 176.168 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 95.6 mt-30 -66.63 -30.38 70.64 Favored 'General case' 0 CA--C 1.552 1.049 0 CA-C-N 114.901 -1.045 . . . . 65.400000000000006 111.633 178.919 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . 0.534 ' HE ' ' HB3' ' A' ' 23' ' ' GLU . 44.5 mtt-85 -76.28 -25.45 54.92 Favored 'General case' 0 N--CA 1.488 1.448 0 C-N-CA 123.473 0.709 . . . . 74.219999999999999 110.846 176.856 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 98.18 9.54 53.49 Favored Glycine 0 C--N 1.348 1.221 0 CA-C-N 116.364 -0.38 . . . . 71.219999999999999 113.244 -177.825 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . 0.4 ' HB2' ' HB3' ' A' ' 24' ' ' LEU . 12.8 mm-40 -80.13 57.41 2.69 Favored 'General case' 0 CA--C 1.55 0.976 0 C-N-CA 124.508 1.123 . . . . 72.420000000000002 110.482 174.985 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 30' ' ' TRP . . . . . 0.437 ' O ' ' HG ' ' A' ' 34' ' ' LEU . 89.2 m95 -62.0 -35.29 78.08 Favored 'General case' 0 N--CA 1.482 1.169 0 C-N-CA 124.218 1.007 . . . . 73.25 111.51 -175.892 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 6.2 m-20 -54.23 -40.01 67.28 Favored 'General case' 0 N--CA 1.476 0.871 0 C-N-CA 124.766 1.226 . . . . 73.420000000000002 111.51 179.619 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . 0.42 HD11 HD22 ' A' ' 24' ' ' LEU . 87.9 mt -69.1 -31.23 69.8 Favored 'General case' 0 CA--C 1.543 0.685 0 CA-C-N 115.096 -0.956 . . . . 64.319999999999993 110.981 179.112 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . 0.578 ' HA ' HD22 ' A' ' 21' ' ' LEU . 8.5 mp -70.48 -40.3 73.72 Favored 'General case' 0 N--CA 1.491 1.604 0 C-N-CA 122.252 0.221 . . . . 70.519999999999996 110.57 173.051 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . 0.437 ' HG ' ' O ' ' A' ' 30' ' ' TRP . 82.6 mt -65.1 -40.65 94.87 Favored 'General case' 0 N--CA 1.479 0.986 0 C-N-CA 123.648 0.779 . . . . 71.129999999999995 111.364 -176.916 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 1.6 mp0 -80.32 -55.76 4.67 Favored 'General case' 0 N--CA 1.473 0.72 0 C-N-CA 123.429 0.692 . . . . 71.150000000000006 111.197 178.541 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 36' ' ' GLN . . . . . 0.409 ' HB2' HD23 ' A' ' 21' ' ' LEU . 84.1 mm-40 -64.44 -13.08 49.55 Favored 'General case' 0 N--CA 1.494 1.768 0 N-CA-C 113.088 0.773 . . . . 75.010000000000005 113.088 -178.935 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . 0.455 ' O ' ' HG ' ' A' ' 41' ' ' LEU . 43.4 tt0 -47.55 -49.43 26.42 Favored 'General case' 0 N--CA 1.478 0.952 0 C-N-CA 122.914 0.486 . . . . 73.019999999999996 110.454 169.296 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 40.9 t -57.1 -53.75 39.18 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.088 0 O-C-N 124.061 0.851 . . . . 75.219999999999999 111.897 -176.906 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 46.4 p -69.09 -34.17 74.67 Favored 'General case' 0 N--CA 1.483 1.179 0 C-N-CA 122.801 0.44 . . . . 71.340000000000003 111.926 -177.399 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 40.9 t80 -64.9 -42.88 94.4 Favored 'General case' 0 N--CA 1.475 0.815 0 C-N-CA 123.513 0.725 . . . . 74.430000000000007 110.064 176.836 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . 0.46 HD11 ' HB2' ' A' ' 91' ' ' SER . 96.6 mt -60.81 -44.35 96.97 Favored 'General case' 0 C--N 1.35 0.627 0 O-C-N 124.192 0.932 . . . . 74.129999999999995 109.856 175.117 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 47.6 tt0 -63.86 -42.6 97.5 Favored 'General case' 0 N--CA 1.473 0.724 0 O-C-N 123.269 0.356 . . . . 74.219999999999999 110.761 -179.246 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 30.9 m -59.82 -53.76 54.2 Favored 'General case' 0 N--CA 1.482 1.156 0 C-N-CA 123.157 0.583 . . . . 72.150000000000006 111.355 -179.047 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 44' ' ' ILE . . . . . 0.516 HG12 ' HE2' ' A' ' 48' ' ' MET . 11.5 tt -66.1 -33.99 67.27 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.054 0 CA-C-N 115.072 -0.967 . . . . 72.329999999999998 111.054 -176.706 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 10.1 mm-40 -64.15 -44.93 90.64 Favored 'General case' 0 N--CA 1.484 1.251 0 C-N-CA 123.119 0.568 . . . . 73.129999999999995 111.307 172.774 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 46' ' ' THR . . . . . 0.422 ' O ' ' HB2' ' A' ' 50' ' ' LYS . 67.7 m -62.8 -34.06 76.49 Favored 'General case' 0 N--CA 1.478 0.932 0 C-N-CA 122.65 0.38 . . . . 75.420000000000002 110.969 -177.882 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 47' ' ' VAL . . . . . . . . . . . . . 58.3 t -71.46 -51.82 30.68 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.021 0 N-CA-C 111.615 0.228 . . . . 64.310000000000002 111.615 175.518 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 48' ' ' MET . . . . . 0.516 ' HE2' HG12 ' A' ' 44' ' ' ILE . 75.6 mtm -67.85 -32.84 73.64 Favored 'General case' 0 N--CA 1.488 1.473 0 N-CA-C 112.899 0.703 . . . . 72.549999999999997 112.899 -172.777 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 49.6 mt-10 -84.02 -34.42 24.29 Favored 'General case' 0 N--CA 1.483 1.198 0 C-N-CA 123.371 0.668 . . . . 64.510000000000005 111.626 -178.632 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . 0.422 ' HB2' ' O ' ' A' ' 46' ' ' THR . 13.8 mptt -79.86 164.08 23.86 Favored 'General case' 0 N--CA 1.483 1.186 0 CA-C-O 121.181 0.515 . . . . 75.25 110.699 -179.677 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 8.9 tt0 -82.83 138.39 33.97 Favored 'General case' 0 C--O 1.241 0.61 0 CA-C-N 115.046 -0.979 . . . . 70.430000000000007 110.65 -172.361 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 52' ' ' THR . . . . . 0.674 HG21 ' HB3' ' A' ' 114' ' ' LEU . 39.1 m -72.29 123.59 89.69 Favored Pre-proline 0 CA--C 1.556 1.187 0 N-CA-C 109.178 -0.675 . . . . 72.140000000000001 109.178 171.914 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 53' ' ' PRO . . . . . 0.518 ' HG3' ' HA ' ' A' ' 4' ' ' THR . 61.7 Cg_endo -69.3 155.46 67.39 Favored 'Trans proline' 0 C--N 1.376 2.01 0 C-N-CA 123.162 2.575 . . . . 74.530000000000001 112.675 -176.664 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 43.9 Cg_endo -67.98 -47.29 1.86 Allowed 'Trans proline' 0 C--N 1.377 2.063 0 C-N-CA 122.367 2.045 . . . . 72.400000000000006 112.258 175.004 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . -69.97 80.1 0.36 Allowed Glycine 0 C--N 1.352 1.46 0 O-C-N 123.566 0.541 . . . . 75.450000000000003 113.656 -175.796 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 77.7 mt -125.86 98.4 4.96 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.526 0 N-CA-C 107.91 -1.144 . . . . 75.450000000000003 107.91 175.085 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 78.5 p -74.45 -179.65 4.12 Favored 'General case' 0 N--CA 1.473 0.712 0 C-N-CA 122.867 0.467 . . . . 72.400000000000006 109.917 175.373 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 21.1 tpt180 -64.99 -40.03 94.35 Favored 'General case' 0 N--CA 1.476 0.828 0 N-CA-C 110.371 -0.233 . . . . 74.109999999999999 110.371 177.79 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 51.9 m -60.25 -45.24 93.94 Favored 'General case' 0 N--CA 1.478 0.953 0 C-N-CA 123.309 0.644 . . . . 62.340000000000003 111.4 177.005 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 60' ' ' ILE . . . . . 0.404 HD11 HG23 ' A' ' 4' ' ' THR . 80.1 mt -64.8 -39.13 84.61 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.971 0 CA-C-N 115.479 -0.782 . . . . 74.019999999999996 110.377 177.272 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 63.2 tt0 -63.18 -41.95 99.28 Favored 'General case' 0 N--CA 1.482 1.143 0 C-N-CA 124.012 0.925 . . . . 73.109999999999999 111.131 179.525 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 52.3 m-20 -69.4 -41.54 76.28 Favored 'General case' 0 N--CA 1.477 0.91 0 C-N-CA 123.163 0.585 . . . . 73.420000000000002 111.503 179.78 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 63' ' ' MET . . . . . . . . . . . . . 64.9 mtm -65.88 -52.3 51.41 Favored 'General case' 0 N--CA 1.485 1.295 0 C-N-CA 122.351 0.26 . . . . 73.540000000000006 111.311 178.477 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 64' ' ' VAL . . . . . 0.521 ' O ' HG13 ' A' ' 68' ' ' ILE . 71.4 t -60.99 -55.84 21.99 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.998 0 C-N-CA 123.456 0.702 . . . . 72.239999999999995 110.563 -178.957 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . 0.512 ' HB3' HD23 ' A' ' 109' ' ' LEU . . . -61.33 -37.8 84.61 Favored 'General case' 0 N--CA 1.488 1.455 0 O-C-N 123.478 0.486 . . . . 71.239999999999995 111.406 179.715 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -60.98 -37.17 93.41 Favored Glycine 0 C--N 1.346 1.109 0 CA-C-N 116.413 -0.358 . . . . 74.129999999999995 112.383 176.521 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 19.3 m-30 -75.86 -34.23 60.04 Favored 'General case' 0 N--CA 1.476 0.846 0 C-N-CA 123.137 0.575 . . . . 73.340000000000003 111.622 177.018 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 68' ' ' ILE . . . . . 0.521 HG13 ' O ' ' A' ' 64' ' ' VAL . 61.5 mt -59.69 -53.57 46.48 Favored 'Isoleucine or valine' 0 C--N 1.357 0.923 0 N-CA-C 108.808 -0.812 . . . . 72.420000000000002 108.808 175.812 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 69' ' ' LYS . . . . . 0.519 ' HB2' ' HE2' ' A' ' 106' ' ' TYR . 0.6 OUTLIER -59.77 -46.28 89.67 Favored 'General case' 0 C--N 1.348 0.507 0 CA-C-N 115.359 -0.837 . . . . 74.230000000000004 110.274 179.919 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 63.3 tt0 -57.08 -45.86 82.98 Favored 'General case' 0 C--N 1.352 0.675 0 O-C-N 124.564 1.165 . . . . 65.120000000000005 111.398 -178.589 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 71' ' ' THR . . . . . 0.599 ' HB ' ' HA ' ' A' ' 15' ' ' ALA . 15.1 t -79.66 -21.94 44.13 Favored 'General case' 0 C--O 1.216 -0.684 0 CA-C-O 119.188 -0.434 . . . . 73.209999999999994 110.559 -174.657 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 72' ' ' LEU . . . . . 0.512 ' HG ' ' O ' ' A' ' 68' ' ' ILE . 44.0 mt -74.62 -31.84 62.12 Favored 'General case' 0 N--CA 1.483 1.207 0 O-C-N 123.321 0.388 . . . . 74.150000000000006 110.521 172.122 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 73' ' ' ASP . . . . . 0.417 ' O ' ' HG ' ' A' ' 77' ' ' LEU . 48.5 m-20 -64.1 -60.17 3.55 Favored 'General case' 0 C--N 1.351 0.654 0 N-CA-C 108.627 -0.879 . . . . 74.349999999999994 108.627 172.702 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 48.4 m-20 -55.48 -41.35 72.86 Favored 'General case' 0 N--CA 1.483 1.21 0 C-N-CA 124.354 1.062 . . . . 74.5 111.335 -178.309 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . 0.535 ' O ' ' HG2' ' A' ' 79' ' ' LYS . 5.3 tp10 -58.88 -59.03 6.1 Favored 'General case' 0 N--CA 1.476 0.851 0 C-N-CA 124.348 1.059 . . . . 71.299999999999997 109.879 178.447 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 9.4 tt0 -72.45 -26.1 61.7 Favored 'General case' 0 CA--C 1.548 0.891 0 O-C-N 124.128 0.892 . . . . 75.209999999999994 111.851 -171.999 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . 0.417 ' HG ' ' O ' ' A' ' 73' ' ' ASP . 97.4 mt -67.61 -43.25 80.9 Favored 'General case' 0 N--CA 1.481 1.08 0 N-CA-C 109.246 -0.65 . . . . 73.019999999999996 109.246 174.165 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . 0.565 HD22 ' HA ' ' A' ' 22' ' ' LEU . 28.9 mt -57.3 -46.05 83.54 Favored 'General case' 0 N--CA 1.48 1.032 0 O-C-N 123.726 0.641 . . . . 75.420000000000002 111.196 169.55 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 79' ' ' LYS . . . . . 0.535 ' HG2' ' O ' ' A' ' 75' ' ' GLU . 36.2 mmtm -64.67 -38.13 89.93 Favored 'General case' 0 N--CA 1.478 0.955 0 C-N-CA 123.408 0.683 . . . . 75.340000000000003 112.316 -175.764 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -71.25 -30.6 67.05 Favored Glycine 0 C--N 1.342 0.906 0 CA-C-N 115.936 -0.574 . . . . 63.310000000000002 112.002 174.534 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 4.8 tt -68.8 -43.83 74.8 Favored 'General case' 0 CA--C 1.557 1.225 0 C-N-CA 123.488 0.715 . . . . 72.310000000000002 109.728 173.302 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 82' ' ' LEU . . . . . 0.47 HD11 ' HG2' ' A' ' 88' ' ' GLU . 57.7 mt -71.93 -65.98 0.7 Allowed 'General case' 0 N--CA 1.478 0.947 0 C-N-CA 123.413 0.685 . . . . 74.239999999999995 110.201 -170.652 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 22.6 tp60 -179.9 -53.68 0.01 OUTLIER 'General case' 0 N--CA 1.483 1.193 0 C-N-CA 123.386 0.675 . . . . 75.140000000000001 110.322 177.578 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 48.5 mt-30 -119.95 158.08 27.47 Favored 'General case' 0 N--CA 1.484 1.239 0 C-N-CA 123.765 0.826 . . . . 74.200000000000003 109.931 -174.314 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 85' ' ' ARG . . . . . 0.521 ' HA ' ' HB3' ' A' ' 79' ' ' LYS . 76.6 mtp180 -64.77 -16.77 63.47 Favored 'General case' 0 N--CA 1.485 1.306 0 O-C-N 123.843 0.714 . . . . 74.140000000000001 112.141 177.176 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 62.4 mt -140.72 -161.76 1.26 Allowed 'General case' 0 C--O 1.243 0.746 0 C-N-CA 125.356 1.462 . . . . 74.420000000000002 108.577 179.229 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 11.4 t70 61.86 62.61 1.23 Allowed 'General case' 0 N--CA 1.483 1.208 0 C-N-CA 124.013 0.925 . . . . 75.549999999999997 111.441 167.635 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 88' ' ' GLU . . . . . 0.47 ' HG2' HD11 ' A' ' 82' ' ' LEU . 12.5 tp10 -174.44 -75.35 0.01 OUTLIER 'General case' 0 N--CA 1.474 0.747 0 C-N-CA 123.799 0.839 . . . . 72.310000000000002 108.901 177.427 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . 0.438 HD11 ' NZ ' ' A' ' 79' ' ' LYS . 89.3 mt -90.6 24.14 2.77 Favored 'General case' 0 N--CA 1.476 0.875 0 C-N-CA 123.272 0.629 . . . . 74.450000000000003 110.438 -177.863 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 10.9 p -116.82 87.32 2.67 Favored 'General case' 0 CA--C 1.55 0.965 0 C-N-CA 123.579 0.752 . . . . 70.420000000000002 112.317 -169.715 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 91' ' ' SER . . . . . 0.46 ' HB2' HD11 ' A' ' 41' ' ' LEU . 49.3 m -127.44 91.03 3.23 Favored 'General case' 0 N--CA 1.476 0.862 0 N-CA-C 107.373 -1.343 . . . . 71.450000000000003 107.373 164.632 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 92' ' ' LEU . . . . . 0.421 HD11 ' HE3' ' A' ' 48' ' ' MET . 64.4 mt -129.56 -155.38 0.69 Allowed 'General case' 0 N--CA 1.481 1.121 0 C-N-CA 124.103 0.961 . . . . 73.329999999999998 110.93 -170.066 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 76.4 mt -41.31 -41.05 0.68 Allowed 'Isoleucine or valine' 0 N--CA 1.488 1.467 0 C-N-CA 125.224 1.41 . . . . 75.239999999999995 111.018 167.967 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -163.31 -151.67 6.53 Favored Glycine 0 C--O 1.242 0.641 0 N-CA-C 110.497 -1.041 . . . . 64.5 110.497 169.049 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 3.9 pt20 -73.92 167.32 21.71 Favored 'General case' 0 CA--C 1.547 0.828 0 N-CA-C 109.128 -0.693 . . . . 73.150000000000006 109.128 168.825 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 78.1 p 49.98 -88.21 0.01 OUTLIER 'General case' 0 CA--C 1.555 1.142 0 C-N-CA 125.051 1.34 . . . . 73.030000000000001 111.842 -170.469 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 28.2 m 55.64 -78.38 0.01 OUTLIER 'General case' 0 CA--C 1.559 1.303 0 C-N-CA 125.379 1.472 . . . . 73.450000000000003 113.27 176.652 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 4.9 ptm180 -45.98 -48.63 16.48 Favored 'General case' 0 N--CA 1.485 1.293 0 C-N-CA 125.699 1.599 . . . . 74.019999999999996 114.665 -169.274 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 60.2 tp60 -67.99 -52.02 40.58 Favored 'General case' 0 N--CA 1.471 0.602 0 N-CA-C 109.842 -0.429 . . . . 64.519999999999996 109.842 -176.976 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 87.3 tttt -60.68 -45.41 94.28 Favored 'General case' 0 N--CA 1.475 0.791 0 CA-C-N 115.797 -0.638 . . . . 74.450000000000003 111.3 -179.231 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 23.0 t -73.63 -46.83 44.5 Favored 'General case' 0 N--CA 1.468 0.432 0 C-N-CA 124.058 0.943 . . . . 73.349999999999994 110.983 -168.835 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 102' ' ' LEU . . . . . 0.518 ' HG ' ' HH2' ' A' ' 11' ' ' TRP . 9.4 mp -78.29 -35.51 47.86 Favored 'General case' 0 N--CA 1.473 0.718 0 O-C-N 123.347 0.404 . . . . 75.129999999999995 111.427 -176.538 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 60.6 t30 -70.85 -35.73 72.54 Favored 'General case' 0 N--CA 1.488 1.466 0 N-CA-C 109.732 -0.47 . . . . 72.140000000000001 109.732 177.874 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 104' ' ' ASN . . . . . 0.434 ' O ' ' HG2' ' A' ' 108' ' ' ARG . 24.4 t-20 -67.0 -43.68 82.29 Favored 'General case' 0 N--CA 1.479 0.998 0 N-CA-C 109.423 -0.584 . . . . 74.430000000000007 109.423 172.57 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -60.49 -34.88 74.69 Favored 'General case' 0 N--CA 1.484 1.236 0 C-N-CA 123.407 0.683 . . . . 74.239999999999995 111.698 178.703 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 106' ' ' TYR . . . . . 0.519 ' HE2' ' HB2' ' A' ' 69' ' ' LYS . 13.6 t80 -65.56 -52.89 48.97 Favored 'General case' 0 CA--C 1.539 0.536 0 N-CA-C 109.03 -0.729 . . . . 73.420000000000002 109.03 175.699 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -62.3 -35.69 91.99 Favored Glycine 0 C--N 1.353 1.508 0 O-C-N 124.095 0.872 . . . . 73.030000000000001 112.673 -177.78 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 108' ' ' ARG . . . . . 0.434 ' HG2' ' O ' ' A' ' 104' ' ' ASN . 21.4 mmt180 -75.21 -34.59 61.5 Favored 'General case' 0 N--CA 1.468 0.446 0 C-N-CA 122.879 0.471 . . . . 72.439999999999998 110.544 179.16 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 109' ' ' LEU . . . . . 0.512 HD23 ' HB3' ' A' ' 65' ' ' ALA . 41.9 tp -67.13 -41.71 85.67 Favored 'General case' 0 N--CA 1.487 1.412 0 CA-C-O 121.311 0.577 . . . . 73.040000000000006 109.857 177.447 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 33.2 t -68.12 -38.76 82.58 Favored 'General case' 0 CA--C 1.545 0.774 0 CA-C-N 114.17 -1.377 . . . . 75.109999999999999 109.81 -179.775 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . -89.8 -64.8 1.25 Allowed Glycine 0 C--N 1.355 1.608 0 C-N-CA 121.153 -0.546 . . . . 73.329999999999998 113.674 -178.165 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 112' ' ' MET . . . . . 0.573 ' SD ' ' HB2' ' A' ' 113' ' ' LEU . 0.2 OUTLIER -93.8 -71.43 0.66 Allowed 'General case' 0 N--CA 1.481 1.093 0 CA-C-N 117.853 0.826 . . . . 73.120000000000005 111.389 -175.793 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 113' ' ' LEU . . . . . 0.573 ' HB2' ' SD ' ' A' ' 112' ' ' MET . 6.1 mt 170.12 35.57 0.0 OUTLIER 'General case' 0 N--CA 1.507 2.409 0 C-N-CA 125.649 1.579 . . . . 74.439999999999998 110.342 -178.47 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 114' ' ' LEU . . . . . 0.674 ' HB3' HG21 ' A' ' 52' ' ' THR . 1.9 tt 83.09 -20.39 0.34 Allowed 'General case' 0 N--CA 1.506 2.357 0 C-N-CA 127.03 2.132 . . . . 75.299999999999997 111.722 176.843 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 115' ' ' VAL . . . . . 0.447 HG22 ' SD ' ' A' ' 112' ' ' MET . 16.3 m -84.56 152.89 61.11 Favored Pre-proline 0 CA--C 1.553 1.088 0 N-CA-C 108.967 -0.753 . . . . 73.099999999999994 108.967 175.369 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 33.4 Cg_endo -62.01 140.83 86.63 Favored 'Trans proline' 0 C--N 1.366 1.458 0 C-N-CA 122.32 2.013 . . . . 74.5 112.174 177.962 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 4.2 m-20 -71.02 -30.25 66.41 Favored 'General case' 0 N--CA 1.482 1.149 0 C-N-CA 123.887 0.875 . . . . 54.25 111.18 -179.049 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . 55.84 62.69 6.83 Favored Pre-proline 0 N--CA 1.481 1.122 0 C-N-CA 123.843 0.857 . . . . 65.430000000000007 110.389 -167.789 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 119' ' ' PRO . . . . . . . . . . . . . 65.5 Cg_endo -71.26 144.45 46.24 Favored 'Trans proline' 0 C--N 1.374 1.882 0 C-N-CA 122.722 2.281 . . . . 72.099999999999994 112.268 -172.289 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . -82.02 123.0 5.89 Favored Glycine 0 CA--C 1.532 1.152 0 CA-C-N 116.148 -0.478 . . . . 73.450000000000003 112.139 178.213 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . -90.5 126.61 35.98 Favored 'General case' 0 N--CA 1.481 1.094 0 C-N-CA 123.728 0.811 . . . . 61.420000000000002 110.204 -179.578 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 122' ' ' SER . . . . . . . . . . . . . 41.9 m . . . . . 0 CA--C 1.555 1.167 0 C-N-CA 123.563 0.745 . . . . 72.430000000000007 110.583 -179.109 . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 25.2 ttt . . . . . 0 N--CA 1.487 1.375 0 CA-C-O 119.672 -0.204 . . . . 72.430000000000007 110.856 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 2' ' ' THR . . . . . 0.42 ' O ' ' HG2' ' A' ' 6' ' ' GLU . 41.6 m -49.47 -49.4 45.61 Favored 'General case' 0 N--CA 1.487 1.398 0 C-N-CA 123.65 0.78 . . . . 74.450000000000003 112.798 -173.547 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 68.8 p -60.72 -41.16 94.73 Favored 'General case' 0 N--CA 1.482 1.173 0 C-N-CA 123.609 0.764 . . . . 71.430000000000007 112.033 -178.392 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 30.4 m -69.1 -40.69 78.23 Favored 'General case' 0 N--CA 1.48 1.045 0 C-N-CA 123.261 0.625 . . . . 72.439999999999998 111.347 179.748 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 99.4 t -65.04 -46.08 92.5 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.922 0 C-N-CA 123.029 0.532 . . . . 73.129999999999995 109.885 178.942 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . 0.42 ' HG2' ' O ' ' A' ' 2' ' ' THR . 63.0 mm-40 -59.02 -44.69 91.75 Favored 'General case' 0 N--CA 1.476 0.844 0 C-N-CA 123.367 0.667 . . . . 64.439999999999998 110.328 174.854 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 39.2 t80 -57.49 -55.62 32.4 Favored 'General case' 0 N--CA 1.479 0.979 0 C-N-CA 124.451 1.1 . . . . 74.540000000000006 110.542 -176.036 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 45.3 mt -66.18 -37.36 79.57 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.986 0 C-N-CA 123.518 0.727 . . . . 74.349999999999994 110.322 -178.452 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 2.7 t-20 -72.28 -26.7 62.08 Favored 'General case' 0 N--CA 1.488 1.469 0 C-N-CA 123.298 0.639 . . . . 75.519999999999996 111.147 -177.442 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . 0.616 ' HB3' HG21 ' A' ' 47' ' ' VAL . 82.0 mtt180 -78.03 -35.47 49.77 Favored 'General case' 0 CA--C 1.536 0.421 0 C-N-CA 123.437 0.695 . . . . 74.400000000000006 109.648 174.688 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 11' ' ' TRP . . . . . 0.407 ' CZ3' HG12 ' A' ' 68' ' ' ILE . 73.4 m95 -67.67 -34.16 76.37 Favored 'General case' 0 N--CA 1.479 1.02 0 O-C-N 123.096 0.248 . . . . 74.450000000000003 110.381 172.028 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 54.4 mt-30 -60.0 -48.42 81.8 Favored 'General case' 0 C--N 1.359 0.993 0 N-CA-C 108.248 -1.019 . . . . 75.540000000000006 108.248 171.1 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 32.2 tpt180 -58.8 -46.81 86.75 Favored 'General case' 0 CA--C 1.552 1.045 0 CA-C-N 115.158 -0.928 . . . . 75.200000000000003 111.503 -175.754 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 14' ' ' ILE . . . . . 0.478 HG13 ' O ' ' A' ' 10' ' ' ARG . 31.7 mt -67.05 -45.36 87.06 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.439 0 C-N-CA 122.665 0.386 . . . . 75.5 110.163 -179.652 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . 0.406 ' HB1' ' OE1' ' A' ' 70' ' ' GLN . . . -62.15 -42.79 99.6 Favored 'General case' 0 N--CA 1.483 1.193 0 C-N-CA 124.339 1.055 . . . . 73.310000000000002 111.792 -177.894 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 95.2 mt -75.51 -39.35 58.59 Favored 'General case' 0 N--CA 1.484 1.249 0 CA-C-N 114.593 -1.185 . . . . 74.310000000000002 110.247 -175.694 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . 0.518 ' O ' ' HG ' ' A' ' 21' ' ' LEU . 44.2 mt -63.9 -49.14 73.84 Favored 'General case' 0 C--O 1.211 -0.948 0 O-C-N 123.565 0.54 . . . . 74.510000000000005 109.99 176.48 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 83.3 p -65.42 -30.55 71.37 Favored 'General case' 0 N--CA 1.484 1.265 0 C-N-CA 122.821 0.448 . . . . 71.409999999999997 111.515 -179.54 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 19' ' ' GLN . . . . . 0.534 ' HA ' HD21 ' A' ' 74' ' ' ASN . 5.6 tp-100 -63.42 -47.69 80.91 Favored 'General case' 0 N--CA 1.481 1.115 0 CA-C-O 121.546 0.688 . . . . 72.030000000000001 110.124 173.037 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 55.0 m -61.39 -48.12 82.68 Favored 'General case' 0 CA--C 1.538 0.502 0 CA-C-N 114.321 -1.309 . . . . 61.340000000000003 110.394 178.488 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . 0.518 ' HG ' ' O ' ' A' ' 17' ' ' LEU . 95.6 mt -60.46 -38.42 84.15 Favored 'General case' 0 N--CA 1.473 0.679 0 C-N-CA 124.218 1.007 . . . . 75.120000000000005 110.136 -178.117 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . 0.773 ' HA ' HD21 ' A' ' 78' ' ' LEU . 35.9 tp -61.09 -55.72 29.24 Favored 'General case' 0 C--O 1.253 1.276 0 C-N-CA 123.539 0.736 . . . . 74.140000000000001 110.733 178.812 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . 0.503 ' O ' ' HG3' ' A' ' 27' ' ' ARG . 56.0 mt-10 -59.19 -55.48 34.46 Favored 'General case' 0 CA--C 1.543 0.699 0 CA-C-N 114.917 -1.038 . . . . 74.209999999999994 111.678 -178.743 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . 0.483 HD21 HD12 ' A' ' 32' ' ' LEU . 78.5 mt -58.42 -38.68 77.9 Favored 'General case' 0 N--CA 1.478 0.973 0 C-N-CA 124.714 1.206 . . . . 74.430000000000007 111.776 -175.952 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . 0.468 ' HB1' HD22 ' A' ' 33' ' ' LEU . . . -62.13 -45.16 94.67 Favored 'General case' 0 N--CA 1.478 0.934 0 C-N-CA 123.247 0.619 . . . . 74.010000000000005 111.727 176.033 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 92.6 mt-30 -73.17 -14.82 61.43 Favored 'General case' 0 CA--C 1.557 1.217 0 CA-C-N 115.42 -0.809 . . . . 74.299999999999997 111.564 177.48 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . 0.503 ' HG3' ' O ' ' A' ' 23' ' ' GLU . 72.7 mtt-85 -87.84 -2.15 58.43 Favored 'General case' 0 N--CA 1.491 1.616 0 C-N-CA 123.58 0.752 . . . . 72.5 111.489 170.979 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 85.45 0.02 88.32 Favored Glycine 0 N--CA 1.48 1.591 0 N-CA-C 113.9 0.32 . . . . 63.149999999999999 113.9 -179.311 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 24.2 mm-40 -85.2 68.2 10.43 Favored 'General case' 0 N--CA 1.473 0.695 0 C-N-CA 124.696 1.199 . . . . 74.319999999999993 111.287 -176.692 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 30' ' ' TRP . . . . . 0.429 ' O ' ' HG ' ' A' ' 34' ' ' LEU . 69.2 m95 -67.84 -28.7 67.78 Favored 'General case' 0 N--CA 1.48 1.046 0 CA-C-N 115.712 -0.677 . . . . 75.310000000000002 110.386 178.292 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 10.4 m-20 -53.13 -46.67 68.88 Favored 'General case' 0 N--CA 1.479 1.017 0 C-N-CA 124.738 1.215 . . . . 75.409999999999997 111.576 176.022 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . 0.483 HD12 HD21 ' A' ' 24' ' ' LEU . 70.7 mt -70.44 -26.53 63.7 Favored 'General case' 0 CA--C 1.544 0.749 0 CA-C-N 114.856 -1.065 . . . . 72.030000000000001 110.758 -175.82 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . 0.468 HD22 ' HB1' ' A' ' 25' ' ' ALA . 11.0 mp -70.04 -42.86 72.34 Favored 'General case' 0 N--CA 1.485 1.325 0 C-N-CA 122.937 0.495 . . . . 74.430000000000007 110.418 172.45 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . 0.429 ' HG ' ' O ' ' A' ' 30' ' ' TRP . 77.0 mt -65.02 -33.97 77.32 Favored 'General case' 0 N--CA 1.484 1.263 0 C-N-CA 123.495 0.718 . . . . 73.010000000000005 111.292 -179.776 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 96.5 mt-30 -71.47 -52.16 19.93 Favored 'General case' 0 N--CA 1.477 0.915 0 C-N-CA 123.446 0.698 . . . . 74.099999999999994 110.658 176.716 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 84.8 mm-40 -74.5 -12.74 60.56 Favored 'General case' 0 N--CA 1.481 1.081 0 C-N-CA 123.743 0.817 . . . . 71.319999999999993 112.594 -177.571 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . 0.423 ' O ' ' HG ' ' A' ' 41' ' ' LEU . 38.4 tt0 -52.86 -53.84 43.08 Favored 'General case' 0 N--CA 1.48 1.051 0 C-N-CA 124.066 0.947 . . . . 75.230000000000004 111.577 178.456 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 83.8 t -60.42 -39.53 81.34 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.258 0 C-N-CA 123.241 0.616 . . . . 74.049999999999997 110.901 -178.239 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 36.4 m -63.72 -43.63 95.98 Favored 'General case' 0 CA--C 1.551 0.987 0 CA-C-N 115.458 -0.792 . . . . 72.549999999999997 111.03 177.246 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 59.5 t80 -65.04 -52.66 54.61 Favored 'General case' 0 N--CA 1.479 0.977 0 C-N-CA 124.778 1.231 . . . . 74.239999999999995 110.242 -175.888 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . 0.423 ' HG ' ' O ' ' A' ' 37' ' ' GLU . 69.6 mt -63.01 -44.74 95.13 Favored 'General case' 0 C--N 1.35 0.609 0 CA-C-N 114.729 -1.123 . . . . 63.310000000000002 110.95 -177.64 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 50.9 tt0 -61.04 -47.9 84.24 Favored 'General case' 0 N--CA 1.481 1.08 0 C-N-CA 122.797 0.439 . . . . 74.099999999999994 111.009 179.709 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 43' ' ' SER . . . . . 0.46 ' O ' HG23 ' A' ' 47' ' ' VAL . 63.2 m -57.76 -53.76 54.52 Favored 'General case' 0 N--CA 1.481 1.124 0 C-N-CA 123.381 0.672 . . . . 74.239999999999995 111.407 -178.968 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 20.8 tt -69.37 -28.67 39.23 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.864 0 CA-C-N 115.54 -0.754 . . . . 73.430000000000007 112.045 -174.037 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 14.0 mm-40 -62.52 -47.42 84.0 Favored 'General case' 0 N--CA 1.479 0.982 0 C-N-CA 122.709 0.404 . . . . 63.310000000000002 110.151 169.374 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 19.2 m -61.96 -27.67 69.01 Favored 'General case' 0 N--CA 1.481 1.082 0 O-C-N 123.906 0.754 . . . . 72.030000000000001 111.139 179.987 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 47' ' ' VAL . . . . . 0.616 HG21 ' HB3' ' A' ' 10' ' ' ARG . 21.1 t -75.4 -50.98 22.27 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.213 0 O-C-N 122.26 -0.275 . . . . 74.230000000000004 111.602 175.086 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 48' ' ' MET . . . . . . . . . . . . . 73.9 mtm -73.4 -20.87 60.64 Favored 'General case' 0 N--CA 1.492 1.648 0 N-CA-C 112.818 0.673 . . . . 71.230000000000004 112.818 -172.35 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 16.1 pt-20 -85.05 -11.51 55.16 Favored 'General case' 0 N--CA 1.48 1.045 0 C-N-CA 122.598 0.359 . . . . 74.209999999999994 111.134 175.047 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 11.9 mptt -94.62 155.88 16.68 Favored 'General case' 0 N--CA 1.485 1.294 0 C-N-CA 124.213 1.005 . . . . 65.319999999999993 110.852 -178.567 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 8.8 tt0 -87.07 142.23 28.08 Favored 'General case' 0 CA--C 1.545 0.773 0 CA-C-N 114.901 -1.045 . . . . 75.420000000000002 110.218 -179.396 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 95.7 m -68.74 131.59 91.17 Favored Pre-proline 0 CA--C 1.555 1.173 0 C-N-CA 123.868 0.867 . . . . 73.319999999999993 110.128 174.48 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 26.9 Cg_exo -66.79 151.91 81.52 Favored 'Trans proline' 0 C--N 1.381 2.285 0 C-N-CA 122.388 2.059 . . . . 72.129999999999995 112.475 172.891 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 17.0 Cg_exo -71.4 -46.88 0.57 Allowed 'Trans proline' 0 C--N 1.373 1.824 0 C-N-CA 122.898 2.398 . . . . 75.019999999999996 112.339 174.916 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . -81.98 48.92 4.0 Favored Glycine 0 C--N 1.351 1.383 0 CA-C-N 115.792 -0.64 . . . . 73.200000000000003 114.636 -172.742 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 56' ' ' ILE . . . . . 0.495 ' HB ' HD22 ' A' ' 113' ' ' LEU . 44.2 mt -81.71 109.1 15.52 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.598 0 N-CA-C 108.331 -0.988 . . . . 63.240000000000002 108.331 170.89 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 67.6 p -75.76 -178.36 4.2 Favored 'General case' 0 N--CA 1.476 0.84 0 C-N-CA 123.434 0.694 . . . . 72.519999999999996 110.729 -179.687 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 47.4 tpt85 -60.1 -48.44 81.72 Favored 'General case' 0 CA--C 1.546 0.811 0 C-N-CA 123.331 0.653 . . . . 73.329999999999998 109.638 174.48 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 14.9 m -59.33 -44.59 92.59 Favored 'General case' 0 C--O 1.248 0.982 0 C-N-CA 124.502 1.121 . . . . 74.109999999999999 111.625 179.754 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 87.5 mt -66.07 -38.35 81.82 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.652 0 CA-C-N 114.87 -1.059 . . . . 74.319999999999993 110.38 179.812 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 51.9 tt0 -64.27 -40.28 95.67 Favored 'General case' 0 N--CA 1.48 1.071 0 C-N-CA 123.028 0.531 . . . . 72.510000000000005 110.655 177.642 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 40.2 m-20 -60.92 -50.34 73.81 Favored 'General case' 0 N--CA 1.479 0.993 0 C-N-CA 123.11 0.564 . . . . 64.019999999999996 110.811 178.259 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 63' ' ' MET . . . . . . . . . . . . . 71.4 mtm -63.41 -57.83 9.02 Favored 'General case' 0 N--CA 1.478 0.971 0 CA-C-N 115.856 -0.611 . . . . 75.400000000000006 110.787 -178.902 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 64' ' ' VAL . . . . . 0.487 ' O ' HG13 ' A' ' 68' ' ' ILE . 55.7 t -54.72 -57.89 5.42 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.146 0 C-N-CA 124.04 0.936 . . . . 74.5 111.412 -177.495 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -63.76 -41.91 97.92 Favored 'General case' 0 N--CA 1.488 1.427 0 C-N-CA 122.393 0.277 . . . . 74.129999999999995 111.5 -178.072 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -58.26 -37.35 86.69 Favored Glycine 0 C--N 1.351 1.375 0 O-C-N 123.192 0.307 . . . . 74.239999999999995 112.446 177.813 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 67' ' ' TYR . . . . . 0.503 ' O ' HG21 ' A' ' 71' ' ' THR . 18.1 m-30 -71.67 -38.73 70.62 Favored 'General case' 0 N--CA 1.472 0.671 0 C-N-CA 123.422 0.689 . . . . 73.450000000000003 111.48 177.028 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 68' ' ' ILE . . . . . 0.495 ' O ' ' HG ' ' A' ' 72' ' ' LEU . 69.8 mt -57.93 -53.39 45.93 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.05 0 O-C-N 123.904 0.752 . . . . 73.049999999999997 109.232 177.363 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 69' ' ' LYS . . . . . 0.484 ' HB2' ' CE2' ' A' ' 106' ' ' TYR . 23.0 tptm -61.02 -38.24 85.4 Favored 'General case' 0 N--CA 1.474 0.767 0 C-N-CA 123.262 0.625 . . . . 74.519999999999996 110.93 179.109 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 70' ' ' GLN . . . . . 0.406 ' OE1' ' HB1' ' A' ' 15' ' ' ALA . 64.3 tt0 -59.67 -47.04 87.19 Favored 'General case' 0 C--N 1.349 0.586 0 O-C-N 123.746 0.654 . . . . 73.140000000000001 110.715 179.737 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 71' ' ' THR . . . . . 0.503 HG21 ' O ' ' A' ' 67' ' ' TYR . 2.2 t -77.51 -26.97 51.6 Favored 'General case' 0 C--N 1.354 0.78 0 O-C-N 122.341 -0.224 . . . . 72.099999999999994 111.601 -177.169 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 72' ' ' LEU . . . . . 0.515 HD23 ' HB2' ' A' ' 102' ' ' LEU . 41.7 mt -69.97 -41.36 74.58 Favored 'General case' 0 N--CA 1.483 1.183 0 C-N-CA 122.153 0.181 . . . . 64.450000000000003 110.892 175.853 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 73' ' ' ASP . . . . . 0.413 ' O ' ' HG ' ' A' ' 77' ' ' LEU . 18.8 t70 -78.08 -42.12 33.19 Favored 'General case' 0 N--CA 1.477 0.9 0 O-C-N 123.952 0.782 . . . . 70.299999999999997 110.517 -175.717 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 74' ' ' ASN . . . . . 0.534 HD21 ' HA ' ' A' ' 19' ' ' GLN . 3.7 m-20 -63.43 -45.15 92.25 Favored 'General case' 0 N--CA 1.482 1.151 0 C-N-CA 122.986 0.514 . . . . 74.310000000000002 110.448 176.976 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 27.2 tt0 -66.07 -36.69 83.87 Favored 'General case' 0 C--O 1.206 -1.192 0 O-C-N 123.427 0.454 . . . . 70.340000000000003 110.093 175.934 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 7.7 tt0 -56.98 -44.34 82.6 Favored 'General case' 0 N--CA 1.494 1.734 0 C-N-CA 123.818 0.847 . . . . 73.450000000000003 110.83 178.518 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . 0.413 ' HG ' ' O ' ' A' ' 73' ' ' ASP . 94.8 mt -67.67 -46.41 72.44 Favored 'General case' 0 N--CA 1.478 0.958 0 CA-C-N 114.829 -1.078 . . . . 75.230000000000004 110.983 179.59 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . 0.773 HD21 ' HA ' ' A' ' 22' ' ' LEU . 71.3 mt -61.0 -52.85 63.24 Favored 'General case' 0 N--CA 1.488 1.427 0 C-N-CA 124.219 1.008 . . . . 74.409999999999997 112.802 178.43 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 79' ' ' LYS . . . . . 0.576 ' HD3' ' HA ' ' A' ' 86' ' ' LEU . 36.6 ttmt -68.19 -30.31 69.38 Favored 'General case' 0 C--N 1.315 -0.894 0 C-N-CA 125.409 1.484 . . . . 75.0 110.395 -175.328 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -71.11 -37.67 63.79 Favored Glycine 0 CA--C 1.536 1.364 0 CA-C-N 115.798 -0.637 . . . . 51.340000000000003 112.571 170.062 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 4.2 tt -63.88 -53.79 44.99 Favored 'General case' 0 N--CA 1.491 1.597 0 C-N-CA 124.043 0.937 . . . . 62.509999999999998 108.979 179.951 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 76.3 mt -60.6 -46.34 90.63 Favored 'General case' 0 CA--C 1.54 0.559 0 C-N-CA 124.705 1.202 . . . . 74.030000000000001 110.048 178.788 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 7.4 tt0 64.51 26.34 13.36 Favored 'General case' 0 CA--C 1.556 1.185 0 CA-C-N 114.582 -1.19 . . . . 74.219999999999999 111.512 171.862 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 21.8 mt-30 -83.69 -76.99 0.27 Allowed 'General case' 0 N--CA 1.478 0.946 0 N-CA-C 109.995 -0.372 . . . . 74.349999999999994 109.995 -178.436 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 85' ' ' ARG . . . . . . . . . . . . . 30.9 ttm180 -173.2 143.3 1.1 Allowed 'General case' 0 N--CA 1.492 1.65 0 C-N-CA 123.852 0.861 . . . . 75.230000000000004 109.279 -177.379 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 86' ' ' LEU . . . . . 0.576 ' HA ' ' HD3' ' A' ' 79' ' ' LYS . 79.4 mt -47.41 -25.6 1.09 Allowed 'General case' 0 N--CA 1.494 1.727 0 N-CA-C 114.836 1.421 . . . . 74.219999999999999 114.836 -168.534 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 2.3 m-20 -77.4 -12.01 59.91 Favored 'General case' 0 N--CA 1.489 1.523 0 N-CA-C 113.305 0.854 . . . . 71.340000000000003 113.305 -174.734 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 88' ' ' GLU . . . . . 0.526 ' HG3' ' HG ' ' A' ' 89' ' ' LEU . 12.1 pt-20 -58.22 -40.72 82.39 Favored 'General case' 0 N--CA 1.484 1.251 0 C-N-CA 124.442 1.097 . . . . 73.340000000000003 112.82 -174.969 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . 0.526 ' HG ' ' HG3' ' A' ' 88' ' ' GLU . 74.5 mt -114.51 13.95 17.67 Favored 'General case' 0 N--CA 1.484 1.269 0 C-N-CA 123.507 0.723 . . . . 73.219999999999999 110.511 -179.136 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 35.1 m -132.56 -95.87 0.32 Allowed 'General case' 0 CA--C 1.557 1.222 0 C-N-CA 123.466 0.706 . . . . 70.420000000000002 110.372 -177.721 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 22.8 t 54.45 29.14 10.58 Favored 'General case' 0 N--CA 1.495 1.775 0 C-N-CA 123.909 0.884 . . . . 73.299999999999997 112.391 -177.859 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 76.3 mt -81.83 -83.08 0.12 Allowed 'General case' 0 N--CA 1.48 1.055 0 N-CA-C 112.574 0.583 . . . . 64.439999999999998 112.574 -166.981 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 36.7 mt -82.28 75.03 0.93 Allowed 'Isoleucine or valine' 0 N--CA 1.475 0.811 0 N-CA-C 108.144 -1.058 . . . . 75.450000000000003 108.144 -177.193 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 75.32 -77.04 1.23 Allowed Glycine 0 C--N 1.347 1.146 0 CA-C-N 114.61 -1.177 . . . . 75.510000000000005 111.098 -169.092 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 84.4 mt-30 -104.59 -159.96 0.74 Allowed 'General case' 0 CA--C 1.549 0.922 0 C-N-CA 124.187 0.995 . . . . 73.209999999999994 110.593 -178.259 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 20.4 p -76.87 44.83 0.4 Allowed 'General case' 0 N--CA 1.478 0.97 0 C-N-CA 125.142 1.377 . . . . 75.230000000000004 113.159 176.334 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 28.5 m -62.21 -18.56 61.44 Favored 'General case' 0 CA--C 1.555 1.17 0 C-N-CA 124.785 1.234 . . . . 75.209999999999994 111.915 177.782 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 12.7 ttp85 -52.48 -55.38 22.34 Favored 'General case' 0 C--N 1.363 1.182 0 C-N-CA 124.435 1.094 . . . . 63.299999999999997 113.511 -172.278 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 7.3 tp60 -60.36 -44.41 95.61 Favored 'General case' 0 N--CA 1.478 0.935 0 O-C-N 123.916 0.76 . . . . 63.329999999999998 109.71 -173.824 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 27.0 mtpp -64.59 -40.75 96.09 Favored 'General case' 0 N--CA 1.477 0.879 0 CA-C-N 114.716 -1.129 . . . . 75.120000000000005 111.682 178.136 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 45.0 t -67.77 -47.73 68.35 Favored 'General case' 0 N--CA 1.478 0.941 0 C-N-CA 124.245 1.018 . . . . 73.420000000000002 110.752 -172.4 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 102' ' ' LEU . . . . . 0.515 ' HB2' HD23 ' A' ' 72' ' ' LEU . 10.2 mp -77.52 -30.26 52.79 Favored 'General case' 0 N--CA 1.472 0.652 0 CA-C-N 115.856 -0.611 . . . . 63.509999999999998 111.16 -179.236 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -64.28 -46.14 84.97 Favored 'General case' 0 N--CA 1.484 1.267 0 N-CA-C 109.064 -0.717 . . . . 74.439999999999998 109.064 176.492 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 104' ' ' ASN . . . . . 0.413 ' O ' ' HG2' ' A' ' 108' ' ' ARG . 6.1 t-20 -63.7 -46.27 86.26 Favored 'General case' 0 CA--C 1.539 0.525 0 CA-C-N 115.248 -0.887 . . . . 73.420000000000002 109.895 176.35 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -58.03 -37.49 74.45 Favored 'General case' 0 N--CA 1.482 1.146 0 C-N-CA 124.03 0.932 . . . . 73.349999999999994 111.438 179.348 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 106' ' ' TYR . . . . . 0.484 ' CE2' ' HB2' ' A' ' 69' ' ' LYS . 12.0 t80 -65.23 -50.37 66.1 Favored 'General case' 0 N--CA 1.475 0.793 0 C-N-CA 123.707 0.803 . . . . 74.209999999999994 109.394 177.324 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -60.95 -40.01 97.8 Favored Glycine 0 C--N 1.351 1.362 0 O-C-N 124.01 0.819 . . . . 74.299999999999997 112.966 -177.513 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 108' ' ' ARG . . . . . 0.413 ' HG2' ' O ' ' A' ' 104' ' ' ASN . 26.7 mmt180 -75.08 -29.38 60.65 Favored 'General case' 0 CA--C 1.548 0.881 0 C-N-CA 122.764 0.425 . . . . 74.430000000000007 110.244 179.307 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 109' ' ' LEU . . . . . 0.461 ' HA ' ' N ' ' A' ' 114' ' ' LEU . 45.6 tp -71.05 -36.63 72.39 Favored 'General case' 0 N--CA 1.492 1.657 0 C-N-CA 123.221 0.608 . . . . 64.420000000000002 110.475 176.361 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 45.3 t -69.85 -41.23 75.16 Favored 'General case' 0 CA--C 1.54 0.587 0 CA-C-N 115.019 -0.991 . . . . 74.109999999999999 109.604 177.758 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . -89.58 -63.68 1.28 Allowed Glycine 0 C--N 1.359 1.819 0 CA-C-O 119.42 -0.656 . . . . 71.409999999999997 114.438 -175.075 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 112' ' ' MET . . . . . . . . . . . . . 1.1 tmm? -96.26 -67.53 0.84 Allowed 'General case' 0 N--CA 1.493 1.721 0 CA-C-N 118.38 1.09 . . . . 74.120000000000005 112.366 -175.125 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 113' ' ' LEU . . . . . 0.495 HD22 ' HB ' ' A' ' 56' ' ' ILE . 1.4 tt 165.77 48.72 0.0 OUTLIER 'General case' 0 N--CA 1.508 2.458 0 C-N-CA 125.704 1.602 . . . . 75.430000000000007 107.878 179.755 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 114' ' ' LEU . . . . . 0.461 ' N ' ' HA ' ' A' ' 109' ' ' LEU . 1.3 tt 78.35 -25.3 0.2 Allowed 'General case' 0 N--CA 1.496 1.837 0 C-N-CA 126.76 2.024 . . . . 74.530000000000001 111.281 177.171 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 115' ' ' VAL . . . . . . . . . . . . . 18.6 m -88.59 132.92 37.33 Favored Pre-proline 0 CA--C 1.558 1.264 0 N-CA-C 108.698 -0.853 . . . . 73.430000000000007 108.698 174.546 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 65.6 Cg_endo -72.33 132.34 19.13 Favored 'Trans proline' 0 C--N 1.369 1.612 0 C-N-CA 122.926 2.417 . . . . 72.319999999999993 113.401 -178.25 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 21.5 t70 -81.08 -75.73 0.27 Allowed 'General case' 0 CA--C 1.544 0.738 0 N-CA-C 108.701 -0.852 . . . . 61.119999999999997 108.701 170.825 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -171.59 141.52 1.28 Allowed Pre-proline 0 CA--C 1.551 1.004 0 C-N-CA 124.27 1.028 . . . . 65.209999999999994 109.433 -178.578 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 119' ' ' PRO . . . . . . . . . . . . . 13.0 Cg_exo -70.79 158.07 56.63 Favored 'Trans proline' 0 C--N 1.376 2.012 0 C-N-CA 123.122 2.548 . . . . 73.209999999999994 112.847 179.133 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . -77.12 87.31 0.99 Allowed Glycine 0 C--N 1.343 0.932 0 N-CA-C 110.945 -0.862 . . . . 62.039999999999999 110.945 173.109 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . -74.13 92.28 2.17 Favored 'General case' 0 CA--C 1.543 0.7 0 C-N-CA 123.318 0.647 . . . . 74.420000000000002 110.076 178.334 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 122' ' ' SER . . . . . . . . . . . . . 13.7 p . . . . . 0 C--O 1.256 1.42 0 C-N-CA 124.424 1.089 . . . . 75.400000000000006 110.696 -178.296 . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 1' ' ' MET . . . . . 0.528 ' HG2' ' HB ' ' A' ' 4' ' ' THR . 38.6 ttp . . . . . 0 N--CA 1.483 1.219 0 N-CA-C 109.253 -0.647 . . . . 65.319999999999993 109.253 . . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 42.5 m -50.25 -50.55 49.65 Favored 'General case' 0 N--CA 1.478 0.958 0 C-N-CA 124.85 1.26 . . . . 75.310000000000002 113.405 -170.118 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 37.0 m -56.25 -47.99 77.41 Favored 'General case' 0 N--CA 1.48 1.042 0 C-N-CA 123.249 0.619 . . . . 74.129999999999995 111.628 -176.688 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 4' ' ' THR . . . . . 0.528 ' HB ' ' HG2' ' A' ' 1' ' ' MET . 40.9 m -68.66 -44.71 73.53 Favored 'General case' 0 C--N 1.35 0.625 0 CA-C-N 115.614 -0.721 . . . . 72.510000000000005 110.979 -179.29 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 83.9 t -62.33 -40.12 86.71 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.939 0 C-N-CA 123.115 0.566 . . . . 73.230000000000004 110.88 -177.789 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . 0.424 ' O ' ' HG3' ' A' ' 10' ' ' ARG . 34.2 mm-40 -69.21 -39.97 78.29 Favored 'General case' 0 N--CA 1.47 0.561 0 O-C-N 123.554 0.534 . . . . 72.450000000000003 110.591 177.226 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 30.4 t80 -65.38 -40.01 92.97 Favored 'General case' 0 CA--C 1.554 1.13 0 C-N-CA 122.67 0.388 . . . . 74.340000000000003 110.568 -179.545 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . 0.543 HD13 HG22 ' A' ' 60' ' ' ILE . 81.0 mt -68.06 -37.03 77.59 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.161 0 C-N-CA 123.876 0.87 . . . . 72.099999999999994 109.723 173.984 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 26.6 t-20 -64.45 -28.7 69.85 Favored 'General case' 0 N--CA 1.483 1.207 0 C-N-CA 124.001 0.92 . . . . 74.310000000000002 110.896 176.384 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . 0.626 ' HB3' HG22 ' A' ' 47' ' ' VAL . 91.5 mtt180 -82.11 -28.8 32.08 Favored 'General case' 0 CA--C 1.539 0.552 0 C-N-CA 123.474 0.71 . . . . 74.230000000000004 110.407 177.135 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 11' ' ' TRP . . . . . . . . . . . . . 53.4 m95 -70.92 -33.54 70.63 Favored 'General case' 0 N--CA 1.48 1.034 0 CA-C-O 119.745 -0.169 . . . . 72.109999999999999 110.632 167.608 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . 0.426 ' HG2' ' CE2' ' A' ' 67' ' ' TYR . 53.0 mt-30 -60.65 -49.19 78.52 Favored 'General case' 0 C--N 1.361 1.092 0 N-CA-C 107.874 -1.158 . . . . 65.310000000000002 107.874 171.838 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 28.5 tpt180 -53.19 -54.16 39.96 Favored 'General case' 0 CA--C 1.551 1.001 0 CA-C-N 114.267 -1.333 . . . . 73.25 111.345 -177.834 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 14' ' ' ILE . . . . . 0.401 HG13 ' O ' ' A' ' 10' ' ' ARG . 52.7 mt -62.38 -49.14 85.14 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.263 0 C-N-CA 122.501 0.321 . . . . 75.129999999999995 110.304 179.704 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . 0.549 ' HA ' ' HB ' ' A' ' 71' ' ' THR . . . -58.94 -44.15 91.34 Favored 'General case' 0 N--CA 1.485 1.288 0 C-N-CA 124.08 0.952 . . . . 70.219999999999999 112.319 -176.004 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 91.1 mt -74.47 -45.27 47.31 Favored 'General case' 0 N--CA 1.479 1.023 0 CA-C-N 114.956 -1.02 . . . . 73.430000000000007 110.632 -173.741 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . 0.525 ' O ' ' HG ' ' A' ' 21' ' ' LEU . 90.2 mt -59.8 -51.21 70.72 Favored 'General case' 0 N--CA 1.474 0.748 0 O-C-N 123.588 0.555 . . . . 71.099999999999994 110.201 179.041 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 78.1 p -66.01 -37.1 85.06 Favored 'General case' 0 N--CA 1.479 0.993 0 O-C-N 123.698 0.623 . . . . 71.129999999999995 111.97 -177.088 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 6.8 tp-100 -63.26 -44.24 95.73 Favored 'General case' 0 C--O 1.25 1.1 0 CA-C-O 121.281 0.563 . . . . 75.430000000000007 110.753 178.022 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 35.9 m -59.48 -46.02 90.01 Favored 'General case' 0 CA--C 1.535 0.372 0 CA-C-N 114.978 -1.01 . . . . 74.019999999999996 109.823 174.255 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . 0.673 HD21 ' HA ' ' A' ' 33' ' ' LEU . 47.9 mt -63.95 -29.27 70.45 Favored 'General case' 0 N--CA 1.473 0.712 0 C-N-CA 123.142 0.577 . . . . 64.319999999999993 111.392 -178.836 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . 0.644 ' HA ' HD23 ' A' ' 78' ' ' LEU . 36.5 tp -70.48 -50.99 32.25 Favored 'General case' 0 C--O 1.245 0.818 0 O-C-N 123.332 0.395 . . . . 72.25 110.043 178.842 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 23.8 mt-10 -60.96 -43.14 99.16 Favored 'General case' 0 N--CA 1.483 1.22 0 O-C-N 123.361 0.413 . . . . 75.129999999999995 111.435 177.063 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 96.5 mt -63.46 -39.64 94.99 Favored 'General case' 0 N--CA 1.475 0.782 0 C-N-CA 123.604 0.762 . . . . 73.329999999999998 110.767 -179.658 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . 0.486 ' HB3' HD21 ' A' ' 33' ' ' LEU . . . -63.75 -40.53 96.95 Favored 'General case' 0 N--CA 1.481 1.117 0 C-N-CA 123.246 0.618 . . . . 74.340000000000003 111.573 178.004 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . 0.417 HE21 ' HG ' ' A' ' 22' ' ' LEU . 66.9 mt-30 -59.87 -39.54 85.6 Favored 'General case' 0 N--CA 1.484 1.256 0 C-N-CA 123.527 0.731 . . . . 75.549999999999997 110.785 173.209 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 47.8 mtt180 -81.61 -5.42 58.02 Favored 'General case' 0 N--CA 1.484 1.254 0 C-N-CA 123.63 0.772 . . . . 73.409999999999997 112.155 -179.613 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 79.12 15.97 79.46 Favored Glycine 0 C--N 1.35 1.313 0 O-C-N 123.126 0.266 . . . . 64.140000000000001 113.671 177.852 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 18.7 mm-40 -83.41 51.31 1.96 Allowed 'General case' 0 N--CA 1.476 0.859 0 C-N-CA 124.805 1.242 . . . . 54.210000000000001 111.248 177.273 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 30' ' ' TRP . . . . . 0.479 ' O ' ' HG ' ' A' ' 34' ' ' LEU . 88.5 m95 -62.33 -27.0 68.75 Favored 'General case' 0 N--CA 1.475 0.808 0 C-N-CA 123.457 0.703 . . . . 72.319999999999993 111.369 -177.309 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 11.2 m-20 -51.89 -54.74 25.8 Favored 'General case' 0 N--CA 1.478 0.928 0 O-C-N 123.933 0.771 . . . . 74.040000000000006 109.816 171.242 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 93.6 mt -63.18 -28.79 70.29 Favored 'General case' 0 N--CA 1.471 0.586 0 CA-C-N 114.862 -1.063 . . . . 70.340000000000003 111.417 -177.335 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . 0.673 ' HA ' HD21 ' A' ' 21' ' ' LEU . 8.4 mp -66.62 -42.8 86.24 Favored 'General case' 0 N--CA 1.479 0.977 0 O-C-N 123.151 0.282 . . . . 75.219999999999999 110.849 172.206 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . 0.479 ' HG ' ' O ' ' A' ' 30' ' ' TRP . 77.0 mt -68.81 -35.87 77.52 Favored 'General case' 0 N--CA 1.483 1.178 0 O-C-N 123.621 0.575 . . . . 73.019999999999996 111.792 -176.826 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 1.3 mp0 -73.51 -55.33 6.47 Favored 'General case' 0 N--CA 1.483 1.21 0 N-CA-C 110.134 -0.321 . . . . 74.109999999999999 110.134 176.636 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 36' ' ' GLN . . . . . 0.474 ' HB2' HD22 ' A' ' 21' ' ' LEU . 82.6 mm-40 -65.63 -14.87 62.06 Favored 'General case' 0 N--CA 1.487 1.381 0 C-N-CA 123.516 0.726 . . . . 74.450000000000003 112.524 179.775 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . 0.509 ' O ' ' HG ' ' A' ' 41' ' ' LEU . 29.8 tt0 -50.36 -53.62 27.76 Favored 'General case' 0 C--O 1.217 -0.657 0 O-C-N 124.228 0.955 . . . . 74.349999999999994 110.591 173.386 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 60.7 t -55.58 -43.9 74.52 Favored 'Isoleucine or valine' 0 C--O 1.249 1.052 0 C-N-CA 123.981 0.913 . . . . 73.439999999999998 111.361 -175.632 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 19.6 m -61.34 -49.15 78.13 Favored 'General case' 0 N--CA 1.476 0.86 0 CA-C-N 115.517 -0.765 . . . . 61.109999999999999 110.398 175.324 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 40.2 t80 -60.38 -40.43 90.81 Favored 'General case' 0 N--CA 1.474 0.745 0 C-N-CA 124.434 1.094 . . . . 74.200000000000003 111.448 -176.932 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . 0.509 ' HG ' ' O ' ' A' ' 37' ' ' GLU . 71.7 mt -70.69 -46.56 62.93 Favored 'General case' 0 C--N 1.349 0.57 0 C-N-CA 123.62 0.768 . . . . 73.129999999999995 110.26 -176.62 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 53.3 tt0 -58.2 -42.39 86.03 Favored 'General case' 0 N--CA 1.474 0.748 0 O-C-N 123.503 0.502 . . . . 75.209999999999994 110.638 177.304 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 43' ' ' SER . . . . . 0.458 ' O ' HG21 ' A' ' 47' ' ' VAL . 49.6 m -63.71 -57.01 11.34 Favored 'General case' 0 CA--C 1.542 0.641 0 CA-C-N 115.514 -0.766 . . . . 74.219999999999999 112.007 -177.973 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 15.9 tt -63.06 -34.15 64.93 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.88 0 C-N-CA 123.391 0.676 . . . . 72.200000000000003 111.115 -174.959 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . 0.576 ' HG2' HD23 ' A' ' 92' ' ' LEU . 23.7 mm-40 -61.02 -53.6 55.22 Favored 'General case' 0 C--N 1.359 0.992 0 O-C-N 123.252 0.345 . . . . 73.150000000000006 110.594 169.819 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 46' ' ' THR . . . . . 0.414 ' O ' ' HB2' ' A' ' 50' ' ' LYS . 96.0 m -53.26 -34.43 57.21 Favored 'General case' 0 N--CA 1.482 1.155 0 C-N-CA 123.532 0.733 . . . . 73.340000000000003 111.664 -176.976 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 47' ' ' VAL . . . . . 0.626 HG22 ' HB3' ' A' ' 10' ' ' ARG . 41.2 t -75.64 -48.57 29.64 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.938 0 C-N-CA 123.189 0.595 . . . . 73.25 111.782 179.019 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 48' ' ' MET . . . . . . . . . . . . . 76.2 mtm -68.78 -30.53 69.15 Favored 'General case' 0 N--CA 1.489 1.485 0 C-N-CA 122.611 0.365 . . . . 74.340000000000003 111.736 -177.736 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 51.2 mt-10 -75.64 -18.48 59.66 Favored 'General case' 0 N--CA 1.48 1.063 0 C-N-CA 124.121 0.968 . . . . 73.430000000000007 110.867 175.845 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . 0.585 ' HZ3' ' HB2' ' A' ' 50' ' ' LYS . 0.1 OUTLIER -93.36 142.52 27.23 Favored 'General case' 0 C--O 1.237 0.409 0 C-N-CA 122.936 0.494 . . . . 74.049999999999997 110.056 -175.738 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 36.8 tt0 -79.46 141.41 36.8 Favored 'General case' 0 C--O 1.244 0.814 0 N-CA-C 108.954 -0.758 . . . . 71.540000000000006 108.954 173.628 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 52' ' ' THR . . . . . 0.669 HG21 ' HB3' ' A' ' 114' ' ' LEU . 32.1 m -73.78 131.29 82.04 Favored Pre-proline 0 CA--C 1.552 1.033 0 O-C-N 123.624 0.578 . . . . 73.049999999999997 110.263 177.255 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 53' ' ' PRO . . . . . 0.407 ' HG2' ' HA ' ' A' ' 4' ' ' THR . 25.5 Cg_exo -65.29 155.12 70.3 Favored 'Trans proline' 0 C--N 1.371 1.743 0 C-N-CA 122.94 2.427 . . . . 74.530000000000001 112.814 174.784 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 32.8 Cg_exo -61.49 -47.7 11.05 Favored 'Trans proline' 0 C--N 1.376 1.999 0 C-N-CA 123.603 2.869 . . . . 72.519999999999996 112.812 179.268 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . -65.52 84.85 0.08 OUTLIER Glycine 0 C--N 1.347 1.148 0 CA-C-N 115.156 -0.929 . . . . 74.439999999999998 113.932 -173.553 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 62.6 mt -121.15 103.99 14.53 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.467 0 N-CA-C 107.932 -1.136 . . . . 73.209999999999994 107.932 173.75 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 58.0 p -91.97 -174.36 3.77 Favored 'General case' 0 CA--C 1.544 0.743 0 C-N-CA 123.476 0.711 . . . . 75.010000000000005 109.668 175.175 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 3.6 tmt_? -60.52 -52.31 65.72 Favored 'General case' 0 CA--C 1.545 0.774 0 C-N-CA 123.949 0.9 . . . . 73.420000000000002 110.905 178.727 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 57.6 p -62.7 -39.11 92.96 Favored 'General case' 0 N--CA 1.481 1.085 0 C-N-CA 123.373 0.669 . . . . 71.439999999999998 111.635 -179.563 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 60' ' ' ILE . . . . . 0.543 HG22 HD13 ' A' ' 8' ' ' ILE . 87.0 mt -63.13 -47.98 89.91 Favored 'Isoleucine or valine' 0 C--N 1.349 0.55 0 CA-C-N 115.108 -0.951 . . . . 72.420000000000002 110.795 179.065 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 27.9 pt20 -70.97 -25.13 62.58 Favored 'General case' 0 N--CA 1.481 1.104 0 CA-C-N 117.491 0.132 . . . . 74.340000000000003 110.997 -177.885 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 53.8 m-20 -65.58 -48.56 71.93 Favored 'General case' 0 N--CA 1.482 1.132 0 C-N-CA 122.268 0.227 . . . . 75.109999999999999 111.256 172.647 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 63' ' ' MET . . . . . 0.515 ' HE1' HD11 ' A' ' 8' ' ' ILE . 73.4 mtm -65.87 -45.03 83.59 Favored 'General case' 0 N--CA 1.478 0.953 0 O-C-N 123.448 0.467 . . . . 72.439999999999998 111.061 178.29 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 64' ' ' VAL . . . . . 0.439 ' O ' HG13 ' A' ' 68' ' ' ILE . 55.6 t -64.49 -64.59 0.66 Allowed 'Isoleucine or valine' 0 N--CA 1.475 0.796 0 C-N-CA 123.337 0.655 . . . . 73.129999999999995 110.389 -178.921 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -63.48 -29.81 71.03 Favored 'General case' 0 N--CA 1.482 1.134 0 C-N-CA 123.053 0.541 . . . . 64.040000000000006 111.534 -177.149 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -60.24 -54.01 40.89 Favored Glycine 0 C--N 1.35 1.333 0 O-C-N 123.871 0.732 . . . . 74.209999999999994 111.378 174.71 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 67' ' ' TYR . . . . . 0.431 ' HB3' ' HB3' ' A' ' 15' ' ' ALA . 12.1 m-85 -66.44 -33.9 76.73 Favored 'General case' 0 N--CA 1.469 0.513 0 C-N-CA 122.999 0.52 . . . . 73.010000000000005 112.109 179.99 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 68' ' ' ILE . . . . . 0.512 ' O ' ' HG ' ' A' ' 72' ' ' LEU . 70.0 mt -59.97 -56.13 19.49 Favored 'Isoleucine or valine' 0 C--N 1.357 0.924 0 N-CA-C 108.982 -0.747 . . . . 71.239999999999995 108.982 175.958 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 54.7 tptt -54.42 -48.31 71.8 Favored 'General case' 0 N--CA 1.475 0.777 0 O-C-N 123.994 0.809 . . . . 63.329999999999998 110.927 -179.366 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 56.6 mt-30 -57.76 -46.41 84.58 Favored 'General case' 0 N--CA 1.474 0.767 0 O-C-N 124.021 0.825 . . . . 74.209999999999994 111.272 179.836 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 71' ' ' THR . . . . . 0.549 ' HB ' ' HA ' ' A' ' 15' ' ' ALA . 14.0 t -79.29 -18.96 51.63 Favored 'General case' 0 C--N 1.353 0.745 0 CA-C-O 118.981 -0.533 . . . . 71.25 111.233 -175.749 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 72' ' ' LEU . . . . . 0.512 ' HG ' ' O ' ' A' ' 68' ' ' ILE . 39.8 mt -70.67 -41.31 72.25 Favored 'General case' 0 N--CA 1.485 1.278 0 N-CA-C 109.627 -0.508 . . . . 73.239999999999995 109.627 171.918 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 6.2 m-20 -62.22 -50.17 72.83 Favored 'General case' 0 N--CA 1.474 0.762 0 O-C-N 123.676 0.61 . . . . 73.430000000000007 110.187 174.007 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 71.5 m-20 -59.47 -52.0 67.45 Favored 'General case' 0 N--CA 1.481 1.109 0 C-N-CA 122.975 0.51 . . . . 75.140000000000001 110.557 -178.712 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . 0.414 ' O ' ' HG2' ' A' ' 79' ' ' LYS . 40.1 tp10 -52.75 -56.21 17.28 Favored 'General case' 0 N--CA 1.485 1.286 0 C-N-CA 125.109 1.364 . . . . 75.400000000000006 111.455 178.547 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 10.0 tt0 -70.56 -42.14 71.52 Favored 'General case' 0 N--CA 1.473 0.724 0 C-N-CA 123.088 0.555 . . . . 73.409999999999997 111.51 -171.336 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 84.4 mt -62.11 -38.4 88.76 Favored 'General case' 0 N--CA 1.483 1.217 0 O-C-N 123.397 0.436 . . . . 74.5 110.677 178.207 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . 0.644 HD23 ' HA ' ' A' ' 22' ' ' LEU . 46.0 mt -63.35 -49.1 75.22 Favored 'General case' 0 N--CA 1.476 0.845 0 O-C-N 123.452 0.47 . . . . 75.329999999999998 111.396 174.525 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 79' ' ' LYS . . . . . 0.414 ' HG2' ' O ' ' A' ' 75' ' ' GLU . 46.6 mmtm -62.87 -34.03 76.52 Favored 'General case' 0 N--CA 1.485 1.291 0 C-N-CA 122.978 0.511 . . . . 75.510000000000005 111.635 -177.766 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -75.28 -35.78 47.23 Favored Glycine 0 C--N 1.346 1.113 0 CA-C-N 115.197 -0.911 . . . . 54.43 112.408 177.125 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 1.5 tt -67.28 -37.37 83.32 Favored 'General case' 0 N--CA 1.477 0.877 0 C-N-CA 123.786 0.834 . . . . 71.299999999999997 109.03 178.172 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 82' ' ' LEU . . . . . 0.472 ' HG ' ' O ' ' A' ' 78' ' ' LEU . 60.1 mt -56.77 -43.0 80.39 Favored 'General case' 0 C--N 1.352 0.697 0 C-N-CA 123.768 0.827 . . . . 74.519999999999996 111.565 179.683 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 35.7 tt0 68.37 2.75 3.44 Favored 'General case' 0 CA--C 1.565 1.533 0 C-N-CA 124.375 1.07 . . . . 74.200000000000003 110.975 -173.019 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 14.9 mm100 -93.88 170.85 9.25 Favored 'General case' 0 N--CA 1.469 0.524 0 C-N-CA 124.284 1.033 . . . . 64.0 110.302 -173.839 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 85' ' ' ARG . . . . . . . . . . . . . 36.3 mmt180 -67.26 156.54 36.08 Favored 'General case' 0 C--O 1.246 0.886 0 CA-C-N 115.474 -0.784 . . . . 71.510000000000005 109.467 171.378 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 94.1 mt -78.35 75.62 4.87 Favored 'General case' 0 CA--C 1.548 0.873 0 CA-C-O 121.612 0.72 . . . . 75.019999999999996 110.507 -176.149 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 6.6 p-10 -142.87 -43.63 0.3 Allowed 'General case' 0 N--CA 1.474 0.756 0 C-N-CA 124.55 1.14 . . . . 74.219999999999999 108.416 174.331 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 37.3 mt-10 -69.42 122.73 19.54 Favored 'General case' 0 C--N 1.352 0.691 0 C-N-CA 123.465 0.706 . . . . 74.25 109.918 174.971 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 74.4 mt 64.02 11.25 5.98 Favored 'General case' 0 N--CA 1.487 1.388 0 C-N-CA 124.83 1.252 . . . . 73.540000000000006 111.906 -175.281 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 90' ' ' SER . . . . . 0.572 ' O ' ' HG ' ' A' ' 92' ' ' LEU . 6.0 m -111.05 -79.98 0.58 Allowed 'General case' 0 C--O 1.217 -0.654 0 N-CA-C 107.927 -1.138 . . . . 64.340000000000003 107.927 -176.908 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 32.8 t 54.52 -116.32 1.04 Allowed 'General case' 0 CA--C 1.563 1.476 0 C-N-CA 124.009 0.924 . . . . 73.519999999999996 111.039 -176.496 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 92' ' ' LEU . . . . . 0.576 HD23 ' HG2' ' A' ' 45' ' ' GLU . 43.7 mt 48.74 -148.53 0.23 Allowed 'General case' 0 N--CA 1.492 1.647 0 C-N-CA 124.737 1.215 . . . . 74.120000000000005 112.629 172.956 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 49.4 mt -53.41 111.12 0.26 Allowed 'Isoleucine or valine' 0 CA--C 1.558 1.26 0 C-N-CA 123.892 0.877 . . . . 74.129999999999995 110.182 167.203 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -76.86 0.61 65.44 Favored Glycine 0 C--N 1.35 1.314 0 CA-C-N 115.82 -0.627 . . . . 72.129999999999995 114.114 -175.561 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 9.9 tt0 -69.69 -11.58 60.96 Favored 'General case' 0 N--CA 1.48 1.071 0 C-N-CA 123.858 0.863 . . . . 64.129999999999995 110.67 169.254 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 19.6 t 73.25 17.49 3.97 Favored 'General case' 0 C--N 1.358 0.973 0 C-N-CA 124.944 1.298 . . . . 71.409999999999997 111.453 176.856 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 13.5 t -86.57 16.7 4.41 Favored 'General case' 0 CA--C 1.553 1.067 0 C-N-CA 123.732 0.813 . . . . 74.140000000000001 111.571 -179.346 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 14.3 mtm-85 -65.59 -58.13 6.49 Favored 'General case' 0 N--CA 1.489 1.515 0 C-N-CA 123.839 0.855 . . . . 74.340000000000003 112.554 -167.441 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 44.8 tt0 -63.4 -37.81 88.73 Favored 'General case' 0 CA--C 1.542 0.65 0 CA-C-N 115.296 -0.865 . . . . 75.140000000000001 109.675 178.344 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 51.5 tttm -68.17 -26.45 65.75 Favored 'General case' 0 CA--C 1.546 0.816 0 CA-C-N 114.794 -1.094 . . . . 72.219999999999999 111.357 177.766 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 47.2 t -73.23 -48.39 35.4 Favored 'General case' 0 N--CA 1.471 0.608 0 C-N-CA 123.502 0.721 . . . . 72.349999999999994 109.159 -178.509 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 9.5 mp -69.3 -30.1 68.1 Favored 'General case' 0 N--CA 1.484 1.266 0 O-C-N 123.498 0.499 . . . . 61.340000000000003 111.418 176.225 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 20.9 t-20 -71.01 -50.33 35.37 Favored 'General case' 0 N--CA 1.478 0.964 0 CA-C-O 121.055 0.455 . . . . 71.310000000000002 110.499 179.642 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 10.8 m120 -71.09 -18.9 62.52 Favored 'General case' 0 N--CA 1.479 1.016 0 C-N-CA 123.072 0.549 . . . . 73.329999999999998 111.091 176.449 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -64.91 -47.43 77.77 Favored 'General case' 0 C--N 1.349 0.572 0 O-C-N 123.626 0.579 . . . . 75.030000000000001 109.795 169.18 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 106' ' ' TYR . . . . . . . . . . . . . 1.1 t80 -58.11 -45.02 87.97 Favored 'General case' 0 N--CA 1.482 1.161 0 N-CA-C 109.482 -0.562 . . . . 73.530000000000001 109.482 174.225 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -58.79 -44.85 95.62 Favored Glycine 0 C--N 1.35 1.361 0 CA-C-N 115.778 -0.646 . . . . 71.129999999999995 113.345 -179.777 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 31.4 ptt180 -81.7 -14.53 56.44 Favored 'General case' 0 N--CA 1.476 0.828 0 C-N-CA 122.746 0.418 . . . . 73.219999999999999 111.051 -179.979 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 109' ' ' LEU . . . . . 0.544 HD12 ' HB2' ' A' ' 114' ' ' LEU . 36.4 tp -70.83 -43.37 68.7 Favored 'General case' 0 N--CA 1.486 1.373 0 N-CA-C 109.218 -0.66 . . . . 73.450000000000003 109.218 171.012 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 19.1 m -71.83 -36.44 70.2 Favored 'General case' 0 CA--C 1.547 0.837 0 CA-C-N 114.984 -1.007 . . . . 74.040000000000006 110.376 177.762 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . -91.02 -61.61 1.26 Allowed Glycine 0 C--N 1.358 1.789 0 N-CA-C 114.585 0.594 . . . . 72.0 114.585 -177.568 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 112' ' ' MET . . . . . . . . . . . . . 12.5 tpt -91.83 -69.72 0.73 Allowed 'General case' 0 N--CA 1.488 1.431 0 N-CA-C 112.961 0.726 . . . . 70.329999999999998 112.961 -172.377 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 18.8 tp 170.75 21.92 0.0 OUTLIER 'General case' 0 N--CA 1.493 1.721 0 C-N-CA 124.54 1.136 . . . . 72.219999999999999 110.593 -178.543 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 114' ' ' LEU . . . . . 0.669 ' HB3' HG21 ' A' ' 52' ' ' THR . 39.0 tp 72.68 -5.02 1.95 Allowed 'General case' 0 N--CA 1.499 1.999 0 C-N-CA 124.788 1.235 . . . . 75.129999999999995 111.698 -175.922 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 115' ' ' VAL . . . . . . . . . . . . . 30.2 m -83.2 141.93 43.5 Favored Pre-proline 0 CA--C 1.55 0.963 0 N-CA-C 108.804 -0.813 . . . . 75.340000000000003 108.804 173.552 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 29.5 Cg_endo -61.42 115.53 2.82 Favored 'Trans proline' 0 C--N 1.372 1.798 0 C-N-CA 122.789 2.326 . . . . 44.520000000000003 112.518 -177.164 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 32.9 t70 -155.42 -74.93 0.11 Allowed 'General case' 0 N--CA 1.474 0.743 0 C-N-CA 123.032 0.533 . . . . 71.329999999999998 109.6 176.993 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . 64.58 132.52 0.03 OUTLIER Pre-proline 0 CA--C 1.558 1.265 0 C-N-CA 124.768 1.227 . . . . 53.329999999999998 111.698 -176.675 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 119' ' ' PRO . . . . . . . . . . . . . 76.4 Cg_endo -81.41 -163.64 0.23 Allowed 'Trans proline' 0 C--N 1.371 1.722 0 C-N-CA 122.52 2.147 . . . . 73.329999999999998 111.195 177.663 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . -79.13 61.44 4.13 Favored Glycine 0 C--N 1.342 0.893 0 N-CA-C 111.546 -0.621 . . . . 74.129999999999995 111.546 171.182 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . -81.91 76.71 8.8 Favored 'General case' 0 C--N 1.35 0.624 0 C-N-CA 124.038 0.935 . . . . 71.430000000000007 109.808 -175.67 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 122' ' ' SER . . . . . . . . . . . . . 24.7 t . . . . . 0 C--O 1.255 1.371 0 C-N-CA 124.231 1.012 . . . . 72.209999999999994 110.116 -178.042 . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 25.3 ttt . . . . . 0 CA--C 1.558 1.257 0 N-CA-C 110.369 -0.234 . . . . 62.039999999999999 110.369 . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 74.1 p -55.63 -56.48 19.85 Favored 'General case' 0 N--CA 1.489 1.523 0 C-N-CA 123.957 0.903 . . . . 73.200000000000003 112.546 -171.971 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 34.1 t -65.23 -30.63 71.54 Favored 'General case' 0 N--CA 1.478 0.94 0 C-N-CA 123.208 0.603 . . . . 74.219999999999999 111.474 -177.178 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 4' ' ' THR . . . . . 0.446 ' HA ' ' HG3' ' A' ' 53' ' ' PRO . 28.0 m -72.27 -43.03 64.88 Favored 'General case' 0 N--CA 1.471 0.624 0 C-N-CA 123.162 0.585 . . . . 70.310000000000002 111.214 179.078 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 76.6 t -63.59 -45.77 96.72 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.759 0 N-CA-C 109.2 -0.667 . . . . 70.299999999999997 109.2 179.29 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 24.1 mm-40 -56.66 -51.63 68.01 Favored 'General case' 0 N--CA 1.475 0.783 0 O-C-N 124.058 0.849 . . . . 74.510000000000005 110.627 174.226 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 34.0 t80 -58.11 -53.65 55.84 Favored 'General case' 0 N--CA 1.481 1.122 0 C-N-CA 124.195 0.998 . . . . 73.340000000000003 111.496 -173.577 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . 0.407 ' O ' ' HG3' ' A' ' 12' ' ' GLN . 72.1 mt -61.77 -45.32 98.94 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.967 0 C-N-CA 123.54 0.736 . . . . 72.310000000000002 110.151 178.776 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 26.2 t-20 -62.01 -32.86 73.38 Favored 'General case' 0 N--CA 1.488 1.436 0 C-N-CA 123.894 0.878 . . . . 74.239999999999995 111.954 -177.897 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . 0.415 ' O ' HG13 ' A' ' 14' ' ' ILE . 96.6 mtt180 -78.13 -34.75 49.75 Favored 'General case' 0 C--O 1.214 -0.773 0 CA-C-N 115.954 -0.566 . . . . 74.310000000000002 110.042 178.694 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 11' ' ' TRP . . . . . . . . . . . . . 53.0 m95 -67.28 -33.76 75.98 Favored 'General case' 0 N--CA 1.482 1.163 0 O-C-N 122.916 0.135 . . . . 74.310000000000002 111.131 172.037 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . 0.43 ' HG2' ' CE2' ' A' ' 67' ' ' TYR . 51.4 mt-30 -61.42 -48.41 81.31 Favored 'General case' 0 C--O 1.218 -0.562 0 N-CA-C 108.327 -0.99 . . . . 73.409999999999997 108.327 171.939 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 79.2 ttt180 -62.56 -48.59 78.83 Favored 'General case' 0 C--O 1.216 -0.687 0 O-C-N 124.638 1.211 . . . . 74.329999999999998 111.373 -175.799 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 14' ' ' ILE . . . . . 0.415 HG13 ' O ' ' A' ' 10' ' ' ARG . 90.9 mt -62.44 -43.12 97.93 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.002 0 C-N-CA 123.615 0.766 . . . . 75.299999999999997 109.69 -179.312 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . 0.64 ' HA ' ' HB ' ' A' ' 71' ' ' THR . . . -60.79 -44.3 97.0 Favored 'General case' 0 N--CA 1.482 1.139 0 C-N-CA 123.373 0.669 . . . . 73.319999999999993 111.799 176.645 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 87.8 mt -74.76 -35.58 62.58 Favored 'General case' 0 N--CA 1.485 1.301 0 CA-C-N 115.143 -0.935 . . . . 73.400000000000006 111.038 -175.027 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . 0.498 ' O ' ' HG ' ' A' ' 21' ' ' LEU . 72.4 mt -72.05 -47.31 52.57 Favored 'General case' 0 N--CA 1.475 0.798 0 C-N-CA 122.912 0.485 . . . . 75.299999999999997 109.742 -177.721 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 79.3 p -65.1 -36.0 82.9 Favored 'General case' 0 N--CA 1.48 1.048 0 C-N-CA 123.04 0.536 . . . . 72.310000000000002 111.091 176.951 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 6.4 tp-100 -61.88 -45.57 93.16 Favored 'General case' 0 N--CA 1.475 0.79 0 C-N-CA 123.391 0.676 . . . . 74.120000000000005 110.189 174.971 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 66.5 m -58.79 -52.93 63.63 Favored 'General case' 0 C--O 1.202 -1.442 0 CA-C-N 114.929 -1.032 . . . . 75.239999999999995 109.584 174.7 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . 0.626 HD22 ' HA ' ' A' ' 33' ' ' LEU . 52.6 mt -62.22 -27.69 69.16 Favored 'General case' 0 N--CA 1.473 0.699 0 C-N-CA 123.676 0.79 . . . . 74.430000000000007 111.323 -175.963 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . 0.661 ' HA ' HD23 ' A' ' 78' ' ' LEU . 56.8 tp -70.51 -54.09 13.59 Favored 'General case' 0 N--CA 1.472 0.651 0 C-N-CA 122.953 0.501 . . . . 74.120000000000005 109.894 176.691 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . 0.447 ' O ' ' HG3' ' A' ' 27' ' ' ARG . 44.6 mt-10 -59.12 -52.74 64.43 Favored 'General case' 0 CA--C 1.545 0.776 0 O-C-N 123.929 0.768 . . . . 74.439999999999998 110.246 179.506 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . 0.446 ' HB3' ' HB2' ' A' ' 29' ' ' GLU . 92.2 mt -53.56 -42.56 67.65 Favored 'General case' 0 N--CA 1.479 1.007 0 C-N-CA 125.441 1.496 . . . . 75.109999999999999 112.174 176.578 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . 0.466 ' HB3' HD23 ' A' ' 33' ' ' LEU . . . -58.28 -47.68 82.87 Favored 'General case' 0 N--CA 1.484 1.237 0 C-N-CA 122.944 0.498 . . . . 74.019999999999996 110.901 176.918 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 90.8 mt-30 -66.59 -30.34 70.61 Favored 'General case' 0 CA--C 1.555 1.157 0 CA-C-N 114.99 -1.005 . . . . 73.329999999999998 111.141 178.721 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . 0.447 ' HG3' ' O ' ' A' ' 23' ' ' GLU . 94.9 mtt180 -78.38 -17.81 55.94 Favored 'General case' 0 N--CA 1.483 1.202 0 C-N-CA 123.857 0.863 . . . . 75.450000000000003 111.326 178.253 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 92.43 9.27 61.83 Favored Glycine 0 N--CA 1.475 1.283 0 C-N-CA 122.922 0.296 . . . . 63.200000000000003 113.564 -178.231 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . 0.446 ' HB2' ' HB3' ' A' ' 24' ' ' LEU . 5.4 mm-40 -82.58 53.72 2.42 Favored 'General case' 0 CA--C 1.55 0.973 0 C-N-CA 124.387 1.075 . . . . 72.209999999999994 111.014 178.09 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 30' ' ' TRP . . . . . . . . . . . . . 86.4 m95 -63.56 -28.89 70.25 Favored 'General case' 0 N--CA 1.483 1.187 0 C-N-CA 123.902 0.881 . . . . 73.109999999999999 111.717 -176.404 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 31' ' ' ASP . . . . . 0.477 ' O ' ' HG3' ' A' ' 35' ' ' GLN . 3.4 m-20 -53.23 -46.37 69.1 Favored 'General case' 0 N--CA 1.475 0.823 0 C-N-CA 123.603 0.761 . . . . 74.319999999999993 110.548 174.789 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . 0.427 HD11 HD23 ' A' ' 24' ' ' LEU . 64.9 mt -67.14 -28.25 67.98 Favored 'General case' 0 CA--C 1.549 0.94 0 CA-C-N 115.501 -0.772 . . . . 74.219999999999999 111.34 -176.527 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . 0.626 ' HA ' HD22 ' A' ' 21' ' ' LEU . 9.6 mp -68.61 -43.81 75.6 Favored 'General case' 0 N--CA 1.486 1.36 0 C-N-CA 123.122 0.569 . . . . 72.420000000000002 110.116 173.365 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 79.3 mt -64.36 -36.97 85.86 Favored 'General case' 0 CA--C 1.551 0.986 0 CA-C-N 115.324 -0.853 . . . . 73.319999999999993 111.348 178.844 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 35' ' ' GLN . . . . . 0.477 ' HG3' ' O ' ' A' ' 31' ' ' ASP . 90.4 mt-30 -69.74 -51.55 33.23 Favored 'General case' 0 N--CA 1.481 1.119 0 C-N-CA 123.292 0.637 . . . . 74.109999999999999 110.312 177.608 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 36' ' ' GLN . . . . . 0.423 ' HB2' HD23 ' A' ' 21' ' ' LEU . 77.2 mm-40 -70.87 -14.25 62.33 Favored 'General case' 0 N--CA 1.477 0.888 0 CA-C-N 115.248 -0.887 . . . . 73.420000000000002 112.993 -177.73 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 38.3 tt0 -45.31 -51.38 11.07 Favored 'General case' 0 N--CA 1.487 1.377 0 CA-C-N 118.287 0.494 . . . . 74.299999999999997 111.373 174.241 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 81.4 t -61.12 -54.57 33.52 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.793 0 O-C-N 123.877 0.736 . . . . 72.510000000000005 110.74 -179.027 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 21.9 m -65.51 -52.09 55.21 Favored 'General case' 0 CA--C 1.551 1.006 0 C-N-CA 123.525 0.73 . . . . 74.030000000000001 112.507 -173.441 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 44.4 t80 -60.58 -51.53 69.01 Favored 'General case' 0 N--CA 1.478 0.951 0 C-N-CA 124.792 1.237 . . . . 74.109999999999999 111.904 -179.077 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . 0.461 HD13 ' O ' ' A' ' 90' ' ' SER . 64.4 mt -77.81 -23.35 49.1 Favored 'General case' 0 CA--C 1.546 0.793 0 CA-C-N 116.317 -0.401 . . . . 75.319999999999993 111.604 -174.688 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 51.8 tt0 -66.54 -44.49 82.24 Favored 'General case' 0 N--CA 1.484 1.255 0 N-CA-C 109.435 -0.579 . . . . 65.450000000000003 109.435 168.7 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 43' ' ' SER . . . . . 0.42 ' O ' HG23 ' A' ' 47' ' ' VAL . 74.3 m -60.79 -43.51 98.0 Favored 'General case' 0 N--CA 1.476 0.859 0 C-N-CA 123.251 0.62 . . . . 71.329999999999998 111.582 179.465 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 44' ' ' ILE . . . . . 0.451 HG23 ' HA ' ' A' ' 41' ' ' LEU . 12.5 tt -69.02 -40.45 80.86 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.972 0 O-C-N 123.121 0.263 . . . . 75.329999999999998 110.464 -178.145 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 14.3 mm-40 -58.81 -42.51 89.34 Favored 'General case' 0 N--CA 1.484 1.251 0 C-N-CA 122.895 0.478 . . . . 70.510000000000005 110.767 172.747 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 99.4 m -62.0 -43.37 98.97 Favored 'General case' 0 N--CA 1.48 1.059 0 C-N-CA 123.919 0.888 . . . . 52.439999999999998 111.578 -179.437 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 47' ' ' VAL . . . . . 0.42 HG23 ' O ' ' A' ' 43' ' ' SER . 58.0 t -67.95 -41.89 85.07 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.012 0 C-N-CA 122.269 0.228 . . . . 75.400000000000006 110.938 178.889 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 48' ' ' MET . . . . . . . . . . . . . 78.4 mtm -68.91 -34.45 75.41 Favored 'General case' 0 N--CA 1.484 1.244 0 N-CA-C 112.479 0.548 . . . . 73.540000000000006 112.479 -177.468 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 13.1 pt-20 -82.33 -24.22 34.7 Favored 'General case' 0 N--CA 1.487 1.407 0 C-N-CA 122.355 0.262 . . . . 72.319999999999993 111.359 179.574 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 13.4 mptt -83.72 143.66 29.87 Favored 'General case' 0 N--CA 1.479 1.021 0 C-N-CA 122.914 0.486 . . . . 75.510000000000005 110.228 177.808 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 51.1 tt0 -74.55 137.48 42.44 Favored 'General case' 0 CA--C 1.542 0.645 0 CA-C-N 114.975 -1.011 . . . . 72.319999999999993 110.581 -178.869 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 17.4 m -62.95 132.76 95.09 Favored Pre-proline 0 CA--C 1.561 1.397 0 O-C-N 123.799 0.687 . . . . 62.240000000000002 110.381 175.637 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 53' ' ' PRO . . . . . 0.446 ' HG3' ' HA ' ' A' ' 4' ' ' THR . 61.0 Cg_endo -70.05 156.26 63.0 Favored 'Trans proline' 0 C--N 1.377 2.072 0 C-N-CA 122.645 2.23 . . . . 74.040000000000006 112.424 177.376 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 35.6 Cg_endo -64.5 -47.57 5.51 Favored 'Trans proline' 0 C--N 1.374 1.891 0 C-N-CA 122.803 2.335 . . . . 71.219999999999999 113.284 175.61 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . -67.14 83.34 0.12 Allowed Glycine 0 C--N 1.347 1.154 0 O-C-N 123.866 0.729 . . . . 72.420000000000002 113.613 -174.115 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 60.5 mt -124.86 103.02 11.71 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.455 0 C-N-CA 124.203 1.001 . . . . 75.319999999999993 108.455 175.164 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 81.9 p -83.67 -178.9 7.17 Favored 'General case' 0 N--CA 1.473 0.712 0 N-CA-C 109.244 -0.65 . . . . 62.340000000000003 109.244 170.547 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 27.1 tpt180 -69.04 -35.53 76.69 Favored 'General case' 0 N--CA 1.472 0.626 0 N-CA-C 110.016 -0.364 . . . . 74.310000000000002 110.016 177.261 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 35.9 m -60.49 -47.9 84.1 Favored 'General case' 0 CA--C 1.546 0.799 0 C-N-CA 123.212 0.605 . . . . 74.540000000000006 110.716 176.508 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 86.1 mt -61.75 -42.73 95.52 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.814 0 CA-C-N 115.097 -0.956 . . . . 74.310000000000002 110.405 176.347 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 64.5 tt0 -65.26 -36.3 83.7 Favored 'General case' 0 N--CA 1.476 0.864 0 C-N-CA 123.754 0.822 . . . . 74.340000000000003 111.597 -178.129 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 37.2 m-20 -75.68 -38.1 59.01 Favored 'General case' 0 N--CA 1.481 1.079 0 C-N-CA 122.831 0.452 . . . . 62.240000000000002 111.786 179.924 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 63' ' ' MET . . . . . . . . . . . . . 72.3 mtm -66.8 -51.55 54.43 Favored 'General case' 0 N--CA 1.482 1.125 0 C-N-CA 122.4 0.28 . . . . 75.450000000000003 110.446 176.649 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 64' ' ' VAL . . . . . 0.481 ' O ' HG13 ' A' ' 68' ' ' ILE . 55.5 t -59.58 -58.97 4.7 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.765 0 C-N-CA 123.524 0.73 . . . . 73.349999999999994 110.768 179.128 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -62.26 -35.94 80.53 Favored 'General case' 0 N--CA 1.488 1.475 0 C-N-CA 122.567 0.347 . . . . 64.230000000000004 111.876 -178.405 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -59.27 -41.68 96.93 Favored Glycine 0 C--N 1.347 1.172 0 N-CA-C 111.776 -0.529 . . . . 72.420000000000002 111.776 175.138 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 67' ' ' TYR . . . . . 0.43 ' CE2' ' HG2' ' A' ' 12' ' ' GLN . 10.7 m-30 -78.86 -29.81 44.75 Favored 'General case' 0 N--CA 1.467 0.422 0 N-CA-C 113.198 0.814 . . . . 74.420000000000002 113.198 -179.902 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 68' ' ' ILE . . . . . 0.481 HG13 ' O ' ' A' ' 64' ' ' VAL . 59.4 mt -64.85 -51.64 64.35 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.095 0 N-CA-C 108.414 -0.958 . . . . 74.109999999999999 108.414 174.702 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 20.2 tptm -55.21 -45.17 75.89 Favored 'General case' 0 N--CA 1.474 0.767 0 O-C-N 123.913 0.758 . . . . 73.530000000000001 110.57 175.119 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 55.4 tt0 -61.38 -45.39 94.55 Favored 'General case' 0 C--N 1.352 0.717 0 O-C-N 123.818 0.699 . . . . 75.349999999999994 110.848 -176.3 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 71' ' ' THR . . . . . 0.64 ' HB ' ' HA ' ' A' ' 15' ' ' ALA . 11.1 t -78.3 -28.1 47.4 Favored 'General case' 0 C--N 1.353 0.752 0 O-C-N 122.999 0.187 . . . . 75.540000000000006 110.999 -173.864 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 72' ' ' LEU . . . . . 0.413 ' O ' ' HB2' ' A' ' 76' ' ' GLN . 36.0 mt -73.64 -29.54 62.4 Favored 'General case' 0 N--CA 1.474 0.748 0 O-C-N 123.407 0.442 . . . . 75.230000000000004 110.658 174.966 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 33.3 t70 -77.22 -43.49 33.4 Favored 'General case' 0 N--CA 1.48 1.055 0 O-C-N 123.907 0.754 . . . . 75.319999999999993 110.678 178.927 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 74' ' ' ASN . . . . . 0.413 ' HA ' HD21 ' A' ' 22' ' ' LEU . 82.7 m-20 -59.66 -49.57 77.25 Favored 'General case' 0 N--CA 1.472 0.638 0 CA-C-N 115.613 -0.721 . . . . 65.5 109.676 176.499 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . 0.412 ' HA ' ' HB2' ' A' ' 78' ' ' LEU . 25.5 tt0 -74.7 -23.1 58.55 Favored 'General case' 0 CA--C 1.552 1.027 0 CA-C-N 115.082 -0.963 . . . . 71.239999999999995 111.494 179.609 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 76' ' ' GLN . . . . . 0.413 ' HB2' ' O ' ' A' ' 72' ' ' LEU . 8.9 tt0 -58.88 -48.31 81.84 Favored 'General case' 0 N--CA 1.488 1.426 0 N-CA-C 109.085 -0.709 . . . . 74.340000000000003 109.085 172.283 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 82.6 mt -67.56 -43.72 79.97 Favored 'General case' 0 CA--C 1.548 0.869 0 CA-C-N 115.169 -0.923 . . . . 73.120000000000005 111.183 177.451 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . 0.661 HD23 ' HA ' ' A' ' 22' ' ' LEU . 61.1 mt -62.18 -58.75 6.61 Favored 'General case' 0 N--CA 1.486 1.343 0 C-N-CA 123.35 0.66 . . . . 75.420000000000002 112.474 -178.421 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 79' ' ' LYS . . . . . 0.585 ' HB3' ' HA ' ' A' ' 84' ' ' GLN . 46.3 mmtm -64.49 -34.47 78.29 Favored 'General case' 0 CA--C 1.553 1.08 0 C-N-CA 123.159 0.584 . . . . 72.510000000000005 110.611 176.794 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -62.5 -28.3 71.01 Favored Glycine 0 C--N 1.346 1.137 0 CA-C-N 116.695 -0.23 . . . . 72.200000000000003 112.928 175.396 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 8.6 tt -86.16 -47.13 9.76 Favored 'General case' 0 CA--C 1.545 0.769 0 C-N-CA 123.871 0.868 . . . . 75.430000000000007 109.728 175.281 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 50.4 mt -87.3 -66.15 0.94 Allowed 'General case' 0 N--CA 1.478 0.938 0 C-N-CA 123.682 0.793 . . . . 74.209999999999994 110.667 -166.415 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 2.0 mm100 -177.92 97.3 0.04 OUTLIER 'General case' 0 N--CA 1.475 0.786 0 C-N-CA 125.002 1.321 . . . . 73.120000000000005 108.91 -172.486 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 84' ' ' GLN . . . . . 0.585 ' HA ' ' HB3' ' A' ' 79' ' ' LYS . 7.2 tt0 -43.77 -53.98 5.51 Favored 'General case' 0 N--CA 1.491 1.583 0 C-N-CA 124.761 1.224 . . . . 75.5 111.492 172.27 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 85' ' ' ARG . . . . . . . . . . . . . 99.6 mtt180 -70.01 130.45 42.2 Favored 'General case' 0 CA--C 1.543 0.702 0 CA-C-N 114.517 -1.22 . . . . 72.25 108.979 170.339 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 72.8 mt -54.01 110.31 0.58 Allowed 'General case' 0 N--CA 1.478 0.938 0 C-N-CA 123.904 0.882 . . . . 74.209999999999994 110.527 -179.535 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 14.0 t70 -157.44 -62.15 0.09 Allowed 'General case' 0 CA--C 1.541 0.619 0 N-CA-C 109.303 -0.628 . . . . 74.219999999999999 109.303 -171.869 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 34.6 mm-40 -67.1 -42.49 84.49 Favored 'General case' 0 N--CA 1.486 1.33 0 C-N-CA 122.962 0.505 . . . . 75.549999999999997 110.69 172.709 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 90.5 mt -136.09 109.16 7.69 Favored 'General case' 0 CA--C 1.544 0.723 0 N-CA-C 107.576 -1.268 . . . . 72.200000000000003 107.576 176.131 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 90' ' ' SER . . . . . 0.461 ' O ' HD13 ' A' ' 41' ' ' LEU . 14.0 m -113.78 -89.23 0.54 Allowed 'General case' 0 N--CA 1.482 1.14 0 C-N-CA 123.112 0.565 . . . . 71.25 110.674 -176.351 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 22.1 t 50.64 26.12 2.34 Favored 'General case' 0 N--CA 1.499 1.976 0 C-N-CA 124.861 1.264 . . . . 65.209999999999994 114.314 174.867 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 92' ' ' LEU . . . . . 0.442 ' HG ' ' O ' ' A' ' 90' ' ' SER . 97.7 mt -124.67 -173.12 2.71 Favored 'General case' 0 N--CA 1.491 1.576 0 C-N-CA 123.582 0.753 . . . . 73.340000000000003 110.863 -178.487 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 60.4 mt -59.04 -71.61 0.1 Allowed 'Isoleucine or valine' 0 N--CA 1.482 1.146 0 C-N-CA 124.023 0.929 . . . . 75.409999999999997 111.768 -178.608 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -139.53 -123.26 2.05 Favored Glycine 0 C--N 1.346 1.135 0 N-CA-C 112.099 -0.401 . . . . 52.409999999999997 112.099 -173.949 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -88.46 148.2 24.29 Favored 'General case' 0 N--CA 1.477 0.91 0 C-N-CA 122.896 0.478 . . . . 73.329999999999998 109.881 176.099 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 70.2 p 52.26 -79.88 0.01 OUTLIER 'General case' 0 CA--C 1.559 1.289 0 C-N-CA 125.79 1.636 . . . . 63.130000000000003 111.972 -175.705 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 28.1 m 66.74 -80.35 0.03 OUTLIER 'General case' 0 CA--C 1.555 1.145 0 C-N-CA 125.188 1.395 . . . . 75.530000000000001 111.905 175.779 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 98' ' ' ARG . . . . . 0.417 ' HB2' HD11 ' A' ' 44' ' ' ILE . 0.0 OUTLIER -62.64 -43.9 97.64 Favored 'General case' 0 N--CA 1.488 1.446 0 N-CA-C 112.581 0.586 . . . . 73.409999999999997 112.581 -170.243 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 3.8 pt20 -70.5 -40.06 73.78 Favored 'General case' 0 N--CA 1.477 0.885 0 C-N-CA 122.61 0.364 . . . . 74.329999999999998 110.331 -174.768 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 23.6 tptm -66.9 -46.12 75.85 Favored 'General case' 0 CA--C 1.55 0.96 0 C-N-CA 124.144 0.978 . . . . 75.239999999999995 110.579 -179.498 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 31.4 t -72.68 -39.56 66.97 Favored 'General case' 0 N--CA 1.476 0.835 0 CA-C-N 115.155 -0.93 . . . . 72.120000000000005 111.546 -174.437 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 11.2 mp -78.39 -29.69 47.41 Favored 'General case' 0 N--CA 1.485 1.281 0 C-N-CA 122.684 0.394 . . . . 73.129999999999995 111.54 -179.838 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 50.1 t-20 -64.97 -45.85 83.96 Favored 'General case' 0 N--CA 1.482 1.13 0 N-CA-C 108.563 -0.903 . . . . 65.310000000000002 108.563 172.239 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 40.3 t-20 -59.71 -47.0 87.39 Favored 'General case' 0 N--CA 1.478 0.945 0 CA-C-N 115.269 -0.878 . . . . 72.239999999999995 109.557 176.017 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -63.87 -33.63 76.13 Favored 'General case' 0 CA--C 1.538 0.503 0 CA-C-N 115.112 -0.949 . . . . 73.530000000000001 111.627 -178.488 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 106' ' ' TYR . . . . . . . . . . . . . 3.9 t80 -70.54 -54.23 12.98 Favored 'General case' 0 N--CA 1.476 0.838 0 C-N-CA 122.897 0.479 . . . . 74.310000000000002 110.071 -179.063 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -62.64 -32.03 82.02 Favored Glycine 0 C--N 1.345 1.064 0 CA-C-N 115.512 -0.767 . . . . 74.430000000000007 112.573 -178.781 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 108' ' ' ARG . . . . . 0.578 ' HG2' ' HA ' ' A' ' 116' ' ' PRO . 9.7 mpt_? -83.28 -21.5 33.27 Favored 'General case' 0 C--O 1.217 -0.641 0 C-N-CA 122.935 0.494 . . . . 74.239999999999995 110.62 176.463 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 109' ' ' LEU . . . . . 0.517 HD11 ' HB2' ' A' ' 114' ' ' LEU . 43.9 tp -68.79 -31.18 70.0 Favored 'General case' 0 N--CA 1.494 1.728 0 CA-C-N 118.841 0.746 . . . . 74.030000000000001 109.603 170.633 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 25.7 t -72.81 -46.57 52.44 Favored 'General case' 0 CA--C 1.551 1.002 0 CA-C-N 115.382 -0.826 . . . . 60.5 110.205 170.592 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . -89.97 -63.0 1.27 Allowed Glycine 0 C--N 1.358 1.793 0 N-CA-C 115.67 1.028 . . . . 71.209999999999994 115.67 -172.201 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 112' ' ' MET . . . . . . . . . . . . . 54.8 mmm -92.67 -69.51 0.74 Allowed 'General case' 0 N--CA 1.49 1.542 0 CA-C-N 118.277 1.038 . . . . 72.219999999999999 113.683 -175.472 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 113' ' ' LEU . . . . . 0.404 ' HB3' HG23 ' A' ' 115' ' ' VAL . 15.2 tp 173.27 28.76 0.0 OUTLIER 'General case' 0 N--CA 1.492 1.629 0 C-N-CA 123.34 0.656 . . . . 75.420000000000002 109.673 -169.769 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 114' ' ' LEU . . . . . 0.517 ' HB2' HD11 ' A' ' 109' ' ' LEU . 6.3 tt 77.12 -22.47 0.28 Allowed 'General case' 0 N--CA 1.501 2.115 0 C-N-CA 125.454 1.502 . . . . 73.310000000000002 111.267 -172.394 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 115' ' ' VAL . . . . . 0.404 HG23 ' HB3' ' A' ' 113' ' ' LEU . 29.0 m -79.11 127.86 77.99 Favored Pre-proline 0 CA--C 1.557 1.23 0 C-N-CA 123.511 0.724 . . . . 72.230000000000004 110.352 179.795 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 116' ' ' PRO . . . . . 0.578 ' HA ' ' HG2' ' A' ' 108' ' ' ARG . 80.6 Cg_endo -77.86 157.7 31.2 Favored 'Trans proline' 0 C--N 1.377 2.034 0 C-N-CA 122.514 2.143 . . . . 74.430000000000007 112.244 176.498 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 13.3 t70 -100.79 -70.51 0.74 Allowed 'General case' 0 N--CA 1.472 0.646 0 N-CA-C 108.098 -1.075 . . . . 63.310000000000002 108.098 176.854 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -148.82 105.48 3.43 Favored Pre-proline 0 CA--C 1.555 1.138 0 C-N-CA 124.498 1.119 . . . . 61.009999999999998 108.583 178.111 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 119' ' ' PRO . . . . . . . . . . . . . 42.3 Cg_endo -64.7 150.17 88.59 Favored 'Trans proline' 0 C--N 1.378 2.095 0 C-N-CA 122.789 2.326 . . . . 72.099999999999994 112.718 -179.316 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . -155.53 84.27 0.14 Allowed Glycine 0 C--N 1.344 1.017 0 N-CA-C 111.848 -0.501 . . . . 64.530000000000001 111.848 -175.506 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . -145.16 -178.06 5.86 Favored 'General case' 0 N--CA 1.475 0.82 0 C-N-CA 124.127 0.971 . . . . 74.030000000000001 109.86 -179.542 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 122' ' ' SER . . . . . . . . . . . . . 40.3 m . . . . . 0 CA--C 1.553 1.061 0 N-CA-C 108.825 -0.806 . . . . 71.310000000000002 108.825 172.369 . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 1' ' ' MET . . . . . 0.5 ' SD ' ' HB ' ' A' ' 4' ' ' THR . 13.7 tpt . . . . . 0 N--CA 1.482 1.138 0 CA-C-O 119.272 -0.394 . . . . 71.049999999999997 111.217 . . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 62.5 m -53.94 -47.4 71.29 Favored 'General case' 0 N--CA 1.489 1.498 0 C-N-CA 124.205 1.002 . . . . 75.219999999999999 112.572 -175.388 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 46.9 t -62.69 -38.25 89.68 Favored 'General case' 0 N--CA 1.481 1.124 0 C-N-CA 123.025 0.53 . . . . 72.109999999999999 110.656 177.347 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 4' ' ' THR . . . . . 0.5 ' HB ' ' SD ' ' A' ' 1' ' ' MET . 11.9 m -69.35 -33.39 73.02 Favored 'General case' 0 CA--C 1.547 0.853 0 C-N-CA 123.508 0.723 . . . . 73.409999999999997 111.059 179.552 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 62.9 t -64.58 -48.56 84.39 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.175 0 C-N-CA 123.504 0.722 . . . . 75.349999999999994 109.837 177.376 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 26.7 mm-40 -62.29 -41.03 98.16 Favored 'General case' 0 N--CA 1.477 0.923 0 O-C-N 123.904 0.752 . . . . 74.0 110.896 175.753 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 65.2 t80 -60.99 -46.4 90.9 Favored 'General case' 0 CA--C 1.547 0.855 0 C-N-CA 124.487 1.115 . . . . 73.310000000000002 110.937 -176.608 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . 0.428 HG13 ' O ' ' A' ' 4' ' ' THR . 85.0 mt -62.14 -52.62 58.09 Favored 'Isoleucine or valine' 0 C--N 1.356 0.882 0 O-C-N 123.778 0.674 . . . . 74.310000000000002 109.559 175.906 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 28.4 t-20 -58.67 -34.29 71.08 Favored 'General case' 0 N--CA 1.481 1.118 0 O-C-N 124.177 0.923 . . . . 65.400000000000006 111.781 -174.762 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 99.2 mtt180 -78.19 -37.07 46.48 Favored 'General case' 0 N--CA 1.471 0.616 0 C-N-CA 123.039 0.535 . . . . 74.230000000000004 111.021 -179.8 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 11' ' ' TRP . . . . . . . . . . . . . 51.3 m95 -71.59 -25.8 62.33 Favored 'General case' 0 N--CA 1.484 1.226 0 N-CA-C 111.549 0.203 . . . . 74.349999999999994 111.549 172.518 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . 0.492 ' HG2' ' CE2' ' A' ' 67' ' ' TYR . 53.0 mt-30 -67.25 -44.81 78.49 Favored 'General case' 0 C--O 1.208 -1.101 0 N-CA-C 108.163 -1.051 . . . . 73.450000000000003 108.163 170.399 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 15.0 tpt180 -60.48 -44.17 96.19 Favored 'General case' 0 CA--C 1.545 0.762 0 O-C-N 124.152 0.908 . . . . 75.109999999999999 110.816 -177.042 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 58.3 mt -68.32 -45.84 81.89 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.997 0 C-N-CA 122.601 0.36 . . . . 74.299999999999997 110.035 177.916 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . 0.571 ' HA ' ' HB ' ' A' ' 71' ' ' THR . . . -56.87 -49.0 76.81 Favored 'General case' 0 N--CA 1.484 1.251 0 C-N-CA 123.76 0.824 . . . . 71.310000000000002 111.551 -179.976 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 96.8 mt -73.33 -43.71 60.3 Favored 'General case' 0 N--CA 1.475 0.802 0 CA-C-N 114.422 -1.263 . . . . 72.129999999999995 110.675 -173.154 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . 0.483 ' O ' ' HG ' ' A' ' 21' ' ' LEU . 40.7 mt -61.05 -53.53 56.03 Favored 'General case' 0 N--CA 1.481 1.077 0 O-C-N 123.606 0.566 . . . . 74.109999999999999 110.566 178.68 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 87.2 p -65.69 -33.55 76.14 Favored 'General case' 0 N--CA 1.478 0.953 0 O-C-N 123.682 0.614 . . . . 71.430000000000007 111.231 -176.04 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 6.7 tp-100 -69.11 -37.32 78.32 Favored 'General case' 0 N--CA 1.479 0.975 0 C-N-CA 122.845 0.458 . . . . 62.130000000000003 110.836 175.601 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 68.9 m -70.05 -33.24 71.7 Favored 'General case' 0 CA--C 1.539 0.542 0 CA-C-N 115.826 -0.624 . . . . 73.239999999999995 110.66 174.423 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . 0.598 HD22 ' HA ' ' A' ' 33' ' ' LEU . 50.5 mt -73.91 -29.2 61.93 Favored 'General case' 0 N--CA 1.474 0.755 0 C-N-CA 123.146 0.578 . . . . 65.140000000000001 110.044 178.294 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . 0.699 ' HA ' HD23 ' A' ' 78' ' ' LEU . 50.3 tp -67.29 -48.46 67.58 Favored 'General case' 0 N--CA 1.47 0.545 0 C-N-CA 123.366 0.666 . . . . 73.010000000000005 109.357 174.425 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 38.3 mm-40 -51.06 -59.4 4.21 Favored 'General case' 0 N--CA 1.47 0.555 0 C-N-CA 124.169 0.988 . . . . 74.209999999999994 111.374 173.263 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . 0.401 HD22 HD11 ' A' ' 32' ' ' LEU . 93.6 mt -59.09 -46.54 88.02 Favored 'General case' 0 CA--C 1.539 0.548 0 O-C-N 124.233 0.958 . . . . 72.219999999999999 111.358 -175.585 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . 0.472 ' HB2' HD22 ' A' ' 33' ' ' LEU . . . -60.06 -45.24 93.53 Favored 'General case' 0 N--CA 1.48 1.038 0 C-N-CA 123.413 0.685 . . . . 73.120000000000005 112.047 -177.915 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 97.1 mt-30 -67.04 -32.03 72.96 Favored 'General case' 0 N--CA 1.483 1.2 0 C-N-CA 123.169 0.587 . . . . 73.099999999999994 111.269 178.15 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 92.5 mtt-85 -83.97 -2.2 56.13 Favored 'General case' 0 N--CA 1.479 1.005 0 C-N-CA 123.591 0.757 . . . . 72.510000000000005 111.239 176.716 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 92.7 2.33 67.34 Favored Glycine 0 C--N 1.356 1.679 0 C-N-CA 123.37 0.509 . . . . 71.019999999999996 114.2 171.256 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 58.9 mm-40 -83.66 70.01 10.24 Favored 'General case' 0 CA--C 1.548 0.896 0 C-N-CA 124.123 0.969 . . . . 75.349999999999994 111.563 -179.827 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 30' ' ' TRP . . . . . . . . . . . . . 65.3 m95 -69.93 -39.31 76.19 Favored 'General case' 0 N--CA 1.482 1.173 0 C-N-CA 123.983 0.913 . . . . 74.310000000000002 111.628 -176.626 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 18.2 m-20 -62.06 -31.9 72.36 Favored 'General case' 0 N--CA 1.477 0.901 0 CA-C-N 115.517 -0.765 . . . . 74.530000000000001 111.001 -177.616 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . 0.401 HD11 HD22 ' A' ' 24' ' ' LEU . 62.1 mt -70.69 -28.03 64.46 Favored 'General case' 0 CA--C 1.542 0.663 0 C-N-CA 122.569 0.347 . . . . 73.450000000000003 111.021 178.677 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . 0.598 ' HA ' HD22 ' A' ' 21' ' ' LEU . 10.1 mp -66.9 -47.55 71.43 Favored 'General case' 0 N--CA 1.493 1.69 0 C-N-CA 122.799 0.439 . . . . 73.340000000000003 109.913 169.724 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 80.2 mt -61.74 -33.62 74.37 Favored 'General case' 0 N--CA 1.481 1.118 0 O-C-N 124.282 0.989 . . . . 75.439999999999998 111.677 -178.777 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 35' ' ' GLN . . . . . 0.4 HE21 ' N ' ' A' ' 35' ' ' GLN . 0.0 OUTLIER -70.8 -55.9 7.54 Favored 'General case' 0 N--CA 1.477 0.905 0 C-N-CA 123.716 0.806 . . . . 75.409999999999997 109.58 175.396 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 36' ' ' GLN . . . . . 0.421 ' HB2' HD23 ' A' ' 21' ' ' LEU . 89.6 mm-40 -66.03 -12.69 56.99 Favored 'General case' 0 N--CA 1.482 1.128 0 O-C-N 123.84 0.713 . . . . 70.319999999999993 112.742 -176.873 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . 0.522 ' O ' ' HG ' ' A' ' 41' ' ' LEU . 43.3 tt0 -47.87 -40.41 21.47 Favored 'General case' 0 C--O 1.211 -0.95 0 C-N-CA 123.941 0.896 . . . . 74.530000000000001 111.656 172.87 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 43.1 t -58.22 -48.89 83.53 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.521 0 C-N-CA 123.052 0.541 . . . . 74.209999999999994 110.935 178.838 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 23.3 m -66.24 -38.96 89.15 Favored 'General case' 0 N--CA 1.475 0.786 0 CA-C-N 115.139 -0.937 . . . . 73.430000000000007 111.167 178.558 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 36.3 t80 -57.28 -52.05 66.9 Favored 'General case' 0 C--N 1.352 0.69 0 C-N-CA 124.887 1.275 . . . . 75.420000000000002 109.164 178.749 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . 0.522 ' HG ' ' O ' ' A' ' 37' ' ' GLU . 17.2 mt -59.38 -58.29 9.26 Favored 'General case' 0 C--N 1.363 1.193 0 O-C-N 124.702 1.251 . . . . 73.310000000000002 109.629 -178.601 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 48.1 tt0 -52.21 -49.61 63.58 Favored 'General case' 0 N--CA 1.476 0.828 0 O-C-N 123.994 0.809 . . . . 73.0 111.758 -174.094 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 36.9 m -64.85 -54.36 32.23 Favored 'General case' 0 CA--C 1.549 0.917 0 CA-C-N 115.991 -0.55 . . . . 73.010000000000005 111.859 -177.584 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 44' ' ' ILE . . . . . 0.508 HD13 HD12 ' A' ' 102' ' ' LEU . 14.1 tt -65.42 -36.23 77.2 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.105 0 C-N-CA 123.162 0.585 . . . . 64.310000000000002 111.238 -173.328 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 12.5 mm-40 -64.57 -47.36 79.02 Favored 'General case' 0 C--N 1.348 0.508 0 C-N-CA 123.773 0.829 . . . . 73.219999999999999 110.058 174.898 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 87.1 m -62.87 -26.1 68.61 Favored 'General case' 0 N--CA 1.477 0.902 0 O-C-N 123.443 0.464 . . . . 70.150000000000006 111.593 -179.314 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 47' ' ' VAL . . . . . . . . . . . . . 63.0 t -73.64 -54.05 16.29 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.008 0 O-C-N 122.173 -0.329 . . . . 72.5 110.906 172.831 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 48' ' ' MET . . . . . . . . . . . . . 70.4 mtm -72.22 -24.17 61.35 Favored 'General case' 0 N--CA 1.487 1.389 0 C-N-CA 123.104 0.562 . . . . 74.319999999999993 112.215 -171.324 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 32.7 mm-40 -82.34 -24.5 34.52 Favored 'General case' 0 N--CA 1.48 1.043 0 C-N-CA 123.96 0.904 . . . . 73.120000000000005 111.329 176.607 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 13.7 mptt -97.22 165.27 12.12 Favored 'General case' 0 N--CA 1.479 1.004 0 CA-C-O 121.802 0.81 . . . . 70.340000000000003 111.393 -175.663 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 8.5 tt0 -90.76 133.34 35.25 Favored 'General case' 0 C--O 1.24 0.594 0 CA-C-N 113.968 -1.469 . . . . 72.349999999999994 110.529 -172.81 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 89.9 m -78.26 127.94 79.67 Favored Pre-proline 0 CA--C 1.553 1.07 0 N-CA-C 108.755 -0.831 . . . . 71.099999999999994 108.755 169.754 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 57.0 Cg_endo -68.49 156.8 64.34 Favored 'Trans proline' 0 CA--C 1.562 1.901 0 C-N-CA 122.907 2.405 . . . . 65.310000000000002 112.574 176.996 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 7.6 Cg_exo -74.43 -50.06 0.16 Allowed 'Trans proline' 0 C--N 1.374 1.902 0 C-N-CA 122.798 2.332 . . . . 65.310000000000002 112.153 173.607 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . -80.86 72.64 2.68 Favored Glycine 0 C--N 1.349 1.274 0 CA-C-N 115.447 -0.797 . . . . 75.209999999999994 112.389 -177.141 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 56' ' ' ILE . . . . . 0.405 ' O ' HD11 ' A' ' 60' ' ' ILE . 70.0 mt -83.66 -85.01 0.08 OUTLIER 'Isoleucine or valine' 0 CA--C 1.559 1.291 0 N-CA-C 108.574 -0.898 . . . . 74.109999999999999 108.574 178.507 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 57' ' ' THR . . . . . 0.407 ' HG1' HD11 ' A' ' 60' ' ' ILE . 36.8 p 138.18 163.32 0.0 OUTLIER 'General case' 0 N--CA 1.495 1.794 0 C-N-CA 131.201 3.8 . . . . 73.510000000000005 107.165 167.342 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 46.0 tpt85 -60.28 -52.28 65.97 Favored 'General case' 0 CA--C 1.549 0.934 0 C-N-CA 123.82 0.848 . . . . 65.329999999999998 111.996 -174.084 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 43.4 m -63.95 -36.61 84.52 Favored 'General case' 0 N--CA 1.476 0.85 0 C-N-CA 123.426 0.691 . . . . 63.32 112.07 -178.646 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 60' ' ' ILE . . . . . 0.407 HD11 ' HG1' ' A' ' 57' ' ' THR . 78.1 mt -71.15 -35.17 57.48 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.645 0 CA-C-N 116.339 -0.392 . . . . 74.420000000000002 110.06 178.038 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 57.7 tt0 -60.88 -38.77 86.78 Favored 'General case' 0 CA--C 1.543 0.693 0 C-N-CA 123.123 0.569 . . . . 74.200000000000003 109.899 175.05 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 44.4 m-20 -65.35 -42.69 92.56 Favored 'General case' 0 N--CA 1.479 0.987 0 CA-C-N 115.909 -0.587 . . . . 73.430000000000007 112.045 175.088 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 63' ' ' MET . . . . . . . . . . . . . 71.3 mtm -68.18 -49.36 61.4 Favored 'General case' 0 N--CA 1.484 1.259 0 C-N-CA 122.566 0.346 . . . . 73.129999999999995 111.6 -178.933 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 64' ' ' VAL . . . . . 0.442 ' O ' HG13 ' A' ' 68' ' ' ILE . 70.8 t -60.14 -56.91 14.37 Favored 'Isoleucine or valine' 0 C--N 1.35 0.607 0 C-N-CA 123.879 0.872 . . . . 63.109999999999999 110.675 177.518 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -62.38 -28.2 69.61 Favored 'General case' 0 N--CA 1.489 1.498 0 O-C-N 123.405 0.44 . . . . 65.230000000000004 111.282 -179.848 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -63.65 -42.73 98.64 Favored Glycine 0 C--N 1.347 1.154 0 N-CA-C 111.753 -0.539 . . . . 64.140000000000001 111.753 172.608 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 67' ' ' TYR . . . . . 0.492 ' CE2' ' HG2' ' A' ' 12' ' ' GLN . 17.1 m-30 -79.59 -27.24 41.12 Favored 'General case' 0 N--CA 1.48 1.051 0 N-CA-C 112.855 0.687 . . . . 74.030000000000001 112.855 -179.621 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 68' ' ' ILE . . . . . 0.511 ' O ' ' HG ' ' A' ' 72' ' ' LEU . 38.9 mt -66.29 -49.59 74.63 Favored 'Isoleucine or valine' 0 C--N 1.35 0.592 0 N-CA-C 107.405 -1.331 . . . . 74.420000000000002 107.405 171.581 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 69' ' ' LYS . . . . . 0.648 ' HB2' ' HE2' ' A' ' 106' ' ' TYR . 0.3 OUTLIER -54.78 -46.75 74.46 Favored 'General case' 0 C--N 1.356 0.872 0 O-C-N 123.989 0.805 . . . . 74.299999999999997 110.619 177.66 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 62.0 tt0 -57.43 -51.11 70.75 Favored 'General case' 0 C--N 1.349 0.569 0 O-C-N 124.926 1.391 . . . . 71.340000000000003 110.506 -178.843 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 71' ' ' THR . . . . . 0.571 ' HB ' ' HA ' ' A' ' 15' ' ' ALA . 12.8 t -72.57 -19.67 61.45 Favored 'General case' 0 C--O 1.215 -0.757 0 CA-C-O 118.566 -0.731 . . . . 73.109999999999999 111.607 -179.199 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 72' ' ' LEU . . . . . 0.711 HD22 ' HB3' ' A' ' 102' ' ' LEU . 17.0 mt -79.74 -28.78 40.44 Favored 'General case' 0 N--CA 1.49 1.566 0 C-N-CA 122.945 0.498 . . . . 73.219999999999999 111.499 174.559 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 29.8 m-20 -65.53 -53.24 45.07 Favored 'General case' 0 N--CA 1.473 0.719 0 N-CA-C 107.882 -1.155 . . . . 72.319999999999993 107.882 170.519 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 35.0 m-20 -61.54 -33.53 73.99 Favored 'General case' 0 N--CA 1.477 0.879 0 CA-C-N 114.666 -1.152 . . . . 74.439999999999998 110.961 179.553 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . 0.451 ' O ' ' HG2' ' A' ' 79' ' ' LYS . 27.2 tp10 -61.84 -60.63 3.36 Favored 'General case' 0 N--CA 1.474 0.737 0 C-N-CA 124.238 1.015 . . . . 73.030000000000001 109.455 176.876 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 10.3 tt0 -63.5 -36.34 83.45 Favored 'General case' 0 CA--C 1.545 0.787 0 CA-C-N 116.108 -0.496 . . . . 72.230000000000004 111.862 -175.715 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . 0.418 ' O ' ' HB2' ' A' ' 81' ' ' LEU . 93.1 mt -68.22 -54.42 17.92 Favored 'General case' 0 N--CA 1.471 0.594 0 C-N-CA 122.84 0.456 . . . . 72.239999999999995 110.537 -179.281 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . 0.699 HD23 ' HA ' ' A' ' 22' ' ' LEU . 51.0 mt -62.24 -52.66 62.84 Favored 'General case' 0 N--CA 1.484 1.248 0 C-N-CA 122.979 0.512 . . . . 74.129999999999995 112.08 -178.532 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 79' ' ' LYS . . . . . 0.451 ' HG2' ' O ' ' A' ' 75' ' ' GLU . 26.3 mmtp -73.87 -28.08 61.39 Favored 'General case' 0 N--CA 1.476 0.86 0 O-C-N 123.716 0.635 . . . . 73.310000000000002 110.805 -173.81 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -75.42 -24.19 71.38 Favored Glycine 0 C--N 1.344 1.019 0 CA-C-N 116.02 -0.536 . . . . 64.310000000000002 112.287 171.285 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . 0.418 ' HB2' ' O ' ' A' ' 77' ' ' LEU . 5.1 tt -80.51 -41.96 23.33 Favored 'General case' 0 N--CA 1.475 0.791 0 C-N-CA 123.662 0.785 . . . . 71.409999999999997 109.829 178.087 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 96.4 mt -70.47 -65.55 0.72 Allowed 'General case' 0 N--CA 1.475 0.799 0 N-CA-C 109.754 -0.461 . . . . 71.209999999999994 109.754 -173.131 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 66.9 mm-40 -129.75 -74.21 0.55 Allowed 'General case' 0 N--CA 1.473 0.687 0 N-CA-C 108.518 -0.919 . . . . 74.310000000000002 108.518 179.3 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 21.7 tp60 174.88 105.83 0.02 OUTLIER 'General case' 0 N--CA 1.479 1.014 0 C-N-CA 124.461 1.104 . . . . 75.209999999999994 108.977 -177.354 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 85' ' ' ARG . . . . . 0.557 ' HG3' ' H ' ' A' ' 86' ' ' LEU . 4.3 ptp180 34.38 -77.05 0.0 OUTLIER 'General case' 0 N--CA 1.499 2.025 0 C-N-CA 126.898 2.079 . . . . 71.299999999999997 114.792 -179.859 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 86' ' ' LEU . . . . . 0.557 ' H ' ' HG3' ' A' ' 85' ' ' ARG . 63.4 mt -73.49 101.57 3.57 Favored 'General case' 0 N--CA 1.477 0.887 0 CA-C-N 119.096 0.862 . . . . 75.099999999999994 109.461 175.969 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 40.2 p-10 -170.05 -151.41 0.08 Allowed 'General case' 0 N--CA 1.486 1.359 0 N-CA-C 112.373 0.509 . . . . 51.329999999999998 112.373 -173.963 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 43.3 mt-10 -49.86 160.93 0.28 Allowed 'General case' 0 N--CA 1.481 1.112 0 C-N-CA 126.282 1.833 . . . . 73.099999999999994 114.182 178.153 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . 0.433 ' HB2' ' HE2' ' A' ' 79' ' ' LYS . 65.4 mt 63.95 25.14 13.84 Favored 'General case' 0 N--CA 1.48 1.047 0 C-N-CA 125.107 1.363 . . . . 74.319999999999993 110.764 -176.868 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 45.7 t -94.07 -92.76 0.18 Allowed 'General case' 0 C--N 1.349 0.585 0 N-CA-C 107.918 -1.141 . . . . 65.099999999999994 107.918 175.644 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 35.8 p 43.79 25.28 0.09 Allowed 'General case' 0 N--CA 1.488 1.443 0 C-N-CA 124.88 1.272 . . . . 72.109999999999999 113.761 -175.552 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 80.3 mt -89.23 -72.67 0.54 Allowed 'General case' 0 C--N 1.355 0.842 0 N-CA-C 107.946 -1.131 . . . . 72.25 107.946 178.594 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 93' ' ' ILE . . . . . 0.438 HG23 ' HG2' ' A' ' 95' ' ' GLN . 43.8 mt -128.24 138.02 55.82 Favored 'Isoleucine or valine' 0 C--O 1.241 0.625 0 N-CA-C 107.53 -1.285 . . . . 74.519999999999996 107.53 177.383 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -63.08 -30.59 77.94 Favored Glycine 0 C--N 1.353 1.481 0 O-C-N 124.114 0.884 . . . . 64.140000000000001 114.362 -171.671 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 95' ' ' GLN . . . . . 0.438 ' HG2' HG23 ' A' ' 93' ' ' ILE . 30.0 pt20 -73.12 -0.29 13.68 Favored 'General case' 0 N--CA 1.486 1.343 0 C-N-CA 123.338 0.655 . . . . 74.450000000000003 112.407 178.437 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 20.9 m 66.12 30.27 9.48 Favored 'General case' 0 C--N 1.358 0.96 0 C-N-CA 124.987 1.315 . . . . 75.239999999999995 111.978 171.503 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 14.9 t -74.6 14.11 0.52 Allowed 'General case' 0 N--CA 1.481 1.106 0 C-N-CA 123.679 0.792 . . . . 72.239999999999995 112.923 -176.265 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 98' ' ' ARG . . . . . 0.406 ' NH1' ' HZ1' ' A' ' 79' ' ' LYS . 60.6 ttp180 -53.57 -53.09 56.7 Favored 'General case' 0 N--CA 1.476 0.857 0 C-N-CA 124.377 1.071 . . . . 73.329999999999998 111.622 179.145 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 9.7 mm100 -61.94 -47.0 86.87 Favored 'General case' 0 N--CA 1.479 0.997 0 CA-C-O 121.488 0.661 . . . . 73.439999999999998 109.63 -176.76 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 38.9 ttmt -62.36 -40.53 96.73 Favored 'General case' 0 CA--C 1.54 0.584 0 CA-C-N 113.781 -1.554 . . . . 75.299999999999997 111.729 -178.385 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 38.7 t -71.95 -44.37 63.7 Favored 'General case' 0 N--CA 1.474 0.737 0 C-N-CA 123.753 0.821 . . . . 73.329999999999998 110.942 -172.464 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 102' ' ' LEU . . . . . 0.711 ' HB3' HD22 ' A' ' 72' ' ' LEU . 8.9 mp -72.08 -37.57 69.57 Favored 'General case' 0 CA--C 1.546 0.819 0 CA-C-N 115.314 -0.857 . . . . 75.140000000000001 110.682 -179.662 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 9.8 t30 -68.82 -31.9 71.21 Favored 'General case' 0 N--CA 1.48 1.051 0 CA-C-N 115.698 -0.683 . . . . 74.519999999999996 110.503 176.176 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 49.0 t30 -74.47 -36.11 63.3 Favored 'General case' 0 N--CA 1.482 1.173 0 C-N-CA 123.596 0.759 . . . . 75.230000000000004 110.017 176.947 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -61.21 -49.59 76.52 Favored 'General case' 0 N--CA 1.475 0.794 0 C-N-CA 123.057 0.543 . . . . 61.509999999999998 110.134 177.4 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 106' ' ' TYR . . . . . 0.648 ' HE2' ' HB2' ' A' ' 69' ' ' LYS . 1.7 t80 -63.85 -48.88 74.97 Favored 'General case' 0 C--N 1.354 0.795 0 O-C-N 123.993 0.808 . . . . 73.030000000000001 109.472 175.62 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -56.93 -38.3 83.91 Favored Glycine 0 C--N 1.35 1.31 0 O-C-N 124.017 0.823 . . . . 74.239999999999995 113.772 -173.691 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 108' ' ' ARG . . . . . 0.513 ' HB3' ' HE2' ' A' ' 112' ' ' MET . 70.8 mtm180 -75.63 -42.82 50.61 Favored 'General case' 0 C--O 1.239 0.545 0 C-N-CA 123.386 0.674 . . . . 75.030000000000001 110.533 176.767 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 109' ' ' LEU . . . . . 0.406 ' HA ' ' N ' ' A' ' 114' ' ' LEU . 32.7 tp -61.82 -28.27 69.35 Favored 'General case' 0 N--CA 1.491 1.578 0 C-N-CA 123.141 0.576 . . . . 75.430000000000007 110.894 177.251 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 39.5 t -83.08 -38.62 22.26 Favored 'General case' 0 N--CA 1.452 -0.363 0 CA-C-N 114.711 -1.131 . . . . 63.219999999999999 109.449 178.144 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . -79.09 -64.99 1.85 Allowed Glycine 0 C--N 1.356 1.643 0 CA-C-O 119.214 -0.77 . . . . 74.010000000000005 113.558 -173.228 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 112' ' ' MET . . . . . 0.681 ' HA ' ' HA2' ' A' ' 120' ' ' GLY . 0.0 OUTLIER -99.32 -66.53 0.9 Allowed 'General case' 0 N--CA 1.485 1.3 0 CA-C-N 118.793 1.297 . . . . 74.540000000000006 109.525 172.637 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER 170.43 27.31 0.0 OUTLIER 'General case' 0 CA--C 1.573 1.831 0 O-C-N 124.712 1.258 . . . . 74.019999999999996 109.626 -171.633 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 114' ' ' LEU . . . . . 0.406 ' N ' ' HA ' ' A' ' 109' ' ' LEU . 0.9 OUTLIER 76.86 -22.18 0.29 Allowed 'General case' 0 N--CA 1.501 2.109 0 C-N-CA 125.92 1.688 . . . . 72.040000000000006 111.368 -178.324 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 115' ' ' VAL . . . . . . . . . . . . . 33.9 m -124.48 144.51 46.28 Favored Pre-proline 0 C--O 1.247 0.923 0 C-N-CA 124.33 1.052 . . . . 64.230000000000004 109.31 -174.866 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 17.8 Cg_exo -68.07 167.29 22.18 Favored 'Trans proline' 0 C--N 1.367 1.545 0 C-N-CA 122.53 2.153 . . . . 73.439999999999998 111.606 173.506 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 16.2 m-20 65.36 27.52 11.93 Favored 'General case' 0 N--CA 1.486 1.329 0 C-N-CA 124.31 1.044 . . . . 72.150000000000006 110.967 178.806 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -126.3 137.67 30.75 Favored Pre-proline 0 N--CA 1.473 0.705 0 C-N-CA 124.138 0.975 . . . . 65.329999999999998 109.617 -178.508 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 119' ' ' PRO . . . . . . . . . . . . . 38.2 Cg_endo -64.2 132.8 35.32 Favored 'Trans proline' 0 C--N 1.377 2.067 0 C-N-CA 122.58 2.187 . . . . 75.420000000000002 111.512 -175.252 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 120' ' ' GLY . . . . . 0.681 ' HA2' ' HA ' ' A' ' 112' ' ' MET . . . -59.96 123.59 33.57 Favored Glycine 0 C--N 1.349 1.272 0 O-C-N 124.284 0.99 . . . . 75.230000000000004 114.057 -171.077 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . -76.46 175.11 9.5 Favored 'General case' 0 N--CA 1.473 0.695 0 C-N-CA 123.809 0.844 . . . . 52.200000000000003 111.607 178.181 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 122' ' ' SER . . . . . . . . . . . . . 20.3 m . . . . . 0 C--O 1.253 1.262 0 CA-C-O 118.547 -0.739 . . . . 64.230000000000004 109.482 -178.904 . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 25.9 ttt . . . . . 0 CA--C 1.555 1.162 0 CA-C-O 119.621 -0.228 . . . . 73.5 110.906 . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 4.6 p -53.85 -35.33 61.39 Favored 'General case' 0 N--CA 1.489 1.477 0 C-N-CA 123.501 0.72 . . . . 70.439999999999998 112.471 -178.957 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 63.5 p -62.22 -48.07 81.62 Favored 'General case' 0 N--CA 1.48 1.069 0 C-N-CA 123.701 0.8 . . . . 75.219999999999999 110.555 176.524 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 22.1 m -66.26 -37.63 85.93 Favored 'General case' 0 CA--C 1.54 0.594 0 CA-C-N 115.023 -0.99 . . . . 75.129999999999995 111.194 -179.876 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 78.1 t -65.75 -44.63 93.11 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.936 0 C-N-CA 123.192 0.597 . . . . 75.230000000000004 110.433 -179.175 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 11.7 mm-40 -61.54 -41.57 97.54 Favored 'General case' 0 C--N 1.353 0.761 0 O-C-N 123.581 0.551 . . . . 74.430000000000007 110.703 173.782 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 44.6 t80 -63.05 -47.85 81.18 Favored 'General case' 0 N--CA 1.481 1.101 0 C-N-CA 123.852 0.861 . . . . 75.439999999999998 111.439 -176.958 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . 0.417 ' O ' ' HG3' ' A' ' 12' ' ' GLN . 73.1 mt -65.0 -41.54 92.37 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.033 0 C-N-CA 123.682 0.793 . . . . 75.25 109.541 177.472 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 4.0 t-20 -65.76 -29.15 69.62 Favored 'General case' 0 N--CA 1.479 1.022 0 C-N-CA 123.756 0.822 . . . . 72.510000000000005 111.104 179.23 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . 0.729 ' HB3' HG21 ' A' ' 47' ' ' VAL . 57.6 mtt180 -78.55 -30.64 46.99 Favored 'General case' 0 N--CA 1.469 0.477 0 C-N-CA 123.689 0.796 . . . . 74.129999999999995 110.381 177.431 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 11' ' ' TRP . . . . . 0.492 ' HH2' ' HG ' ' A' ' 102' ' ' LEU . 76.8 m95 -74.98 -27.57 60.21 Favored 'General case' 0 N--CA 1.477 0.902 0 CA-C-O 119.492 -0.29 . . . . 61.130000000000003 110.945 170.381 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . 0.417 ' HG3' ' O ' ' A' ' 8' ' ' ILE . 51.5 mt-30 -64.49 -44.18 91.8 Favored 'General case' 0 C--O 1.212 -0.896 0 N-CA-C 107.744 -1.206 . . . . 64.140000000000001 107.744 168.959 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 30.9 tpt180 -59.04 -50.98 72.02 Favored 'General case' 0 CA--C 1.547 0.862 0 O-C-N 124.087 0.867 . . . . 74.349999999999994 110.689 -177.222 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 56.4 mt -63.97 -49.53 81.26 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.313 0 C-N-CA 122.666 0.387 . . . . 72.239999999999995 110.335 179.187 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . 0.577 ' HA ' ' HB ' ' A' ' 71' ' ' THR . . . -59.06 -43.51 91.72 Favored 'General case' 0 N--CA 1.485 1.31 0 C-N-CA 123.864 0.865 . . . . 71.019999999999996 112.115 -176.373 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 95.1 mt -77.41 -39.6 46.49 Favored 'General case' 0 N--CA 1.481 1.082 0 CA-C-N 115.248 -0.887 . . . . 75.340000000000003 110.658 -174.848 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . 0.494 ' O ' ' HG ' ' A' ' 21' ' ' LEU . 53.9 mt -64.45 -47.04 80.55 Favored 'General case' 0 N--CA 1.483 1.186 0 O-C-N 123.302 0.377 . . . . 75.230000000000004 110.511 179.718 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 18' ' ' SER . . . . . 0.416 ' HB3' ' CE1' ' A' ' 40' ' ' TYR . 71.7 p -68.65 -35.5 77.34 Favored 'General case' 0 N--CA 1.477 0.882 0 O-C-N 123.768 0.667 . . . . 71.510000000000005 111.143 178.592 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 19' ' ' GLN . . . . . 0.488 ' O ' ' HG2' ' A' ' 23' ' ' GLU . 6.3 tp-100 -62.41 -41.17 98.48 Favored 'General case' 0 C--N 1.357 0.913 0 O-C-N 123.586 0.554 . . . . 74.409999999999997 109.878 174.702 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 68.6 m -63.37 -49.19 74.81 Favored 'General case' 0 C--N 1.352 0.702 0 O-C-N 123.818 0.699 . . . . 71.340000000000003 109.288 175.564 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . 0.494 ' HG ' ' O ' ' A' ' 17' ' ' LEU . 83.8 mt -57.22 -31.53 65.59 Favored 'General case' 0 N--CA 1.479 1.016 0 C-N-CA 123.811 0.844 . . . . 72.340000000000003 110.665 179.995 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . 0.553 ' HA ' HD21 ' A' ' 78' ' ' LEU . 37.9 tp -73.33 -52.45 13.84 Favored 'General case' 0 CA--C 1.543 0.674 0 O-C-N 123.862 0.727 . . . . 75.25 110.727 178.491 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . 0.568 ' HB3' ' NH1' ' A' ' 27' ' ' ARG . 46.5 mm-40 -51.79 -55.2 21.21 Favored 'General case' 0 N--CA 1.491 1.586 0 CA-C-O 122.159 0.981 . . . . 72.420000000000002 110.454 177.734 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . 0.422 HD23 HD12 ' A' ' 32' ' ' LEU . 70.4 mt -56.36 -51.36 68.59 Favored 'General case' 0 CA--C 1.545 0.77 0 CA-C-N 112.878 -1.965 . . . . 74.430000000000007 110.425 179.79 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . 0.461 ' HB3' HD23 ' A' ' 33' ' ' LEU . . . -60.91 -41.52 96.26 Favored 'General case' 0 N--CA 1.49 1.527 0 C-N-CA 123.396 0.679 . . . . 75.219999999999999 112.68 -175.962 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 94.6 mt-30 -64.51 -38.22 90.27 Favored 'General case' 0 N--CA 1.478 0.943 0 C-N-CA 123.537 0.735 . . . . 74.430000000000007 110.264 179.265 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . 0.568 ' NH1' ' HB3' ' A' ' 23' ' ' GLU . 58.0 mtt180 -81.65 -15.66 53.85 Favored 'General case' 0 N--CA 1.488 1.453 0 N-CA-C 112.306 0.484 . . . . 73.049999999999997 112.306 175.517 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 88.79 24.93 31.21 Favored Glycine 0 C--N 1.349 1.305 0 N-CA-C 114.527 0.571 . . . . 74.549999999999997 114.527 177.417 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 49.7 mm-40 -84.33 60.55 6.05 Favored 'General case' 0 N--CA 1.477 0.895 0 C-N-CA 124.239 1.016 . . . . 65.409999999999997 110.699 175.491 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 30' ' ' TRP . . . . . 0.46 ' O ' ' HG ' ' A' ' 34' ' ' LEU . 88.5 m95 -66.17 -30.57 71.07 Favored 'General case' 0 N--CA 1.477 0.88 0 C-N-CA 123.911 0.884 . . . . 74.540000000000006 112.575 -171.952 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 4.8 m-20 -61.18 -40.64 94.65 Favored 'General case' 0 N--CA 1.483 1.197 0 C-N-CA 123.332 0.653 . . . . 74.409999999999997 110.563 175.642 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . 0.422 HD12 HD23 ' A' ' 24' ' ' LEU . 64.2 mt -71.6 -26.54 62.63 Favored 'General case' 0 CA--C 1.543 0.683 0 CA-C-N 115.211 -0.904 . . . . 72.319999999999993 110.396 179.842 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . 0.461 HD23 ' HB3' ' A' ' 25' ' ' ALA . 7.6 mp -66.29 -44.59 83.11 Favored 'General case' 0 N--CA 1.489 1.492 0 N-CA-C 110.476 -0.194 . . . . 73.430000000000007 110.476 169.039 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . 0.46 ' HG ' ' O ' ' A' ' 30' ' ' TRP . 83.0 mt -63.63 -34.53 78.04 Favored 'General case' 0 N--CA 1.48 1.058 0 O-C-N 123.896 0.747 . . . . 75.340000000000003 111.124 -178.548 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 96.8 mt-30 -65.71 -58.04 6.62 Favored 'General case' 0 N--CA 1.483 1.186 0 CA-C-O 121.168 0.508 . . . . 74.319999999999993 110.033 174.687 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 36' ' ' GLN . . . . . 0.402 ' HB2' HD22 ' A' ' 21' ' ' LEU . 80.1 mm-40 -73.82 -10.39 59.62 Favored 'General case' 0 N--CA 1.477 0.896 0 CA-C-N 114.885 -1.052 . . . . 74.299999999999997 112.654 -174.207 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 37.1 tt0 -53.38 -52.31 59.7 Favored 'General case' 0 N--CA 1.475 0.79 0 C-N-CA 124.591 1.156 . . . . 73.439999999999998 110.692 175.224 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 46.8 t -58.7 -43.97 88.89 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.141 0 O-C-N 123.76 0.662 . . . . 75.230000000000004 110.179 -179.18 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 42.7 m -56.95 -53.23 60.4 Favored 'General case' 0 CA--C 1.546 0.809 0 CA-C-N 115.403 -0.817 . . . . 74.200000000000003 111.631 176.211 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 40' ' ' TYR . . . . . 0.416 ' CE1' ' HB3' ' A' ' 18' ' ' SER . 58.2 t80 -63.0 -49.62 73.94 Favored 'General case' 0 N--CA 1.474 0.758 0 C-N-CA 123.797 0.839 . . . . 71.549999999999997 111.159 -173.502 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . 0.671 ' HB3' HD23 ' A' ' 92' ' ' LEU . 72.2 mt -60.23 -48.34 82.15 Favored 'General case' 0 C--O 1.257 1.486 0 C-N-CA 124.48 1.112 . . . . 73.450000000000003 111.285 -178.022 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 49.8 tt0 -61.07 -44.03 98.0 Favored 'General case' 0 N--CA 1.475 0.786 0 CA-C-N 115.557 -0.747 . . . . 73.150000000000006 110.43 -179.85 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 43' ' ' SER . . . . . 0.508 ' O ' HG23 ' A' ' 47' ' ' VAL . 69.4 m -60.94 -57.7 11.56 Favored 'General case' 0 C--N 1.354 0.767 0 CA-C-N 115.378 -0.828 . . . . 73.420000000000002 111.442 -178.511 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 44' ' ' ILE . . . . . 0.677 HG12 ' HE1' ' A' ' 48' ' ' MET . 3.9 tt -58.38 -41.22 80.84 Favored 'Isoleucine or valine' 0 C--O 1.251 1.156 0 C-N-CA 123.266 0.626 . . . . 72.150000000000006 111.375 -174.682 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 40.9 mm-40 -59.19 -49.8 76.47 Favored 'General case' 0 C--N 1.367 1.333 0 N-CA-C 111.542 0.201 . . . . 75.109999999999999 111.542 173.442 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 46' ' ' THR . . . . . 0.48 ' O ' ' HD3' ' A' ' 50' ' ' LYS . 97.3 m -55.72 -41.78 74.36 Favored 'General case' 0 N--CA 1.482 1.155 0 O-C-N 123.958 0.786 . . . . 70.340000000000003 111.617 -178.292 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 47' ' ' VAL . . . . . 0.729 HG21 ' HB3' ' A' ' 10' ' ' ARG . 26.2 t -70.05 -37.71 73.04 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.997 0 C-N-CA 122.884 0.474 . . . . 73.329999999999998 110.623 -177.94 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 48' ' ' MET . . . . . 0.677 ' HE1' HG12 ' A' ' 44' ' ' ILE . 79.1 mtm -72.22 -19.93 61.64 Favored 'General case' 0 N--CA 1.481 1.113 0 CA-C-N 116.183 -0.462 . . . . 75.120000000000005 111.76 175.375 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 48.2 mt-10 -83.02 -7.47 59.66 Favored 'General case' 0 N--CA 1.49 1.57 0 C-N-CA 123.285 0.634 . . . . 74.109999999999999 111.759 172.918 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . 0.48 ' HD3' ' O ' ' A' ' 46' ' ' THR . 12.7 mptt -95.44 132.0 40.98 Favored 'General case' 0 N--CA 1.482 1.169 0 C-N-CA 123.485 0.714 . . . . 75.329999999999998 110.235 177.691 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 34.2 tt0 -68.57 151.99 45.99 Favored 'General case' 0 C--O 1.247 0.923 0 C-N-CA 123.524 0.729 . . . . 74.5 109.389 172.787 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 20.0 m -59.69 118.85 35.3 Favored Pre-proline 0 CA--C 1.556 1.185 0 CA-C-O 118.744 -0.646 . . . . 73.319999999999993 109.792 173.471 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 53' ' ' PRO . . . . . 0.529 ' HD2' HD11 ' A' ' 56' ' ' ILE . 31.6 Cg_exo -62.72 153.62 71.1 Favored 'Trans proline' 0 C--N 1.377 2.075 0 C-N-CA 122.602 2.202 . . . . 60.539999999999999 112.79 177.844 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 22.7 Cg_exo -66.98 -47.98 2.14 Favored 'Trans proline' 0 C--N 1.373 1.861 0 C-N-CA 123.199 2.599 . . . . 73.349999999999994 112.506 177.591 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . -83.94 59.86 4.91 Favored Glycine 0 C--N 1.346 1.092 0 CA-C-N 115.966 -0.561 . . . . 65.129999999999995 114.07 -173.233 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 56' ' ' ILE . . . . . 0.529 HD11 ' HD2' ' A' ' 53' ' ' PRO . 56.1 mt -100.72 116.23 43.79 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.763 0 N-CA-C 108.133 -1.062 . . . . 63.130000000000003 108.133 169.971 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 71.6 p -101.73 -166.88 1.34 Allowed 'General case' 0 CA--C 1.545 0.763 0 C-N-CA 124.178 0.991 . . . . 73.310000000000002 109.523 177.634 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 16.6 tpt85 -61.25 -63.42 1.29 Allowed 'General case' 0 N--CA 1.474 0.773 0 C-N-CA 123.715 0.806 . . . . 75.109999999999999 111.017 -179.828 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 26.0 m -54.73 -38.0 66.6 Favored 'General case' 0 N--CA 1.482 1.142 0 C-N-CA 123.482 0.713 . . . . 62.020000000000003 111.778 -178.41 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 60' ' ' ILE . . . . . 0.4 HG21 HD13 ' A' ' 8' ' ' ILE . 80.2 mt -63.51 -46.72 94.35 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.703 0 C-N-CA 123.481 0.712 . . . . 73.349999999999994 110.655 178.079 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 61' ' ' GLN . . . . . 0.537 ' HG3' ' HG ' ' A' ' 109' ' ' LEU . 50.9 tt0 -61.77 -39.35 91.36 Favored 'General case' 0 N--CA 1.476 0.849 0 C-N-CA 123.073 0.549 . . . . 73.510000000000005 111.106 179.896 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 9.0 m-20 -69.15 -37.42 78.23 Favored 'General case' 0 N--CA 1.479 1.002 0 C-N-CA 123.175 0.59 . . . . 74.019999999999996 111.944 179.298 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 63' ' ' MET . . . . . . . . . . . . . 72.1 mtm -68.42 -49.79 57.46 Favored 'General case' 0 N--CA 1.48 1.029 0 C-N-CA 122.41 0.284 . . . . 74.049999999999997 110.564 177.477 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 64' ' ' VAL . . . . . 0.501 ' O ' HG13 ' A' ' 68' ' ' ILE . 60.6 t -60.49 -59.76 3.65 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.664 0 C-N-CA 123.873 0.869 . . . . 72.319999999999993 110.216 -179.87 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . 0.554 ' HB3' HD22 ' A' ' 109' ' ' LEU . . . -60.36 -38.56 84.23 Favored 'General case' 0 N--CA 1.483 1.179 0 O-C-N 123.635 0.584 . . . . 74.530000000000001 111.571 -179.24 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -58.59 -42.36 96.06 Favored Glycine 0 C--N 1.35 1.307 0 O-C-N 123.218 0.324 . . . . 70.030000000000001 112.457 175.961 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 12.3 m-85 -70.35 -36.26 74.08 Favored 'General case' 0 N--CA 1.473 0.702 0 C-N-CA 123.083 0.553 . . . . 72.120000000000005 111.681 177.007 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 68' ' ' ILE . . . . . 0.502 ' O ' ' HG ' ' A' ' 72' ' ' LEU . 65.0 mt -60.02 -56.61 16.31 Favored 'Isoleucine or valine' 0 C--N 1.361 1.072 0 N-CA-C 108.852 -0.796 . . . . 75.230000000000004 108.852 177.785 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 69' ' ' LYS . . . . . 0.487 ' HB2' ' CE2' ' A' ' 106' ' ' TYR . 28.3 tptp -53.69 -47.27 70.63 Favored 'General case' 0 C--N 1.354 0.771 0 O-C-N 124.283 0.989 . . . . 75.420000000000002 110.001 179.997 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 59.8 tt0 -58.93 -48.04 82.89 Favored 'General case' 0 C--N 1.35 0.603 0 O-C-N 124.653 1.221 . . . . 75.349999999999994 111.364 -176.292 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 71' ' ' THR . . . . . 0.577 ' HB ' ' HA ' ' A' ' 15' ' ' ALA . 10.5 t -76.99 -22.68 52.79 Favored 'General case' 0 N--CA 1.475 0.805 0 O-C-N 123.433 0.458 . . . . 74.209999999999994 111.234 -175.949 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 72' ' ' LEU . . . . . 0.502 ' HG ' ' O ' ' A' ' 68' ' ' ILE . 21.1 mt -74.08 -34.81 64.12 Favored 'General case' 0 N--CA 1.476 0.845 0 O-C-N 123.261 0.351 . . . . 73.400000000000006 110.261 173.756 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 73.4 m-20 -75.39 -38.44 59.94 Favored 'General case' 0 N--CA 1.473 0.679 0 O-C-N 124.092 0.87 . . . . 75.349999999999994 110.535 176.492 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 74' ' ' ASN . . . . . 0.41 ' O ' ' HG ' ' A' ' 78' ' ' LEU . 92.4 m-20 -60.25 -51.87 67.71 Favored 'General case' 0 N--CA 1.48 1.068 0 N-CA-C 109.112 -0.699 . . . . 75.299999999999997 109.112 176.819 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . 0.662 ' HG3' ' HZ3' ' A' ' 79' ' ' LYS . 5.4 tt0 -59.95 -42.83 94.9 Favored 'General case' 0 C--N 1.356 0.872 0 CA-C-N 115.518 -0.764 . . . . 75.230000000000004 110.869 176.031 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 7.8 tt0 -57.09 -43.84 82.6 Favored 'General case' 0 N--CA 1.486 1.337 0 C-N-CA 123.985 0.914 . . . . 72.150000000000006 111.415 -179.201 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 94.5 mt -70.6 -37.32 73.88 Favored 'General case' 0 CA--C 1.536 0.412 0 CA-C-N 115.112 -0.949 . . . . 64.310000000000002 110.814 -179.473 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . 0.553 HD21 ' HA ' ' A' ' 22' ' ' LEU . 72.2 mt -64.84 -42.21 95.11 Favored 'General case' 0 N--CA 1.481 1.106 0 O-C-N 123.699 0.625 . . . . 75.140000000000001 111.419 174.928 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 79' ' ' LYS . . . . . 0.662 ' HZ3' ' HG3' ' A' ' 75' ' ' GLU . 47.3 mmtm -74.24 -34.84 63.77 Favored 'General case' 0 N--CA 1.476 0.865 0 C-N-CA 123.139 0.576 . . . . 74.439999999999998 110.674 -176.148 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -70.71 -37.11 67.08 Favored Glycine 0 C--N 1.347 1.194 0 O-C-N 123.91 0.756 . . . . 72.109999999999999 111.672 175.828 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 6.7 tt -65.57 -56.83 10.15 Favored 'General case' 0 N--CA 1.481 1.109 0 C-N-CA 123.839 0.855 . . . . 71.530000000000001 108.881 177.373 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 82' ' ' LEU . . . . . 0.425 HD13 ' HG2' ' A' ' 88' ' ' GLU . 80.7 mt -66.36 -22.12 66.25 Favored 'General case' 0 CA--C 1.543 0.696 0 C-N-CA 124.248 1.019 . . . . 72.430000000000007 111.934 -178.44 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 25.9 mt-30 60.46 33.3 20.64 Favored 'General case' 0 N--CA 1.487 1.391 0 C-N-CA 124.516 1.127 . . . . 62.119999999999997 111.292 178.191 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 16.5 mm-40 -89.2 176.13 7.08 Favored 'General case' 0 N--CA 1.478 0.928 0 C-N-CA 123.42 0.688 . . . . 74.120000000000005 111.29 -176.671 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 85' ' ' ARG . . . . . . . . . . . . . 20.3 mmt180 -116.51 38.77 3.33 Favored 'General case' 0 N--CA 1.481 1.077 0 C-N-CA 124.595 1.158 . . . . 72.349999999999994 109.006 178.429 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 56.8 mt 67.35 89.56 0.1 Allowed 'General case' 0 C--N 1.361 1.069 0 C-N-CA 124.959 1.304 . . . . 74.439999999999998 110.607 -178.003 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 22.9 t70 -160.0 -59.43 0.06 Allowed 'General case' 0 CA--C 1.539 0.524 0 CA-C-N 115.089 -0.959 . . . . 72.239999999999995 109.784 -179.644 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 88' ' ' GLU . . . . . 0.425 ' HG2' HD13 ' A' ' 82' ' ' LEU . 7.4 tp10 -48.46 -53.49 17.7 Favored 'General case' 0 N--CA 1.48 1.07 0 O-C-N 124.855 1.347 . . . . 73.530000000000001 112.612 -173.053 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 81.8 mt -124.65 52.39 1.54 Allowed 'General case' 0 N--CA 1.477 0.905 0 N-CA-C 108.352 -0.981 . . . . 64.239999999999995 108.352 177.794 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 29.9 t -150.4 17.83 0.83 Allowed 'General case' 0 N--CA 1.478 0.958 0 C-N-CA 123.788 0.835 . . . . 72.120000000000005 110.486 -176.089 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 24.2 m -75.87 77.4 2.78 Favored 'General case' 0 C--N 1.352 0.709 0 C-N-CA 124.369 1.068 . . . . 75.109999999999999 111.256 -175.737 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 92' ' ' LEU . . . . . 0.671 HD23 ' HB3' ' A' ' 41' ' ' LEU . 89.7 mt -141.12 -73.68 0.33 Allowed 'General case' 0 N--CA 1.473 0.681 0 C-N-CA 125.094 1.358 . . . . 73.530000000000001 108.493 -178.655 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 38.3 mt -112.72 -20.32 6.28 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.872 0 C-N-CA 124.852 1.261 . . . . 74.099999999999994 108.449 175.434 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 102.35 -62.76 0.48 Allowed Glycine 0 C--N 1.353 1.473 0 CA-C-N 115.962 -0.563 . . . . 72.109999999999999 111.915 173.972 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 9.9 pt20 -77.25 -171.81 2.2 Favored 'General case' 0 N--CA 1.482 1.165 0 C-N-CA 123.255 0.622 . . . . 61.520000000000003 111.935 -176.942 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 71.7 p -74.81 11.67 1.01 Allowed 'General case' 0 N--CA 1.472 0.647 0 CA-C-O 117.847 -1.073 . . . . 74.099999999999994 113.797 -174.944 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 96.0 m -48.58 -42.19 33.0 Favored 'General case' 0 N--CA 1.483 1.199 0 C-N-CA 124.173 0.989 . . . . 74.230000000000004 112.397 177.528 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 98' ' ' ARG . . . . . 0.548 ' HD2' HD12 ' A' ' 92' ' ' LEU . 18.5 mtm105 -68.11 -53.65 23.81 Favored 'General case' 0 N--CA 1.475 0.815 0 C-N-CA 124.074 0.95 . . . . 75.329999999999998 109.696 -176.687 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 7.7 tp-100 -61.93 -35.16 77.57 Favored 'General case' 0 N--CA 1.477 0.913 0 C-N-CA 124.605 1.162 . . . . 74.409999999999997 110.617 -178.226 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -72.75 -39.44 66.83 Favored 'General case' 0 N--CA 1.472 0.656 0 C-N-CA 124.645 1.178 . . . . 73.439999999999998 108.966 179.734 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 42.6 t -69.65 -38.3 77.07 Favored 'General case' 0 C--N 1.352 0.678 0 C-N-CA 124.008 0.923 . . . . 75.209999999999994 111.585 -176.265 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 102' ' ' LEU . . . . . 0.492 ' HG ' ' HH2' ' A' ' 11' ' ' TRP . 10.8 mp -80.8 -32.7 35.2 Favored 'General case' 0 N--CA 1.472 0.628 0 O-C-N 123.551 0.532 . . . . 75.150000000000006 110.649 -179.838 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 25.0 t-20 -68.61 -37.34 79.7 Favored 'General case' 0 N--CA 1.486 1.325 0 CA-C-O 120.975 0.416 . . . . 71.430000000000007 109.958 172.852 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 104' ' ' ASN . . . . . 0.668 ' HA ' HH21 ' A' ' 108' ' ' ARG . 28.4 t-20 -65.92 -44.84 83.95 Favored 'General case' 0 C--N 1.356 0.89 0 N-CA-C 108.812 -0.811 . . . . 74.540000000000006 108.812 174.661 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -56.5 -41.8 77.29 Favored 'General case' 0 C--N 1.346 0.433 0 O-C-N 124.052 0.845 . . . . 75.430000000000007 110.973 178.164 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 106' ' ' TYR . . . . . 0.487 ' CE2' ' HB2' ' A' ' 69' ' ' LYS . 17.2 t80 -68.02 -58.32 4.71 Favored 'General case' 0 CA--C 1.547 0.83 0 C-N-CA 123.339 0.656 . . . . 73.230000000000004 110.973 -176.642 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -65.34 -37.04 93.45 Favored Glycine 0 C--N 1.353 1.478 0 CA-C-N 115.797 -0.638 . . . . 74.299999999999997 112.413 -173.232 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 108' ' ' ARG . . . . . 0.668 HH21 ' HA ' ' A' ' 104' ' ' ASN . 0.0 OUTLIER -80.34 -22.73 41.14 Favored 'General case' 0 CA--C 1.538 0.507 0 C-N-CA 123.514 0.726 . . . . 75.530000000000001 110.673 179.422 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 109' ' ' LEU . . . . . 0.554 HD22 ' HB3' ' A' ' 65' ' ' ALA . 41.0 tp -67.15 -37.24 83.45 Favored 'General case' 0 N--CA 1.498 1.974 0 CA-C-O 121.402 0.62 . . . . 74.329999999999998 109.543 170.55 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 30.4 t -70.7 -36.15 73.12 Favored 'General case' 0 CA--C 1.55 0.976 0 CA-C-N 114.418 -1.265 . . . . 63.229999999999997 110.295 173.529 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . -90.33 -68.25 1.2 Allowed Glycine 0 C--N 1.371 2.509 0 N-CA-C 115.759 1.064 . . . . 74.430000000000007 115.759 -176.511 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 112' ' ' MET . . . . . . . . . . . . . 5.5 tmm? -95.97 -62.99 1.2 Allowed 'General case' 0 N--CA 1.498 1.967 0 CA-C-N 118.911 1.356 . . . . 74.329999999999998 111.078 -177.49 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 5.8 mt 157.47 66.38 0.0 OUTLIER 'General case' 0 N--CA 1.494 1.749 0 C-N-CA 128.141 2.576 . . . . 71.230000000000004 107.198 179.526 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 114' ' ' LEU . . . . . 0.434 ' H ' ' HA ' ' A' ' 109' ' ' LEU . 7.1 tt 79.55 -29.25 0.14 Allowed 'General case' 0 N--CA 1.483 1.211 0 C-N-CA 126.958 2.103 . . . . 72.310000000000002 112.698 171.12 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 115' ' ' VAL . . . . . . . . . . . . . 18.2 m -124.3 128.03 25.13 Favored Pre-proline 0 CA--C 1.55 0.979 0 C-N-CA 123.424 0.69 . . . . 73.409999999999997 110.811 -172.932 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 21.8 Cg_endo -98.34 -173.72 0.17 Allowed 'Trans proline' 0 C--N 1.375 1.938 0 C-N-CA 123.672 2.914 . . . . 72.439999999999998 112.587 173.261 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 5.6 m-20 -100.67 -38.21 8.42 Favored 'General case' 0 N--CA 1.488 1.445 0 N-CA-C 108.096 -1.076 . . . . 73.239999999999995 108.096 162.458 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -156.22 146.32 15.76 Favored Pre-proline 0 CA--C 1.548 0.884 0 CA-C-N 114.247 -1.342 . . . . 71.209999999999994 108.305 176.224 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 119' ' ' PRO . . . . . . . . . . . . . 22.0 Cg_endo -59.83 137.35 75.98 Favored 'Trans proline' 0 C--N 1.373 1.837 0 C-N-CA 122.662 2.241 . . . . 75.310000000000002 111.264 173.733 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . -70.89 135.45 24.57 Favored Glycine 0 C--N 1.345 1.039 0 O-C-N 123.539 0.524 . . . . 52.409999999999997 113.338 -174.19 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . -108.86 178.21 4.54 Favored 'General case' 0 N--CA 1.479 1.004 0 C-N-CA 124.478 1.111 . . . . 74.040000000000006 110.864 178.52 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 122' ' ' SER . . . . . . . . . . . . . 35.6 t . . . . . 0 C--O 1.249 1.061 0 C-N-CA 124.22 1.008 . . . . 71.120000000000005 108.291 173.145 . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 18.5 ptt? . . . . . 0 N--CA 1.479 1.001 0 CA-C-O 120.923 0.392 . . . . 74.310000000000002 110.739 . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 8.8 t -55.52 -36.22 66.49 Favored 'General case' 0 N--CA 1.487 1.412 0 C-N-CA 123.268 0.627 . . . . 75.319999999999993 111.27 -178.205 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 18.4 m -55.11 -50.07 70.16 Favored 'General case' 0 C--N 1.356 0.855 0 C-N-CA 124.382 1.073 . . . . 72.230000000000004 110.85 174.416 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 4' ' ' THR . . . . . 0.457 HG22 HD12 ' A' ' 60' ' ' ILE . 24.2 m -69.14 -39.09 79.04 Favored 'General case' 0 C--O 1.217 -0.616 0 CA-C-N 115.19 -0.914 . . . . 74.109999999999999 111.741 -177.508 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 74.6 t -61.91 -47.37 93.52 Favored 'Isoleucine or valine' 0 C--O 1.255 1.378 0 C-N-CA 122.698 0.399 . . . . 72.329999999999998 110.143 -177.276 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 27.6 mm-40 -61.43 -48.35 81.6 Favored 'General case' 0 C--N 1.351 0.639 0 CA-C-N 115.669 -0.696 . . . . 73.329999999999998 110.114 174.862 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 38.4 t80 -54.18 -49.88 68.31 Favored 'General case' 0 N--CA 1.485 1.31 0 C-N-CA 124.633 1.173 . . . . 75.219999999999999 111.472 -176.568 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . 0.449 HG13 ' O ' ' A' ' 4' ' ' THR . 64.0 mt -64.02 -47.33 90.87 Favored 'Isoleucine or valine' 0 C--N 1.359 0.988 0 C-N-CA 123.506 0.722 . . . . 74.219999999999999 110.123 179.624 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 2.9 t-20 -62.15 -28.94 70.0 Favored 'General case' 0 N--CA 1.484 1.251 0 O-C-N 123.559 0.537 . . . . 74.400000000000006 111.272 -176.811 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 96.9 mtt180 -72.82 -40.27 65.95 Favored 'General case' 0 CA--C 1.543 0.692 0 C-N-CA 123.803 0.841 . . . . 74.109999999999999 110.584 174.347 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 11' ' ' TRP . . . . . . . . . . . . . 84.0 m95 -65.8 -29.96 70.52 Favored 'General case' 0 N--CA 1.486 1.328 0 C-N-CA 122.801 0.441 . . . . 74.200000000000003 111.591 172.99 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . 0.444 ' HG2' ' CE2' ' A' ' 67' ' ' TYR . 38.2 mt-30 -65.21 -46.29 81.31 Favored 'General case' 0 C--O 1.211 -0.953 0 N-CA-C 107.796 -1.187 . . . . 72.310000000000002 107.796 173.352 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 61.6 ttt180 -59.62 -41.27 90.03 Favored 'General case' 0 CA--C 1.547 0.851 0 O-C-N 124.034 0.834 . . . . 75.340000000000003 111.71 -179.767 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 77.9 mt -64.41 -49.91 78.65 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.478 0 C-N-CA 123.098 0.559 . . . . 75.409999999999997 110.094 178.537 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . 0.46 ' HA ' ' HB ' ' A' ' 71' ' ' THR . . . -57.36 -46.55 83.22 Favored 'General case' 0 N--CA 1.478 0.933 0 C-N-CA 124.629 1.172 . . . . 74.299999999999997 111.656 178.869 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 89.5 mt -80.17 -34.33 37.63 Favored 'General case' 0 N--CA 1.477 0.896 0 CA-C-N 114.579 -1.191 . . . . 72.329999999999998 111.402 -171.968 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . 0.496 ' O ' ' HG ' ' A' ' 21' ' ' LEU . 21.0 mt -67.71 -49.46 62.54 Favored 'General case' 0 N--CA 1.481 1.092 0 N-CA-C 109.642 -0.503 . . . . 74.430000000000007 109.642 177.542 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 85.0 p -62.56 -37.72 87.25 Favored 'General case' 0 N--CA 1.478 0.953 0 O-C-N 123.513 0.508 . . . . 72.409999999999997 111.052 178.588 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 6.2 tp-100 -56.95 -46.92 81.78 Favored 'General case' 0 C--N 1.358 0.951 0 C-N-CA 123.497 0.719 . . . . 74.120000000000005 110.159 172.163 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 63.9 m -65.7 -42.11 91.56 Favored 'General case' 0 C--O 1.213 -0.819 0 O-C-N 123.707 0.629 . . . . 75.430000000000007 110.688 179.018 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . 0.496 ' HG ' ' O ' ' A' ' 17' ' ' LEU . 87.1 mt -63.43 -34.23 77.3 Favored 'General case' 0 N--CA 1.476 0.832 0 C-N-CA 123.56 0.744 . . . . 65.329999999999998 109.882 -178.032 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . 0.57 ' HA ' HD21 ' A' ' 78' ' ' LEU . 56.1 tp -66.97 -54.72 19.16 Favored 'General case' 0 C--N 1.352 0.682 0 C-N-CA 123.535 0.734 . . . . 75.450000000000003 110.12 176.026 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 9.5 mm-40 -50.82 -52.58 39.82 Favored 'General case' 0 N--CA 1.479 1.01 0 C-N-CA 124.341 1.056 . . . . 75.239999999999995 111.439 178.15 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . 0.475 HD21 HD11 ' A' ' 32' ' ' LEU . 62.4 mt -70.15 -34.54 73.15 Favored 'General case' 0 CA--C 1.539 0.557 0 C-N-CA 124.602 1.161 . . . . 74.019999999999996 111.078 -173.334 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . 0.406 ' HB3' HD22 ' A' ' 33' ' ' LEU . . . -60.64 -44.01 96.89 Favored 'General case' 0 N--CA 1.479 1.012 0 CA-C-O 120.902 0.382 . . . . 63.25 110.65 173.754 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 95.1 mt-30 -69.48 -31.79 70.29 Favored 'General case' 0 CA--C 1.549 0.918 0 CA-C-N 115.303 -0.862 . . . . 55.240000000000002 111.518 179.016 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 78.3 mtt180 -90.48 -2.57 57.93 Favored 'General case' 0 N--CA 1.483 1.198 0 C-N-CA 123.756 0.822 . . . . 71.239999999999995 112.315 -177.834 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 85.38 10.04 78.12 Favored Glycine 0 N--CA 1.479 1.566 0 N-CA-C 114.433 0.533 . . . . 74.109999999999999 114.433 174.891 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . 0.405 ' HB2' ' HB3' ' A' ' 24' ' ' LEU . 15.3 mm-40 -90.37 55.08 2.93 Favored 'General case' 0 N--CA 1.478 0.942 0 C-N-CA 124.79 1.236 . . . . 71.439999999999998 111.126 178.261 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 30' ' ' TRP . . . . . 0.459 ' HA ' HD11 ' A' ' 33' ' ' LEU . 83.5 m95 -63.02 -23.38 67.43 Favored 'General case' 0 N--CA 1.491 1.58 0 C-N-CA 123.875 0.87 . . . . 74.430000000000007 111.6 179.441 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 4.1 m-20 -55.61 -47.83 75.89 Favored 'General case' 0 N--CA 1.473 0.702 0 C-N-CA 124.984 1.314 . . . . 74.310000000000002 110.18 175.22 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . 0.475 HD11 HD21 ' A' ' 24' ' ' LEU . 82.0 mt -72.3 -24.33 61.31 Favored 'General case' 0 CA--C 1.544 0.723 0 CA-C-N 114.306 -1.315 . . . . 64.420000000000002 110.954 -177.872 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . 0.47 ' HA ' HD23 ' A' ' 21' ' ' LEU . 9.4 mp -66.23 -45.18 81.57 Favored 'General case' 0 C--N 1.363 1.184 0 N-CA-C 110.101 -0.333 . . . . 73.230000000000004 110.101 171.228 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 88.8 mt -65.54 -38.63 90.17 Favored 'General case' 0 N--CA 1.482 1.136 0 C-N-CA 123.325 0.65 . . . . 75.239999999999995 111.784 -178.677 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 95.7 mt-30 -71.09 -49.68 41.81 Favored 'General case' 0 N--CA 1.478 0.938 0 C-N-CA 122.588 0.355 . . . . 74.5 110.681 179.211 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 85.2 mm-40 -73.95 -14.2 61.01 Favored 'General case' 0 N--CA 1.483 1.182 0 C-N-CA 123.102 0.561 . . . . 71.450000000000003 112.464 179.314 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . 0.437 ' O ' ' HG ' ' A' ' 41' ' ' LEU . 42.9 tt0 -51.92 -52.13 52.1 Favored 'General case' 0 N--CA 1.484 1.236 0 C-N-CA 123.94 0.896 . . . . 73.420000000000002 111.32 176.485 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 62.9 t -56.63 -47.84 81.59 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.755 0 O-C-N 123.889 0.743 . . . . 74.430000000000007 110.661 -178.856 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 32.0 m -67.04 -37.0 83.31 Favored 'General case' 0 CA--C 1.538 0.508 0 CA-C-N 115.455 -0.793 . . . . 75.549999999999997 111.801 -177.695 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 43.8 t80 -70.69 -49.47 46.77 Favored 'General case' 0 N--CA 1.47 0.541 0 C-N-CA 123.248 0.619 . . . . 72.140000000000001 110.65 -176.875 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . 0.529 HD22 HD22 ' A' ' 92' ' ' LEU . 22.2 mt -68.36 -41.88 80.03 Favored 'General case' 0 N--CA 1.478 0.939 0 O-C-N 123.851 0.719 . . . . 74.129999999999995 110.144 -176.749 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 41.1 tt0 -57.43 -56.03 27.16 Favored 'General case' 0 C--N 1.358 0.965 0 O-C-N 123.924 0.765 . . . . 75.319999999999993 110.788 176.119 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 43' ' ' SER . . . . . 0.501 ' O ' HG23 ' A' ' 47' ' ' VAL . 73.0 m -57.54 -56.98 14.93 Favored 'General case' 0 C--N 1.352 0.704 0 O-C-N 124.046 0.841 . . . . 74.209999999999994 110.692 -177.587 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 14.6 tt -59.2 -40.8 82.01 Favored 'Isoleucine or valine' 0 C--N 1.354 0.803 0 O-C-N 123.799 0.687 . . . . 72.540000000000006 111.39 -172.139 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 38.1 mm-40 -64.07 -47.55 79.65 Favored 'General case' 0 C--N 1.358 0.964 0 CA-C-O 119.435 -0.317 . . . . 71.439999999999998 111.412 176.429 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 18.3 m -66.53 -27.6 67.89 Favored 'General case' 0 CA--C 1.551 0.983 0 O-C-N 123.457 0.473 . . . . 73.510000000000005 111.849 -177.222 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 47' ' ' VAL . . . . . 0.501 HG23 ' O ' ' A' ' 43' ' ' SER . 59.1 t -80.97 -38.37 16.81 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.384 0 C-N-CA 123.335 0.654 . . . . 72.239999999999995 110.612 -179.194 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 48' ' ' MET . . . . . . . . . . . . . 68.5 mtm -73.13 -21.9 60.63 Favored 'General case' 0 N--CA 1.486 1.374 0 C-N-CA 122.755 0.422 . . . . 74.129999999999995 110.407 172.894 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 17.2 tp10 -88.0 -18.74 28.34 Favored 'General case' 0 N--CA 1.481 1.096 0 C-N-CA 124.251 1.02 . . . . 73.200000000000003 110.167 174.793 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 14.2 tppt? -78.36 138.76 38.7 Favored 'General case' 0 C--O 1.24 0.581 0 N-CA-C 109.27 -0.641 . . . . 73.230000000000004 109.27 -179.852 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 8.6 tt0 -68.5 124.99 25.08 Favored 'General case' 0 C--O 1.241 0.639 0 CA-C-N 115.423 -0.808 . . . . 71.310000000000002 109.558 -177.899 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 52' ' ' THR . . . . . 0.444 HG22 ' HB3' ' A' ' 114' ' ' LEU . 29.7 m -61.08 121.34 61.82 Favored Pre-proline 0 CA--C 1.555 1.155 0 C-N-CA 123.672 0.789 . . . . 73.209999999999994 110.612 178.686 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 55.7 Cg_endo -67.19 155.88 68.69 Favored 'Trans proline' 0 C--N 1.376 1.988 0 C-N-CA 122.414 2.076 . . . . 72.109999999999999 111.764 176.484 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 18.1 Cg_exo -67.08 -52.87 0.56 Allowed 'Trans proline' 0 C--N 1.376 1.992 0 C-N-CA 122.399 2.066 . . . . 75.319999999999993 111.72 177.574 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . -70.11 86.8 0.31 Allowed Glycine 0 C--N 1.349 1.251 0 O-C-N 124.09 0.869 . . . . 63.240000000000002 112.912 -175.618 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 56' ' ' ILE . . . . . 0.484 ' O ' ' HB ' ' A' ' 60' ' ' ILE . 71.9 mt -115.5 -50.28 4.82 Favored 'Isoleucine or valine' 0 C--O 1.209 -1.044 0 C-N-CA 124.646 1.178 . . . . 75.040000000000006 108.99 176.416 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 10.4 p 60.43 -177.37 0.1 Allowed 'General case' 0 CA--C 1.557 1.23 0 C-N-CA 125.872 1.669 . . . . 64.010000000000005 111.077 -178.2 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -55.57 -42.85 75.3 Favored 'General case' 0 N--CA 1.479 1.011 0 C-N-CA 124.345 1.058 . . . . 71.439999999999998 110.144 176.168 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 49.3 m -61.76 -53.97 48.83 Favored 'General case' 0 CA--C 1.545 0.788 0 CA-C-N 115.697 -0.683 . . . . 32.149999999999999 112.759 -173.264 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 60' ' ' ILE . . . . . 0.484 ' HB ' ' O ' ' A' ' 56' ' ' ILE . 26.1 mt -79.28 -23.74 12.52 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.182 0 N-CA-C 109.631 -0.507 . . . . 75.409999999999997 109.631 -174.648 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 61' ' ' GLN . . . . . 0.446 ' HG3' ' HG ' ' A' ' 109' ' ' LEU . 53.2 tt0 -58.75 -48.23 81.92 Favored 'General case' 0 C--N 1.358 0.942 0 N-CA-C 109.866 -0.42 . . . . 75.349999999999994 109.866 172.005 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 3.4 m-20 -71.56 -37.68 71.05 Favored 'General case' 0 CA--C 1.547 0.842 0 CA-C-N 115.973 -0.558 . . . . 72.219999999999999 112.416 178.616 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 63' ' ' MET . . . . . . . . . . . . . 69.2 mtm -64.93 -59.79 3.78 Favored 'General case' 0 N--CA 1.488 1.466 0 CA-C-N 117.775 0.261 . . . . 74.349999999999994 111.284 179.172 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 64' ' ' VAL . . . . . 0.453 ' O ' HG13 ' A' ' 68' ' ' ILE . 55.5 t -57.64 -49.44 80.64 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.033 0 C-N-CA 123.516 0.726 . . . . 74.230000000000004 111.984 178.263 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . 0.473 ' HB3' HD21 ' A' ' 109' ' ' LEU . . . -64.7 -33.21 75.41 Favored 'General case' 0 N--CA 1.495 1.795 0 CA-C-N 118.977 0.808 . . . . 50.200000000000003 111.279 -179.638 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -64.36 -39.02 96.61 Favored Glycine 0 C--N 1.347 1.19 0 N-CA-C 112.182 -0.367 . . . . 52.439999999999998 112.182 174.795 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 67' ' ' TYR . . . . . 0.454 ' HB3' ' HB3' ' A' ' 15' ' ' ALA . 14.2 m-30 -65.48 -42.6 92.06 Favored 'General case' 0 N--CA 1.471 0.61 0 C-N-CA 123.636 0.774 . . . . 74.219999999999999 110.752 175.306 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 68' ' ' ILE . . . . . 0.524 ' O ' ' HG ' ' A' ' 72' ' ' LEU . 78.5 mt -59.34 -49.97 81.57 Favored 'Isoleucine or valine' 0 C--N 1.355 0.836 0 O-C-N 124.619 1.199 . . . . 74.230000000000004 109.38 178.689 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 69' ' ' LYS . . . . . 0.568 ' HB2' ' HE2' ' A' ' 106' ' ' TYR . 27.9 tptp -57.37 -46.09 83.76 Favored 'General case' 0 N--CA 1.472 0.666 0 C-N-CA 124.013 0.925 . . . . 74.239999999999995 110.393 -179.26 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 53.5 tt0 -59.35 -48.21 82.49 Favored 'General case' 0 C--N 1.354 0.802 0 CA-C-N 115.306 -0.861 . . . . 72.319999999999993 111.058 -179.411 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 71' ' ' THR . . . . . 0.46 ' HB ' ' HA ' ' A' ' 15' ' ' ALA . 9.2 t -76.08 -23.74 55.03 Favored 'General case' 0 C--O 1.24 0.584 0 O-C-N 123.401 0.438 . . . . 74.120000000000005 110.227 -174.438 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 72' ' ' LEU . . . . . 0.623 ' HA ' HH12 ' A' ' 98' ' ' ARG . 39.5 mt -61.37 -51.73 67.56 Favored 'General case' 0 C--N 1.363 1.158 0 N-CA-C 108.648 -0.871 . . . . 74.209999999999994 108.648 171.796 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 28.6 m-20 -64.51 -48.57 74.65 Favored 'General case' 0 N--CA 1.484 1.231 0 O-C-N 123.945 0.778 . . . . 75.510000000000005 112.429 179.716 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 94.6 m-20 -52.02 -56.63 13.09 Favored 'General case' 0 N--CA 1.491 1.593 0 C-N-CA 124.03 0.932 . . . . 63.200000000000003 110.729 -179.989 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 15.6 tt0 -70.49 -30.52 67.32 Favored 'General case' 0 CA--C 1.551 1.014 0 CA-C-N 114.787 -1.097 . . . . 74.239999999999995 110.762 -176.527 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 8.4 tt0 -64.22 -41.26 97.11 Favored 'General case' 0 N--CA 1.487 1.419 0 C-N-CA 123.49 0.716 . . . . 75.340000000000003 110.77 176.744 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 95.2 mt -67.26 -38.99 86.03 Favored 'General case' 0 N--CA 1.47 0.57 0 CA-C-N 115.7 -0.682 . . . . 73.420000000000002 109.929 178.085 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . 0.57 HD21 ' HA ' ' A' ' 22' ' ' LEU . 74.9 mt -58.78 -51.25 70.8 Favored 'General case' 0 C--N 1.357 0.898 0 CA-C-N 115.867 -0.606 . . . . 74.5 111.454 172.042 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 79' ' ' LYS . . . . . 0.549 ' HE2' ' O ' ' A' ' 88' ' ' GLU . 2.9 mptm? -61.33 -38.97 88.81 Favored 'General case' 0 N--CA 1.481 1.122 0 C-N-CA 123.956 0.902 . . . . 73.150000000000006 111.313 -179.442 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -67.94 -29.83 73.82 Favored Glycine 0 C--N 1.341 0.857 0 O-C-N 123.738 0.649 . . . . 62.130000000000003 112.204 177.429 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . 0.417 HD21 ' HH2' ' A' ' 30' ' ' TRP . 4.3 tt -78.2 -39.28 41.13 Favored 'General case' 0 CA--C 1.554 1.115 0 C-N-CA 123.5 0.72 . . . . 72.319999999999993 109.582 176.088 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 82' ' ' LEU . . . . . 0.42 ' HG ' ' O ' ' A' ' 78' ' ' LEU . 94.0 mt -77.85 -66.6 0.82 Allowed 'General case' 0 N--CA 1.48 1.073 0 C-N-CA 123.184 0.594 . . . . 74.129999999999995 111.057 -171.997 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 15.5 mm100 -147.28 -72.57 0.22 Allowed 'General case' 0 N--CA 1.475 0.821 0 C-N-CA 124.162 0.985 . . . . 74.099999999999994 109.308 -170.563 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 84' ' ' GLN . . . . . 0.405 ' HG2' ' HG2' ' A' ' 85' ' ' ARG . 8.4 tt0 -169.01 163.8 11.35 Favored 'General case' 0 CA--C 1.541 0.612 0 C-N-CA 124.209 1.003 . . . . 75.319999999999993 108.417 -173.499 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 85' ' ' ARG . . . . . 0.405 ' HG2' ' HG2' ' A' ' 84' ' ' GLN . 4.6 ptp180 -44.84 -35.5 2.8 Favored 'General case' 0 N--CA 1.489 1.502 0 C-N-CA 125.499 1.519 . . . . 73.099999999999994 113.865 -179.244 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 86' ' ' LEU . . . . . 0.55 HD21 ' HB3' ' A' ' 96' ' ' SER . 86.0 mt -130.19 98.45 4.73 Favored 'General case' 0 N--CA 1.469 0.487 0 C-N-CA 123.588 0.755 . . . . 70.219999999999999 109.218 176.957 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 10.2 t70 -160.63 -89.9 0.03 OUTLIER 'General case' 0 CA--C 1.55 0.974 0 N-CA-C 108.531 -0.914 . . . . 74.019999999999996 108.531 174.649 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 88' ' ' GLU . . . . . 0.549 ' O ' ' HE2' ' A' ' 79' ' ' LYS . 48.9 mt-10 -85.89 148.4 25.81 Favored 'General case' 0 N--CA 1.485 1.296 0 C-N-CA 123.598 0.759 . . . . 74.099999999999994 109.036 175.559 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 88.5 mt 61.73 20.74 11.63 Favored 'General case' 0 N--CA 1.498 1.93 0 C-N-CA 124.59 1.156 . . . . 74.310000000000002 112.265 -179.508 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 20.2 m -112.64 -40.58 4.02 Favored 'General case' 0 N--CA 1.48 1.064 0 C-N-CA 123.635 0.774 . . . . 74.530000000000001 110.301 -176.166 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 26.9 m -79.24 92.24 5.09 Favored 'General case' 0 N--CA 1.471 0.602 0 C-N-CA 123.811 0.844 . . . . 75.120000000000005 109.786 176.897 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 92' ' ' LEU . . . . . 0.529 HD22 HD22 ' A' ' 41' ' ' LEU . 11.9 mt -90.51 -62.89 1.36 Allowed 'General case' 0 N--CA 1.476 0.875 0 CA-C-N 116.044 -0.525 . . . . 70.0 110.552 -174.461 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 49.4 mt -77.24 -43.52 31.13 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.244 0 N-CA-C 109.076 -0.713 . . . . 75.420000000000002 109.076 173.14 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -171.62 -29.41 0.02 OUTLIER Glycine 0 C--N 1.346 1.115 0 CA-C-N 115.14 -0.936 . . . . 75.430000000000007 112.289 -179.226 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 14.1 pt20 -140.99 -177.41 5.08 Favored 'General case' 0 N--CA 1.481 1.102 0 C-N-CA 123.61 0.764 . . . . 73.519999999999996 110.112 179.544 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 96' ' ' SER . . . . . 0.55 ' HB3' HD21 ' A' ' 86' ' ' LEU . 50.2 m -66.91 83.01 0.11 Allowed 'General case' 0 CA--C 1.541 0.615 0 C-N-CA 124.233 1.013 . . . . 74.329999999999998 112.249 -174.618 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 89.7 m -88.12 -41.85 12.75 Favored 'General case' 0 CA--C 1.54 0.558 0 C-N-CA 123.744 0.818 . . . . 65.239999999999995 110.075 176.526 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 98' ' ' ARG . . . . . 0.623 HH12 ' HA ' ' A' ' 72' ' ' LEU . 1.7 tmt_? -49.88 -57.65 6.99 Favored 'General case' 0 N--CA 1.478 0.948 0 C-N-CA 125.075 1.35 . . . . 72.310000000000002 112.929 -165.57 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 8.9 tt0 -60.51 -52.4 65.35 Favored 'General case' 0 N--CA 1.477 0.916 0 O-C-N 123.789 0.681 . . . . 64.430000000000007 110.861 -170.318 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 65.5 tttp -64.78 -42.99 94.65 Favored 'General case' 0 CA--C 1.542 0.673 0 O-C-N 124.15 0.906 . . . . 73.329999999999998 111.473 -178.397 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 26.5 t -69.37 -40.24 77.55 Favored 'General case' 0 N--CA 1.467 0.419 0 C-N-CA 123.426 0.691 . . . . 71.109999999999999 111.613 -173.122 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 102' ' ' LEU . . . . . 0.464 ' HG ' HG23 ' A' ' 68' ' ' ILE . 3.4 tp -80.38 -34.65 36.19 Favored 'General case' 0 N--CA 1.471 0.6 0 C-N-CA 122.787 0.435 . . . . 72.409999999999997 110.47 -176.372 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 7.6 t30 -63.41 -40.03 96.11 Favored 'General case' 0 N--CA 1.479 1.016 0 C-N-CA 122.933 0.493 . . . . 64.340000000000003 109.907 172.902 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 12.0 t30 -67.07 -41.28 86.69 Favored 'General case' 0 N--CA 1.473 0.722 0 CA-C-N 115.651 -0.704 . . . . 71.519999999999996 110.126 177.188 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -59.14 -45.17 91.66 Favored 'General case' 0 N--CA 1.47 0.566 0 O-C-N 123.598 0.561 . . . . 55.329999999999998 110.402 177.44 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 106' ' ' TYR . . . . . 0.568 ' HE2' ' HB2' ' A' ' 69' ' ' LYS . 19.9 t80 -60.71 -55.4 33.67 Favored 'General case' 0 C--N 1.355 0.821 0 O-C-N 124.046 0.841 . . . . 74.409999999999997 110.477 178.999 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -66.09 -44.04 92.13 Favored Glycine 0 C--N 1.349 1.302 0 O-C-N 124.318 1.011 . . . . 43.140000000000001 112.494 -171.058 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 20.4 mmm180 -67.1 -33.3 75.18 Favored 'General case' 0 CA--C 1.541 0.633 0 C-N-CA 123.258 0.623 . . . . 75.5 111.048 177.512 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 109' ' ' LEU . . . . . 0.545 ' HA ' ' N ' ' A' ' 114' ' ' LEU . 35.6 tp -68.33 -43.43 77.57 Favored 'General case' 0 N--CA 1.485 1.287 0 C-N-CA 122.819 0.448 . . . . 62.100000000000001 110.359 176.327 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 33.2 t -68.06 -31.73 71.57 Favored 'General case' 0 CA--C 1.54 0.595 0 CA-C-N 114.701 -1.136 . . . . 72.109999999999999 110.296 -178.326 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . -89.64 -65.18 1.25 Allowed Glycine 0 C--N 1.36 1.898 0 CA-C-O 119.109 -0.828 . . . . 73.239999999999995 113.941 -179.502 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 112' ' ' MET . . . . . 0.465 ' O ' ' HG ' ' A' ' 113' ' ' LEU . 10.0 tpt -98.1 -72.52 0.65 Allowed 'General case' 0 N--CA 1.486 1.347 0 CA-C-N 118.609 1.204 . . . . 74.109999999999999 112.273 174.637 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 113' ' ' LEU . . . . . 0.465 ' HG ' ' O ' ' A' ' 112' ' ' MET . 12.2 mt 171.25 45.88 0.0 OUTLIER 'General case' 0 N--CA 1.505 2.305 0 C-N-CA 125.445 1.498 . . . . 73.230000000000004 109.561 -174.406 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 114' ' ' LEU . . . . . 0.545 ' N ' ' HA ' ' A' ' 109' ' ' LEU . 2.1 tt 82.12 -25.32 0.16 Allowed 'General case' 0 N--CA 1.507 2.388 0 C-N-CA 126.633 1.973 . . . . 71.049999999999997 111.343 172.075 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 115' ' ' VAL . . . . . . . . . . . . . 35.2 m -77.53 129.93 75.65 Favored Pre-proline 0 CA--C 1.552 1.026 0 C-N-CA 123.685 0.794 . . . . 74.450000000000003 109.988 -175.841 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 12.2 Cg_exo -71.53 92.25 0.68 Allowed 'Trans proline' 0 C--N 1.372 1.807 0 C-N-CA 122.91 2.407 . . . . 73.430000000000007 110.956 177.178 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 33.8 t70 -171.5 88.22 0.1 Allowed 'General case' 0 C--O 1.241 0.635 0 C-N-CA 124.295 1.038 . . . . 74.010000000000005 108.555 -172.717 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -80.69 109.96 15.26 Favored Pre-proline 0 CA--C 1.553 1.085 0 C-N-CA 123.444 0.698 . . . . 72.099999999999994 110.413 179.308 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 119' ' ' PRO . . . . . . . . . . . . . 42.9 Cg_endo -99.8 19.09 0.32 Allowed 'Trans proline' 0 C--N 1.375 1.967 0 C-N-CA 123.629 2.886 . . . . 72.340000000000003 112.972 -179.824 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . 83.77 -67.23 3.76 Favored Glycine 0 C--N 1.348 1.233 0 N-CA-C 110.599 -1.0 . . . . 75.519999999999996 110.599 -168.775 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . -168.09 161.21 12.45 Favored 'General case' 0 N--CA 1.472 0.667 0 C-N-CA 124.557 1.143 . . . . 71.129999999999995 109.158 171.381 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 122' ' ' SER . . . . . . . . . . . . . 17.8 m . . . . . 0 C--O 1.253 1.255 0 N-CA-C 109.004 -0.739 . . . . 72.349999999999994 109.004 175.749 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 1' ' ' MET . . . . . 0.4 ' O ' HG23 ' A' ' 5' ' ' VAL . 24.6 ptm . . . . . 0 N--CA 1.483 1.221 0 CA-C-O 119.706 -0.188 . . . . 71.02 111.327 . . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 26.2 p -56.05 -39.65 72.35 Favored 'General case' 0 N--CA 1.484 1.267 0 C-N-CA 123.286 0.634 . . . . 75.24 111.739 -179.934 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 48.3 m -68.46 -30.76 69.7 Favored 'General case' 0 CA--C 1.54 0.593 0 C-N-CA 123.375 0.67 . . . . 65.14 111.637 177.124 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 4' ' ' THR . . . . . 0.516 ' HA ' ' HG3' ' A' ' 53' ' ' PRO . 12.4 m -74.42 -35.99 63.43 Favored 'General case' 0 C--N 1.351 0.668 0 C-N-CA 123.04 0.536 . . . . 73.12 111.226 177.207 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 5' ' ' VAL . . . . . 0.4 HG23 ' O ' ' A' ' 1' ' ' MET . 48.7 t -66.27 -40.29 86.47 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.745 0 N-CA-C 109.248 -0.649 . . . . 73.03 109.248 175.478 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 6' ' ' GLU . . . . . 0.511 ' O ' ' HG3' ' A' ' 10' ' ' ARG . 5.0 tm-20 -65.34 -37.21 86.37 Favored 'General case' 0 CA--C 1.542 0.652 0 CA-C-N 114.466 -1.243 . . . . 65.11 110.062 176.157 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 7' ' ' PHE . . . . . 0.421 ' O ' ' HB2' ' A' ' 10' ' ' ARG . 69.0 t80 -67.88 -44.62 76.63 Favored 'General case' 0 N--CA 1.48 1.069 0 C-N-CA 124.516 1.126 . . . . 63.31 112.103 178.4 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 8' ' ' ILE . . . . . 0.49 HD11 HG23 ' A' ' 60' ' ' ILE . 83.9 mt -65.49 -37.68 80.63 Favored 'Isoleucine or valine' 0 C--O 1.214 -0.813 0 N-CA-C 108.752 -0.832 . . . . 74.45 108.752 175.611 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 28.4 t-20 -65.2 -28.87 69.69 Favored 'General case' 0 N--CA 1.482 1.131 0 C-N-CA 124.594 1.157 . . . . 63.53 110.937 175.762 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 10' ' ' ARG . . . . . 0.6 ' HB3' HG22 ' A' ' 47' ' ' VAL . 65.4 mtt180 -62.56 -53.78 49.53 Favored 'General case' 0 N--CA 1.484 1.251 0 CA-C-O 121.766 0.793 . . . . 74.24 109.216 172.408 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 11' ' ' TRP . . . . . . . . . . . . . 98.3 m95 -73.89 -20.62 60.35 Favored 'General case' 0 N--CA 1.475 0.801 0 CA-C-N 114.927 -1.033 . . . . 74.23 112.741 -177.963 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 12' ' ' GLN . . . . . 0.439 ' HG3' ' O ' ' A' ' 8' ' ' ILE . 58.7 mt-30 -72.18 -38.86 69.01 Favored 'General case' 0 C--O 1.214 -0.813 0 N-CA-C 108.795 -0.817 . . . . 60.53 108.795 170.117 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 16.5 tpt180 -58.57 -52.34 66.07 Favored 'General case' 0 CA--C 1.54 0.563 0 O-C-N 123.812 0.695 . . . . 74.03 109.702 178.996 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 14' ' ' ILE . . . . . 0.463 HG22 ' OG1' ' A' ' 71' ' ' THR . 22.8 mt -65.04 -46.83 90.21 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.24 0 O-C-N 123.459 0.474 . . . . 63.12 111.03 179.507 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 15' ' ' ALA . . . . . 0.568 ' HA ' ' HB ' ' A' ' 71' ' ' THR . . . -58.54 -46.78 86.1 Favored 'General case' 0 N--CA 1.491 1.604 0 C-N-CA 123.703 0.801 . . . . 62.23 111.919 -177.278 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 82.7 mt -70.26 -44.6 68.11 Favored 'General case' 0 N--CA 1.479 1.014 0 CA-C-N 114.891 -1.049 . . . . 75.13 111.101 -176.445 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.496 ' O ' ' HG ' ' A' ' 21' ' ' LEU . 74.3 mt -64.83 -45.29 86.78 Favored 'General case' 0 CA--C 1.544 0.717 0 O-C-N 123.607 0.567 . . . . 74.04 111.092 -179.531 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 18' ' ' SER . . . . . 0.408 ' HB3' ' OH ' ' A' ' 40' ' ' TYR . 80.4 p -64.68 -39.01 92.93 Favored 'General case' 0 N--CA 1.484 1.248 0 C-N-CA 123.159 0.584 . . . . 74.45 111.392 -179.36 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 6.0 tp-100 -58.98 -48.3 82.04 Favored 'General case' 0 C--N 1.354 0.777 0 O-C-N 123.972 0.795 . . . . 74.25 110.079 175.045 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 38.4 m -56.74 -50.97 70.65 Favored 'General case' 0 C--N 1.354 0.793 0 O-C-N 124.14 0.9 . . . . 74.35 110.188 177.517 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 21' ' ' LEU . . . . . 0.497 HD22 ' HA ' ' A' ' 33' ' ' LEU . 81.1 mt -65.32 -30.23 71.06 Favored 'General case' 0 CA--C 1.538 0.507 0 C-N-CA 123.754 0.822 . . . . 62.43 111.163 -175.497 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 22' ' ' LEU . . . . . 0.707 ' HA ' HD21 ' A' ' 78' ' ' LEU . 63.9 tp -64.72 -58.13 7.09 Favored 'General case' 0 C--N 1.353 0.752 0 N-CA-C 109.534 -0.543 . . . . 74.34 109.534 176.989 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 39.3 mt-10 -57.12 -47.28 81.49 Favored 'General case' 0 N--CA 1.475 0.779 0 O-C-N 124.396 1.06 . . . . 63.33 110.991 -178.015 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 95.9 mt -64.33 -40.33 95.68 Favored 'General case' 0 N--CA 1.473 0.714 0 C-N-CA 123.899 0.88 . . . . 74.15 111.442 -177.372 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 25' ' ' ALA . . . . . 0.493 ' HB2' HD21 ' A' ' 33' ' ' LEU . . . -61.42 -44.73 96.62 Favored 'General case' 0 N--CA 1.476 0.863 0 C-N-CA 122.895 0.478 . . . . 43.33 110.847 178.195 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 89.6 mt-30 -64.84 -30.81 71.83 Favored 'General case' 0 N--CA 1.477 0.883 0 O-C-N 124.088 0.868 . . . . 62.43 111.2 178.351 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 53.6 mtt180 -83.16 -5.79 59.25 Favored 'General case' 0 N--CA 1.481 1.106 0 C-N-CA 123.568 0.747 . . . . 73.2 112.071 177.271 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 86.67 7.65 78.21 Favored Glycine 0 C--N 1.349 1.271 0 N-CA-C 114.027 0.371 . . . . 63.35 114.027 178.144 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 11.2 mm-40 -82.37 57.63 3.74 Favored 'General case' 0 CA--C 1.546 0.791 0 C-N-CA 124.281 1.032 . . . . 61.42 111.251 178.382 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 30' ' ' TRP . . . . . 0.401 ' O ' ' HG ' ' A' ' 34' ' ' LEU . 84.7 m95 -63.43 -32.04 73.37 Favored 'General case' 0 N--CA 1.477 0.917 0 C-N-CA 123.656 0.782 . . . . 72.13 110.942 -178.769 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 10.1 m-20 -56.66 -42.17 78.52 Favored 'General case' 0 N--CA 1.476 0.846 0 C-N-CA 124.032 0.933 . . . . 64.51 110.706 177.846 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 83.3 mt -66.12 -34.51 78.21 Favored 'General case' 0 N--CA 1.474 0.742 0 C-N-CA 123.395 0.678 . . . . 60.04 111.199 179.743 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 33' ' ' LEU . . . . . 0.497 ' HA ' HD22 ' A' ' 21' ' ' LEU . 9.9 mp -66.22 -39.61 89.71 Favored 'General case' 0 N--CA 1.481 1.101 0 C-N-CA 122.563 0.345 . . . . 64.14 110.299 173.023 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.401 ' HG ' ' O ' ' A' ' 30' ' ' TRP . 84.9 mt -73.66 -22.94 59.81 Favored 'General case' 0 N--CA 1.478 0.945 0 C-N-CA 123.504 0.722 . . . . 72.33 111.661 -179.091 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 56.1 mt-30 -85.98 -32.73 21.37 Favored 'General case' 0 N--CA 1.486 1.372 0 C-N-CA 123.515 0.726 . . . . 61.35 110.774 176.09 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 25.5 mm-40 -86.19 -12.66 49.2 Favored 'General case' 0 N--CA 1.479 1.02 0 C-N-CA 124.017 0.927 . . . . 72.5 111.521 176.136 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 37' ' ' GLU . . . . . 0.476 ' O ' ' HG ' ' A' ' 41' ' ' LEU . 36.3 tt0 -44.57 -65.0 0.58 Allowed 'General case' 0 N--CA 1.477 0.889 0 C-N-CA 124.543 1.137 . . . . 53.34 113.055 -178.531 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 93.2 t -65.49 -33.26 62.44 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.692 0 C-N-CA 122.955 0.502 . . . . 61.32 110.866 -175.911 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 57.7 m -63.85 -38.31 90.62 Favored 'General case' 0 N--CA 1.476 0.831 0 C-N-CA 123.069 0.548 . . . . 75.54 111.415 175.406 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 40' ' ' TYR . . . . . 0.408 ' OH ' ' HB3' ' A' ' 18' ' ' SER . 42.4 t80 -78.11 -43.04 30.09 Favored 'General case' 0 C--N 1.344 0.348 0 C-N-CA 123.326 0.65 . . . . 72.34 110.547 -174.705 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 41' ' ' LEU . . . . . 0.476 ' HG ' ' O ' ' A' ' 37' ' ' GLU . 63.2 mt -64.95 -41.52 95.42 Favored 'General case' 0 C--O 1.245 0.854 0 O-C-N 123.955 0.785 . . . . 63.13 109.554 178.529 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 53.9 tt0 -56.71 -53.4 58.22 Favored 'General case' 0 C--N 1.358 0.962 0 CA-C-N 115.157 -0.929 . . . . 71.41 110.014 173.713 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 43' ' ' SER . . . . . 0.562 ' O ' HG23 ' A' ' 47' ' ' VAL . 71.5 m -56.45 -57.16 13.51 Favored 'General case' 0 C--N 1.35 0.607 0 O-C-N 124.216 0.947 . . . . 72.05 111.658 -178.606 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 16.8 tt -61.03 -41.03 87.64 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.812 0 O-C-N 123.728 0.642 . . . . 72.33 111.335 -172.328 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 30.6 mt-10 -72.24 -37.07 69.23 Favored 'General case' 0 N--CA 1.477 0.89 0 N-CA-C 111.975 0.361 . . . . 74.14 111.975 178.824 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 46' ' ' THR . . . . . 0.505 ' O ' ' HB2' ' A' ' 50' ' ' LYS . 96.0 m -57.65 -40.2 78.74 Favored 'General case' 0 N--CA 1.486 1.36 0 C-N-CA 123.008 0.523 . . . . 61.53 110.589 174.424 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 47' ' ' VAL . . . . . 0.6 HG22 ' HB3' ' A' ' 10' ' ' ARG . 87.3 t -68.69 -49.56 63.49 Favored 'Isoleucine or valine' 0 C--O 1.243 0.724 0 C-N-CA 124.201 1.001 . . . . 51.24 111.371 -179.517 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 48' ' ' MET . . . . . . . . . . . . . 78.6 mtm -62.12 -43.74 98.18 Favored 'General case' 0 N--CA 1.482 1.165 0 O-C-N 123.877 0.735 . . . . 72.4 111.399 -176.608 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 46.0 mt-10 -85.02 4.12 35.36 Favored 'General case' 0 N--CA 1.476 0.84 0 C-N-CA 123.721 0.808 . . . . 63.05 111.944 -174.779 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 50' ' ' LYS . . . . . 0.505 ' HB2' ' O ' ' A' ' 46' ' ' THR . 1.5 tppt? -103.62 135.82 44.49 Favored 'General case' 0 N--CA 1.476 0.834 0 N-CA-C 109.56 -0.533 . . . . 73.44 109.56 179.117 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 9.0 tt0 -69.42 148.61 49.35 Favored 'General case' 0 CA--C 1.547 0.831 0 C-N-CA 123.653 0.781 . . . . 75.04 111.856 -169.615 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 15.9 m -68.68 130.58 91.78 Favored Pre-proline 0 CA--C 1.554 1.104 0 C-N-CA 124.511 1.124 . . . . 65.54 110.461 176.548 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 53' ' ' PRO . . . . . 0.516 ' HG3' ' HA ' ' A' ' 4' ' ' THR . 94.7 Cg_endo -75.38 155.89 41.25 Favored 'Trans proline' 0 CA--C 1.557 1.662 0 C-N-CA 122.591 2.194 . . . . 75.31 112.289 178.0 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_endo -70.03 -46.86 0.97 Allowed 'Trans proline' 0 C--N 1.369 1.643 0 C-N-CA 122.764 2.31 . . . . 61.21 113.413 179.029 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . -79.92 70.74 2.85 Favored Glycine 0 C--N 1.348 1.227 0 N-CA-C 114.336 0.495 . . . . 75.44 114.336 -170.179 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 56' ' ' ILE . . . . . 0.715 HG21 HD11 ' A' ' 113' ' ' LEU . 8.3 mm -101.75 142.86 15.5 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.906 0 C-N-CA 124.012 0.925 . . . . 61.45 108.781 175.518 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 72.9 p -113.18 174.32 5.96 Favored 'General case' 0 N--CA 1.478 0.93 0 N-CA-C 109.005 -0.739 . . . . 74.41 109.005 170.134 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 16.0 tpt180 -59.13 -42.74 91.36 Favored 'General case' 0 N--CA 1.478 0.934 0 C-N-CA 123.128 0.571 . . . . 70.04 109.584 176.197 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 19.8 m -56.64 -50.61 71.54 Favored 'General case' 0 C--N 1.356 0.88 0 C-N-CA 123.972 0.909 . . . . 75.42 111.082 176.733 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 60' ' ' ILE . . . . . 0.494 HD13 HG21 ' A' ' 4' ' ' THR . 99.1 mt -60.28 -42.17 89.61 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.809 0 O-C-N 123.972 0.795 . . . . 75.23 110.985 179.483 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 54.7 tt0 -58.73 -47.34 84.93 Favored 'General case' 0 CA--C 1.542 0.656 0 C-N-CA 123.51 0.724 . . . . 72.31 110.785 -179.715 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 14.4 m-20 -72.77 -32.82 65.89 Favored 'General case' 0 N--CA 1.48 1.027 0 N-CA-C 112.827 0.677 . . . . 64.23 112.827 -178.077 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 63' ' ' MET . . . . . . . . . . . . . 58.7 mtm -74.48 -41.82 60.08 Favored 'General case' 0 N--CA 1.485 1.317 0 CA-C-N 117.568 0.167 . . . . 74.44 110.938 179.673 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 64' ' ' VAL . . . . . 0.496 ' O ' HG13 ' A' ' 68' ' ' ILE . 56.1 t -64.0 -54.14 35.21 Favored 'Isoleucine or valine' 0 C--N 1.352 0.71 0 C-N-CA 123.492 0.717 . . . . 72.32 109.616 176.253 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -62.04 -32.7 73.24 Favored 'General case' 0 N--CA 1.477 0.923 0 O-C-N 123.639 0.587 . . . . 75.31 111.129 178.306 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -63.26 -40.2 98.75 Favored Glycine 0 C--N 1.348 1.205 0 N-CA-C 111.689 -0.564 . . . . 53.32 111.689 174.627 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 16.8 m-30 -75.21 -32.3 61.13 Favored 'General case' 0 C--N 1.352 0.685 0 C-N-CA 123.573 0.749 . . . . 73.23 111.722 178.702 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 68' ' ' ILE . . . . . 0.512 ' O ' ' HG ' ' A' ' 72' ' ' LEU . 62.1 mt -63.17 -56.15 19.05 Favored 'Isoleucine or valine' 0 C--N 1.357 0.903 0 N-CA-C 107.979 -1.119 . . . . 70.32 107.979 175.345 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 51.7 tptt -53.11 -43.51 66.94 Favored 'General case' 0 N--CA 1.477 0.896 0 C-N-CA 124.622 1.169 . . . . 75.21 111.527 177.481 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 61.5 tt0 -59.9 -52.39 65.63 Favored 'General case' 0 N--CA 1.472 0.629 0 CA-C-N 115.731 -0.668 . . . . 70.23 111.249 179.982 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 71' ' ' THR . . . . . 0.568 ' HB ' ' HA ' ' A' ' 15' ' ' ALA . 11.4 t -74.95 -27.07 60.03 Favored 'General case' 0 C--N 1.35 0.619 0 O-C-N 123.285 0.366 . . . . 73.34 110.275 -173.703 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 72' ' ' LEU . . . . . 0.512 ' HG ' ' O ' ' A' ' 68' ' ' ILE . 19.4 mt -61.78 -55.41 30.39 Favored 'General case' 0 C--N 1.358 0.949 0 N-CA-C 108.872 -0.788 . . . . 75.15 108.872 175.19 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -67.83 -41.95 82.24 Favored 'General case' 0 N--CA 1.479 0.982 0 N-CA-C 113.937 1.088 . . . . 74.21 113.937 -175.916 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 94.7 m-20 -60.88 -55.41 33.32 Favored 'General case' 0 N--CA 1.493 1.714 0 CA-C-O 121.869 0.842 . . . . 74.21 110.121 177.299 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 75' ' ' GLU . . . . . 0.518 ' O ' ' HG2' ' A' ' 79' ' ' LYS . 62.5 tt0 -70.08 -19.9 63.24 Favored 'General case' 0 CA--C 1.549 0.936 0 CA-C-N 114.516 -1.22 . . . . 64.01 110.801 -178.876 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 76' ' ' GLN . . . . . 0.428 ' HB2' ' O ' ' A' ' 72' ' ' LEU . 61.2 tt0 -72.92 -41.12 64.89 Favored 'General case' 0 N--CA 1.489 1.512 0 C-N-CA 123.127 0.571 . . . . 64.03 109.879 176.602 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 93.3 mt -59.58 -41.4 90.15 Favored 'General case' 0 N--CA 1.474 0.77 0 O-C-N 123.938 0.774 . . . . 73.42 109.467 172.926 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 78' ' ' LEU . . . . . 0.707 HD21 ' HA ' ' A' ' 22' ' ' LEU . 70.1 mt -58.16 -51.25 70.49 Favored 'General case' 0 N--CA 1.478 0.947 0 CA-C-N 115.611 -0.722 . . . . 63.15 111.972 170.87 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 79' ' ' LYS . . . . . 0.518 ' HG2' ' O ' ' A' ' 75' ' ' GLU . 41.3 mmtm -57.1 -42.58 81.03 Favored 'General case' 0 N--CA 1.481 1.105 0 C-N-CA 123.495 0.718 . . . . 74.45 110.827 -176.662 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -67.26 -40.63 92.17 Favored Glycine 0 C--N 1.344 1.004 0 O-C-N 124.583 1.177 . . . . 42.31 113.001 179.259 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 3.1 tt -64.49 -48.3 75.69 Favored 'General case' 0 N--CA 1.475 0.805 0 C-N-CA 123.895 0.878 . . . . 74.55 109.375 179.301 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 85.7 mt . . . . . 0 CA--C 1.543 0.685 0 C-N-CA 124.391 1.076 . . . . 73.42 111.708 -171.885 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 85.1 mt . . . . . 0 N--CA 1.474 0.764 0 N-CA-C 108.364 -0.976 . . . . 73.3 108.364 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 49.8 mt -120.71 13.34 6.35 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.605 0 CA-C-O 122.003 0.906 . . . . 70.34 109.186 176.865 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 87.37 -11.91 64.33 Favored Glycine 0 N--CA 1.475 1.285 0 CA-C-N 116.042 -0.526 . . . . 64.42 113.967 -178.567 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 33.7 tt0 -132.77 174.1 10.67 Favored 'General case' 0 N--CA 1.477 0.894 0 N-CA-C 108.395 -0.965 . . . . 73.03 108.395 -178.398 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 45.6 m -62.6 81.74 0.02 OUTLIER 'General case' 0 N--CA 1.477 0.893 0 C-N-CA 123.936 0.894 . . . . 60.24 111.62 177.247 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 35.4 m -72.27 -43.33 64.43 Favored 'General case' 0 C--O 1.224 -0.289 0 CA-C-N 115.143 -0.935 . . . . 64.31 109.615 175.748 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 98' ' ' ARG . . . . . 0.495 ' NH1' ' HB3' ' A' ' 75' ' ' GLU . 6.9 ttp180 -59.92 -48.53 81.34 Favored 'General case' 0 CA--C 1.536 0.431 0 O-C-N 124.215 0.947 . . . . 52.54 112.705 -169.417 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 1.5 tm0? -62.96 -55.41 26.1 Favored 'General case' 0 N--CA 1.472 0.651 0 N-CA-C 109.595 -0.52 . . . . 61.14 109.595 -175.071 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 65.4 tttp -56.5 -54.2 48.59 Favored 'General case' 0 CA--C 1.543 0.7 0 O-C-N 123.963 0.789 . . . . 73.22 111.105 -179.868 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 46.8 t -67.53 -55.58 12.94 Favored 'General case' 0 CA--C 1.538 0.516 0 C-N-CA 123.686 0.794 . . . . 64.45 112.022 -171.775 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 8.0 mp -76.83 -30.54 56.4 Favored 'General case' 0 N--CA 1.485 1.282 0 N-CA-C 112.518 0.562 . . . . 63.14 112.518 -172.142 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 8.2 t30 -75.64 -41.87 53.03 Favored 'General case' 0 N--CA 1.485 1.316 0 CA-C-N 118.34 0.518 . . . . 63.51 110.257 177.46 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 104' ' ' ASN . . . . . 0.478 ' O ' ' HG2' ' A' ' 108' ' ' ARG . 28.0 t-20 -62.8 -44.28 96.57 Favored 'General case' 0 N--CA 1.481 1.084 0 N-CA-C 109.165 -0.68 . . . . 54.35 109.165 173.725 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -59.62 -38.27 80.88 Favored 'General case' 0 C--N 1.353 0.745 0 C-N-CA 123.843 0.857 . . . . 55.21 111.436 178.561 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 106' ' ' TYR . . . . . . . . . . . . . 4.3 t80 -61.0 -48.64 80.89 Favored 'General case' 0 CA--C 1.54 0.583 0 N-CA-C 108.738 -0.838 . . . . 75.31 108.738 175.104 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -61.93 -36.86 93.46 Favored Glycine 0 C--N 1.353 1.474 0 O-C-N 123.845 0.716 . . . . 64.14 112.786 -179.813 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 108' ' ' ARG . . . . . 0.478 ' HG2' ' O ' ' A' ' 104' ' ' ASN . 34.1 mmt180 -70.59 -40.38 73.28 Favored 'General case' 0 N--CA 1.473 0.679 0 C-N-CA 123.177 0.591 . . . . 61.21 110.035 -179.79 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 109' ' ' LEU . . . . . 0.413 ' HA ' ' N ' ' A' ' 114' ' ' LEU . 59.7 tp -66.75 -39.66 87.99 Favored 'General case' 0 N--CA 1.48 1.064 0 C-N-CA 123.741 0.816 . . . . 72.53 110.271 178.924 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 23.3 t -76.03 -27.76 57.44 Favored 'General case' 0 CA--C 1.543 0.696 0 CA-C-N 114.888 -1.051 . . . . 63.42 110.397 -179.802 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . -90.03 -67.04 1.21 Allowed Glycine 0 C--N 1.361 1.941 0 CA-C-O 119.194 -0.781 . . . . 61.14 113.698 -177.665 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 112' ' ' MET . . . . . . . . . . . . . 3.1 tmm? -97.15 -66.14 0.92 Allowed 'General case' 0 N--CA 1.481 1.088 0 CA-C-N 118.369 1.085 . . . . 75.21 110.605 179.289 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 113' ' ' LEU . . . . . 0.715 HD11 HG21 ' A' ' 56' ' ' ILE . 19.7 tp 160.21 54.35 0.0 OUTLIER 'General case' 0 N--CA 1.489 1.498 0 C-N-CA 126.378 1.871 . . . . 74.24 108.501 -178.501 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 114' ' ' LEU . . . . . 0.413 ' N ' ' HA ' ' A' ' 109' ' ' LEU . 22.3 tp . . . . . 0 CA--C 1.543 0.702 0 C-N-CA 125.764 1.626 . . . . 72.53 111.911 176.271 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 25.3 ttt . . . . . 0 CA--C 1.553 1.078 0 CA-C-O 119.495 -0.288 . . . . 61.41 110.856 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 37.1 p -56.03 -49.08 74.68 Favored 'General case' 0 N--CA 1.487 1.405 0 N-CA-C 112.704 0.631 . . . . 72.14 112.704 -172.142 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 55.2 m -68.41 -26.67 65.65 Favored 'General case' 0 N--CA 1.483 1.183 0 C-N-CA 122.459 0.304 . . . . 73.42 111.774 -178.597 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 4' ' ' THR . . . . . 0.515 HG21 HD13 ' A' ' 60' ' ' ILE . 28.2 m -75.02 -41.3 59.56 Favored 'General case' 0 C--N 1.349 0.566 0 C-N-CA 123.191 0.596 . . . . 73.42 110.755 177.37 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 87.9 t -68.32 -36.36 74.7 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.817 0 C-N-CA 123.381 0.673 . . . . 65.11 109.438 177.361 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 42.2 mm-40 -62.37 -46.62 87.82 Favored 'General case' 0 N--CA 1.478 0.931 0 C-N-CA 123.761 0.824 . . . . 74.34 110.566 173.252 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 31.0 t80 -64.93 -47.91 76.0 Favored 'General case' 0 N--CA 1.475 0.821 0 O-C-N 123.989 0.805 . . . . 74.32 110.603 -175.878 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 8' ' ' ILE . . . . . 0.499 HD11 HG23 ' A' ' 60' ' ' ILE . 77.4 mt -65.75 -36.96 78.81 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.856 0 C-N-CA 123.607 0.763 . . . . 70.43 110.439 178.577 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 26.0 t-20 -73.29 -27.8 61.75 Favored 'General case' 0 N--CA 1.489 1.489 0 C-N-CA 123.201 0.6 . . . . 73.25 111.195 -179.681 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 10' ' ' ARG . . . . . 0.587 ' HB3' HG22 ' A' ' 47' ' ' VAL . 62.7 mtt85 -72.11 -37.43 69.51 Favored 'General case' 0 CA--C 1.54 0.595 0 C-N-CA 123.054 0.542 . . . . 71.44 109.754 173.038 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 11' ' ' TRP . . . . . . . . . . . . . 86.5 m95 -76.14 -20.92 57.17 Favored 'General case' 0 N--CA 1.475 0.824 0 CA-C-N 116.043 -0.526 . . . . 70.13 111.549 172.012 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 53.5 mt-30 -68.15 -46.38 70.93 Favored 'General case' 0 C--N 1.359 0.982 0 N-CA-C 107.553 -1.276 . . . . 65.12 107.553 168.839 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 13' ' ' ARG . . . . . 0.668 ' HE ' HD11 ' A' ' 17' ' ' LEU . 16.2 tpt180 -59.02 -46.66 87.64 Favored 'General case' 0 CA--C 1.548 0.868 0 O-C-N 123.8 0.688 . . . . 74.41 110.927 -177.622 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 14' ' ' ILE . . . . . 0.441 HD13 HG13 ' A' ' 44' ' ' ILE . 56.8 mt -66.21 -52.81 43.5 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.095 0 O-C-N 123.201 0.313 . . . . 72.44 110.607 177.8 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 15' ' ' ALA . . . . . 0.569 ' HA ' ' HB ' ' A' ' 71' ' ' THR . . . -56.56 -45.15 81.43 Favored 'General case' 0 N--CA 1.488 1.436 0 C-N-CA 123.828 0.851 . . . . 34.12 111.794 -177.032 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 97.0 mt -78.58 -40.6 34.23 Favored 'General case' 0 N--CA 1.481 1.119 0 CA-C-N 114.923 -1.035 . . . . 72.45 111.39 -171.904 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.668 HD11 ' HE ' ' A' ' 13' ' ' ARG . 30.3 mt -64.0 -51.3 64.89 Favored 'General case' 0 C--N 1.36 1.05 0 CA-C-O 119.166 -0.445 . . . . 74.1 110.478 177.536 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 80.5 p -62.31 -36.47 82.25 Favored 'General case' 0 N--CA 1.478 0.945 0 O-C-N 123.789 0.681 . . . . 75.04 111.123 -179.94 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 30.9 tp60 -62.19 -44.39 96.68 Favored 'General case' 0 C--N 1.358 0.976 0 C-N-CA 123.288 0.635 . . . . 72.42 110.305 175.105 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 63.4 m -62.04 -43.84 97.97 Favored 'General case' 0 C--O 1.214 -0.782 0 O-C-N 123.918 0.761 . . . . 63.43 109.663 176.975 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 21' ' ' LEU . . . . . 0.714 HD22 ' HA ' ' A' ' 33' ' ' LEU . 52.4 mt -64.15 -31.92 73.3 Favored 'General case' 0 C--N 1.351 0.638 0 C-N-CA 123.268 0.627 . . . . 75.24 110.54 -178.009 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 22' ' ' LEU . . . . . 0.721 ' HA ' HD21 ' A' ' 78' ' ' LEU . 50.7 tp -66.85 -54.64 20.38 Favored 'General case' 0 N--CA 1.48 1.039 0 C-N-CA 123.096 0.558 . . . . 55.11 110.082 176.173 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 23' ' ' GLU . . . . . 0.412 ' HB3' ' NH1' ' A' ' 27' ' ' ARG . 11.6 mm-40 -52.69 -52.48 55.81 Favored 'General case' 0 CA--C 1.547 0.858 0 C-N-CA 124.593 1.157 . . . . 74.15 111.414 177.935 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 24' ' ' LEU . . . . . 0.448 HD22 HD12 ' A' ' 32' ' ' LEU . 77.8 mt -63.45 -43.78 96.39 Favored 'General case' 0 CA--C 1.538 0.516 0 CA-C-N 114.485 -1.234 . . . . 65.34 110.941 -176.752 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 25' ' ' ALA . . . . . 0.516 ' HB2' HD21 ' A' ' 33' ' ' LEU . . . -58.28 -48.35 80.75 Favored 'General case' 0 N--CA 1.483 1.214 0 C-N-CA 123.264 0.625 . . . . 62.33 110.884 -179.838 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 96.3 mt-30 -63.77 -37.46 87.46 Favored 'General case' 0 CA--C 1.545 0.777 0 CA-C-N 114.815 -1.084 . . . . 74.3 110.904 179.716 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 27' ' ' ARG . . . . . 0.412 ' NH1' ' HB3' ' A' ' 23' ' ' GLU . 78.2 mtt180 -87.97 3.78 47.41 Favored 'General case' 0 N--CA 1.482 1.152 0 C-N-CA 123.793 0.837 . . . . 74.2 112.793 -178.222 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 83.97 12.12 77.57 Favored Glycine 0 C--N 1.351 1.405 0 N-CA-C 115.06 0.784 . . . . 75.42 115.06 171.876 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 29' ' ' GLU . . . . . 0.433 ' HB2' ' HB3' ' A' ' 24' ' ' LEU . 14.3 mm-40 -91.02 50.71 1.82 Allowed 'General case' 0 CA--C 1.55 0.977 0 C-N-CA 124.649 1.18 . . . . 70.44 110.464 176.053 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 30' ' ' TRP . . . . . 0.602 ' HA ' HD13 ' A' ' 33' ' ' LEU . 75.3 m95 -64.55 -26.67 68.52 Favored 'General case' 0 N--CA 1.485 1.295 0 C-N-CA 123.204 0.601 . . . . 75.13 111.005 -178.257 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 8.8 m-20 -57.03 -42.81 81.13 Favored 'General case' 0 N--CA 1.478 0.927 0 C-N-CA 123.274 0.63 . . . . 63.22 110.393 172.98 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 0.448 HD12 HD22 ' A' ' 24' ' ' LEU . 76.1 mt -72.08 -18.93 61.89 Favored 'General case' 0 CA--C 1.547 0.839 0 CA-C-N 116.237 -0.438 . . . . 72.42 111.354 -178.882 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 33' ' ' LEU . . . . . 0.714 ' HA ' HD22 ' A' ' 21' ' ' LEU . 10.2 mp -69.37 -46.95 65.73 Favored 'General case' 0 N--CA 1.485 1.307 0 N-CA-C 109.254 -0.647 . . . . 65.53 109.254 167.317 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 59.8 mt -61.41 -38.68 87.97 Favored 'General case' 0 N--CA 1.483 1.212 0 O-C-N 123.99 0.807 . . . . 74.21 111.306 179.291 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -69.05 -45.27 70.83 Favored 'General case' 0 N--CA 1.481 1.116 0 C-N-CA 123.955 0.902 . . . . 75.32 111.34 -179.996 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 36' ' ' GLN . . . . . 0.485 ' HB2' HD21 ' A' ' 21' ' ' LEU . 87.1 mm-40 -81.42 -15.35 55.4 Favored 'General case' 0 N--CA 1.487 1.423 0 C-N-CA 122.791 0.436 . . . . 63.14 111.634 -178.282 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 37' ' ' GLU . . . . . 0.416 ' O ' ' HG ' ' A' ' 41' ' ' LEU . 24.1 tt0 -45.81 -65.97 0.47 Allowed 'General case' 0 N--CA 1.48 1.048 0 C-N-CA 124.849 1.259 . . . . 72.25 113.282 -176.559 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 48.9 t -61.62 -35.44 67.22 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.087 0 C-N-CA 123.682 0.793 . . . . 54.13 111.104 -170.472 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 49.1 m -65.57 -49.29 69.38 Favored 'General case' 0 CA--C 1.54 0.563 0 C-N-CA 123.788 0.835 . . . . 74.23 110.729 176.573 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 38.0 t80 -60.99 -40.51 93.74 Favored 'General case' 0 N--CA 1.48 1.032 0 C-N-CA 124.203 1.001 . . . . 74.14 110.982 -178.862 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 41' ' ' LEU . . . . . 0.672 ' HB3' HD21 ' A' ' 92' ' ' LEU . 69.7 mt -70.14 -48.31 57.96 Favored 'General case' 0 C--O 1.252 1.185 0 O-C-N 124.613 1.195 . . . . 75.4 111.761 -175.292 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 46.6 tt0 -63.27 -39.48 94.7 Favored 'General case' 0 CA--C 1.551 1.015 0 CA-C-N 115.592 -0.731 . . . . 72.45 109.831 177.644 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 43' ' ' SER . . . . . 0.561 ' O ' HG23 ' A' ' 47' ' ' VAL . 67.2 m -61.96 -56.39 19.61 Favored 'General case' 0 C--N 1.356 0.862 0 C-N-CA 123.28 0.632 . . . . 51.54 111.022 178.27 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 44' ' ' ILE . . . . . 0.441 HG13 HD13 ' A' ' 14' ' ' ILE . 11.5 tt -58.04 -42.16 82.18 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.36 0 C-N-CA 123.729 0.812 . . . . 52.04 110.977 -173.756 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 72.1 mm-40 -60.81 -48.45 81.75 Favored 'General case' 0 C--N 1.362 1.151 0 O-C-N 123.492 0.495 . . . . 54.33 111.272 175.174 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 66.9 m -57.06 -39.12 74.29 Favored 'General case' 0 N--CA 1.489 1.515 0 C-N-CA 122.991 0.516 . . . . 75.34 111.895 178.971 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 47' ' ' VAL . . . . . 0.587 HG22 ' HB3' ' A' ' 10' ' ' ARG . 43.3 t -65.98 -44.75 92.16 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.173 0 C-N-CA 123.302 0.641 . . . . 45.54 110.377 -178.479 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 48' ' ' MET . . . . . 0.562 ' SD ' ' HB2' ' A' ' 101' ' ' SER . 75.2 mtm -69.75 -27.23 64.77 Favored 'General case' 0 N--CA 1.485 1.276 0 CA-C-N 116.093 -0.503 . . . . 70.1 111.8 179.221 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 38.5 mt-10 -71.22 -24.47 62.21 Favored 'General case' 0 N--CA 1.481 1.107 0 C-N-CA 123.037 0.535 . . . . 74.2 111.319 173.868 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -87.04 142.5 27.89 Favored 'General case' 0 N--CA 1.478 0.974 0 C-N-CA 123.203 0.601 . . . . 73.43 110.28 -178.944 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 8.8 tt0 -85.56 158.52 20.11 Favored 'General case' 0 N--CA 1.474 0.755 0 C-N-CA 123.761 0.824 . . . . 72.12 110.017 -178.921 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 52' ' ' THR . . . . . 0.451 ' OG1' ' HB3' ' A' ' 114' ' ' LEU . 22.0 m -78.36 129.87 73.52 Favored Pre-proline 0 CA--C 1.546 0.823 0 C-N-CA 123.119 0.567 . . . . 72.13 110.263 175.514 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 53' ' ' PRO . . . . . 0.51 ' HG3' ' HA ' ' A' ' 4' ' ' THR . 56.8 Cg_endo -67.01 157.88 59.56 Favored 'Trans proline' 0 C--N 1.376 2.022 0 C-N-CA 123.2 2.6 . . . . 54.31 112.652 177.754 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 38.8 Cg_endo -65.49 -45.54 6.83 Favored 'Trans proline' 0 C--N 1.375 1.948 0 C-N-CA 122.843 2.362 . . . . 72.2 112.75 176.397 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . -69.2 78.8 0.3 Allowed Glycine 0 C--N 1.359 1.843 0 O-C-N 123.765 0.666 . . . . 63.51 114.054 -175.488 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 23.8 mm -117.91 136.39 55.26 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.575 0 C-N-CA 124.752 1.221 . . . . 71.44 108.337 178.444 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 72.2 p -106.66 179.12 4.36 Favored 'General case' 0 N--CA 1.473 0.717 0 N-CA-C 108.537 -0.912 . . . . 50.21 108.537 168.121 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 29.8 tpt180 -65.96 -43.36 88.16 Favored 'General case' 0 CA--C 1.54 0.588 0 N-CA-C 109.819 -0.437 . . . . 72.24 109.819 174.549 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 71.4 p -62.64 -42.45 99.61 Favored 'General case' 0 CA--C 1.545 0.762 0 C-N-CA 123.5 0.72 . . . . 71.4 110.934 -179.544 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 60' ' ' ILE . . . . . 0.515 HD13 HG21 ' A' ' 4' ' ' THR . 93.9 mt -59.81 -45.65 94.56 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.019 0 C-N-CA 123.806 0.842 . . . . 61.1 110.513 173.762 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 64.5 tt0 -59.91 -37.39 79.28 Favored 'General case' 0 N--CA 1.478 0.932 0 C-N-CA 123.875 0.87 . . . . 74.24 111.104 179.657 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 70.5 m-20 -71.21 -39.44 71.74 Favored 'General case' 0 N--CA 1.481 1.112 0 C-N-CA 123.383 0.673 . . . . 61.11 111.02 179.085 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 63' ' ' MET . . . . . . . . . . . . . 71.0 mtm -71.31 -41.58 69.72 Favored 'General case' 0 N--CA 1.481 1.099 0 C-N-CA 122.923 0.489 . . . . 54.44 111.649 -178.997 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 64' ' ' VAL . . . . . 0.456 ' O ' HG13 ' A' ' 68' ' ' ILE . 85.8 t -67.9 -55.69 15.8 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.755 0 N-CA-C 109.531 -0.544 . . . . 54.01 109.531 179.497 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 65' ' ' ALA . . . . . 0.594 ' HB2' HD23 ' A' ' 109' ' ' LEU . . . -63.07 -28.38 70.04 Favored 'General case' 0 N--CA 1.488 1.472 0 O-C-N 123.351 0.407 . . . . 54.01 110.849 178.594 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -67.02 -40.79 93.32 Favored Glycine 0 C--N 1.35 1.345 0 O-C-N 123.562 0.539 . . . . 53.22 112.519 175.531 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 16.6 m-30 -72.54 -38.82 67.91 Favored 'General case' 0 N--CA 1.48 1.074 0 C-N-CA 123.328 0.651 . . . . 65.53 110.988 178.189 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 68' ' ' ILE . . . . . 0.558 ' O ' ' HG ' ' A' ' 72' ' ' LEU . 78.3 mt -57.96 -50.43 77.93 Favored 'Isoleucine or valine' 0 C--N 1.353 0.736 0 O-C-N 124.575 1.172 . . . . 41.31 108.361 173.783 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 69' ' ' LYS . . . . . 0.597 ' HB2' ' HE2' ' A' ' 106' ' ' TYR . 0.7 OUTLIER -57.83 -49.07 77.92 Favored 'General case' 0 C--N 1.353 0.757 0 C-N-CA 123.886 0.874 . . . . 73.14 110.673 -178.847 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 58.9 tt0 -58.25 -44.88 88.53 Favored 'General case' 0 N--CA 1.471 0.593 0 O-C-N 124.705 1.253 . . . . 75.51 110.784 -176.984 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 71' ' ' THR . . . . . 0.569 ' HB ' ' HA ' ' A' ' 15' ' ' ALA . 12.8 t -76.93 -22.43 53.31 Favored 'General case' 0 C--O 1.21 -0.999 0 CA-C-O 118.846 -0.597 . . . . 73.31 110.344 -177.965 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 72' ' ' LEU . . . . . 0.731 HD21 ' HB3' ' A' ' 102' ' ' LEU . 40.5 mt -72.23 -32.98 67.21 Favored 'General case' 0 N--CA 1.49 1.57 0 CA-C-N 118.136 0.426 . . . . 75.5 110.789 173.5 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 38.8 m-20 -64.13 -49.87 70.47 Favored 'General case' 0 N--CA 1.477 0.91 0 N-CA-C 108.542 -0.91 . . . . 61.31 108.542 172.071 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 70.5 m-20 -62.28 -37.08 84.12 Favored 'General case' 0 N--CA 1.478 0.964 0 CA-C-N 115.037 -0.983 . . . . 71.3 111.566 179.96 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 75' ' ' GLU . . . . . 0.435 ' HG2' ' O ' ' A' ' 71' ' ' THR . 17.2 mm-40 -66.47 -51.62 54.89 Favored 'General case' 0 N--CA 1.481 1.094 0 C-N-CA 123.316 0.646 . . . . 54.35 110.275 178.667 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 9.1 tt0 -58.09 -48.85 78.9 Favored 'General case' 0 N--CA 1.475 0.818 0 O-C-N 123.492 0.495 . . . . 75.3 110.807 -177.778 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 96.8 mt -63.63 -57.13 11.03 Favored 'General case' 0 N--CA 1.471 0.625 0 O-C-N 123.975 0.797 . . . . 73.52 111.043 -176.959 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 78' ' ' LEU . . . . . 0.721 HD21 ' HA ' ' A' ' 22' ' ' LEU . 82.4 mt -63.54 -66.47 0.54 Allowed 'General case' 0 N--CA 1.481 1.107 0 O-C-N 123.553 0.533 . . . . 73.41 111.785 -178.514 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 33.0 mmtp -59.54 -35.15 73.66 Favored 'General case' 0 N--CA 1.475 0.793 0 O-C-N 124.219 0.95 . . . . 71.22 110.928 -173.808 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -66.69 -40.26 93.91 Favored Glycine 0 C--N 1.355 1.606 0 O-C-N 123.526 0.516 . . . . 71.41 113.019 175.069 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 8.2 tt -66.21 -36.96 84.42 Favored 'General case' 0 N--CA 1.485 1.322 0 C-N-CA 123.465 0.706 . . . . 75.24 109.737 177.092 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 95.1 mt . . . . . 0 N--CA 1.473 0.71 0 C-N-CA 123.955 0.902 . . . . 73.31 111.328 -175.516 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 92' ' ' LEU . . . . . 0.672 HD21 ' HB3' ' A' ' 41' ' ' LEU . 94.7 mt . . . . . 0 CA--C 1.537 0.463 0 CA-C-O 120.6 0.238 . . . . 63.44 110.607 . . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 42.6 mt -124.46 65.87 0.3 Allowed 'Isoleucine or valine' 0 CA--C 1.546 0.811 0 N-CA-C 107.537 -1.282 . . . . 71.24 107.537 172.621 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 48.39 -87.53 0.01 OUTLIER Glycine 0 C--N 1.363 2.081 0 CA-C-N 114.219 -1.355 . . . . 65.24 115.157 172.322 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 5.8 pm0 -66.49 -173.52 0.22 Allowed 'General case' 0 N--CA 1.477 0.878 0 C-N-CA 124.564 1.145 . . . . 74.1 111.461 178.628 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 44.5 m -80.42 38.57 0.43 Allowed 'General case' 0 CA--C 1.545 0.78 0 N-CA-C 113.289 0.848 . . . . 60.31 113.289 -173.037 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 39.1 m -49.48 -61.12 2.28 Favored 'General case' 0 N--CA 1.48 1.026 0 C-N-CA 124.014 0.926 . . . . 64.42 110.828 173.028 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 98' ' ' ARG . . . . . 0.642 ' HD2' ' HB2' ' A' ' 92' ' ' LEU . 0.0 OUTLIER -47.62 -56.07 7.99 Favored 'General case' 0 CA--C 1.552 1.036 0 C-N-CA 125.955 1.702 . . . . 74.42 113.533 178.306 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 31.0 mm-40 -66.28 -43.65 85.78 Favored 'General case' 0 N--CA 1.482 1.157 0 C-N-CA 122.968 0.507 . . . . 74.52 111.068 -175.375 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 13.8 tmtt? -63.36 -38.13 89.97 Favored 'General case' 0 C--O 1.217 -0.629 0 CA-C-N 114.897 -1.047 . . . . 74.02 110.638 178.579 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 101' ' ' SER . . . . . 0.562 ' HB2' ' SD ' ' A' ' 48' ' ' MET . 73.1 m -78.33 -32.15 49.06 Favored 'General case' 0 N--CA 1.479 0.981 0 C-N-CA 123.08 0.552 . . . . 74.11 112.076 -172.9 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 102' ' ' LEU . . . . . 0.731 ' HB3' HD21 ' A' ' 72' ' ' LEU . 10.0 mp -71.29 -43.3 67.41 Favored 'General case' 0 N--CA 1.483 1.184 0 N-CA-C 110.074 -0.343 . . . . 62.11 110.074 172.561 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 8.9 t30 -64.08 -41.01 97.47 Favored 'General case' 0 N--CA 1.481 1.079 0 CA-C-O 121.159 0.504 . . . . 75.23 110.507 176.625 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 7.2 t30 -64.05 -39.3 93.77 Favored 'General case' 0 N--CA 1.478 0.958 0 C-N-CA 124.397 1.079 . . . . 75.22 109.469 176.54 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -59.41 -48.39 81.82 Favored 'General case' 0 C--N 1.347 0.467 0 O-C-N 124.049 0.843 . . . . 74.32 110.444 178.598 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 106' ' ' TYR . . . . . 0.597 ' HE2' ' HB2' ' A' ' 69' ' ' LYS . 20.0 t80 -59.47 -56.32 23.44 Favored 'General case' 0 CA--C 1.55 0.957 0 O-C-N 123.867 0.73 . . . . 73.1 111.074 179.8 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -69.0 -41.01 83.62 Favored Glycine 0 C--N 1.347 1.194 0 O-C-N 123.989 0.805 . . . . 70.34 113.302 -171.272 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 5.5 mmp_? -68.91 -33.91 74.53 Favored 'General case' 0 C--N 1.349 0.578 0 CA-C-O 119.258 -0.401 . . . . 65.2 110.455 177.42 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 109' ' ' LEU . . . . . 0.594 HD23 ' HB2' ' A' ' 65' ' ' ALA . 47.3 tp -61.56 -44.8 96.37 Favored 'General case' 0 N--CA 1.482 1.162 0 CA-C-O 120.888 0.375 . . . . 61.0 110.301 175.388 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 10.9 t -69.58 -34.28 73.91 Favored 'General case' 0 CA--C 1.554 1.127 0 CA-C-N 114.749 -1.114 . . . . 51.2 110.938 -179.043 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . -91.2 -63.27 1.19 Allowed Glycine 0 C--N 1.357 1.735 0 N-CA-C 114.454 0.542 . . . . 63.24 114.454 -177.649 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 112' ' ' MET . . . . . . . . . . . . . 3.8 mmm -93.13 -68.92 0.77 Allowed 'General case' 0 N--CA 1.489 1.481 0 CA-C-N 117.454 0.627 . . . . 72.31 112.021 -178.578 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 23.8 tp 174.01 13.41 0.0 OUTLIER 'General case' 0 N--CA 1.492 1.635 0 C-N-CA 125.172 1.389 . . . . 61.32 110.018 178.28 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 114' ' ' LEU . . . . . 0.451 ' HB3' ' OG1' ' A' ' 52' ' ' THR . 2.5 tt . . . . . 0 N--CA 1.5 2.063 0 C-N-CA 126.683 1.993 . . . . 52.15 109.842 -170.321 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 1' ' ' MET . . . . . 0.45 ' HG3' HG23 ' A' ' 5' ' ' VAL . 16.7 ptt? . . . . . 0 N--CA 1.486 1.329 0 CA-C-O 120.683 0.278 . . . . 72.1 110.65 . . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 9.2 t -54.6 -40.32 68.74 Favored 'General case' 0 N--CA 1.483 1.216 0 C-N-CA 123.353 0.661 . . . . 74.22 112.725 -172.766 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 17.2 m -72.46 -32.42 66.23 Favored 'General case' 0 N--CA 1.479 1.019 0 C-N-CA 123.247 0.619 . . . . 73.03 111.4 -178.758 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 52.5 m -74.57 -39.11 62.45 Favored 'General case' 0 C--O 1.217 -0.64 0 C-N-CA 123.07 0.548 . . . . 53.41 110.295 178.233 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 5' ' ' VAL . . . . . 0.45 HG23 ' HG3' ' A' ' 1' ' ' MET . 90.2 t -63.77 -40.48 89.2 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.905 0 C-N-CA 123.309 0.644 . . . . 64.04 109.297 176.581 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 33.9 mm-40 -57.1 -51.98 67.11 Favored 'General case' 0 N--CA 1.473 0.685 0 O-C-N 123.939 0.774 . . . . 63.34 110.625 171.228 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 42.6 t80 -61.88 -43.86 97.99 Favored 'General case' 0 CA--C 1.552 1.027 0 C-N-CA 124.106 0.962 . . . . 74.22 111.337 -173.464 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 8' ' ' ILE . . . . . 0.445 HD11 HG23 ' A' ' 60' ' ' ILE . 77.5 mt -63.84 -45.19 97.76 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.873 0 C-N-CA 123.772 0.829 . . . . 64.01 109.357 176.473 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 28.5 t-20 -67.09 -27.41 67.33 Favored 'General case' 0 N--CA 1.479 0.991 0 C-N-CA 123.834 0.854 . . . . 75.35 111.54 -177.25 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 10' ' ' ARG . . . . . 0.536 ' HB3' HG22 ' A' ' 47' ' ' VAL . 50.8 mtt180 -81.46 -28.02 34.34 Favored 'General case' 0 CA--C 1.543 0.684 0 C-N-CA 123.394 0.678 . . . . 74.24 110.191 176.477 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 11' ' ' TRP . . . . . . . . . . . . . 61.2 m95 -74.53 -28.21 60.87 Favored 'General case' 0 N--CA 1.474 0.774 0 CA-C-O 119.313 -0.375 . . . . 73.25 110.828 167.663 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 12' ' ' GLN . . . . . 0.49 ' HG2' ' CE2' ' A' ' 67' ' ' TYR . 41.1 mt-30 -67.52 -38.79 84.76 Favored 'General case' 0 C--N 1.358 0.956 0 N-CA-C 108.064 -1.087 . . . . 62.31 108.064 170.165 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 32.2 tpt180 -57.1 -55.54 33.38 Favored 'General case' 0 CA--C 1.542 0.643 0 CA-C-N 115.328 -0.851 . . . . 73.43 109.984 179.753 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 14' ' ' ILE . . . . . 0.431 HG22 ' OG1' ' A' ' 71' ' ' THR . 19.1 mt -64.81 -45.97 93.41 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.357 0 O-C-N 122.938 0.148 . . . . 73.25 111.001 179.806 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 15' ' ' ALA . . . . . 0.601 ' HA ' ' HB ' ' A' ' 71' ' ' THR . . . -58.05 -48.52 79.84 Favored 'General case' 0 N--CA 1.487 1.399 0 C-N-CA 124.406 1.082 . . . . 64.31 112.154 -176.426 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 87.0 mt -78.64 -37.44 42.09 Favored 'General case' 0 N--CA 1.48 1.051 0 CA-C-N 114.902 -1.045 . . . . 73.53 110.903 -173.085 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.508 ' O ' ' HG ' ' A' ' 21' ' ' LEU . 59.0 mt -62.46 -48.1 81.12 Favored 'General case' 0 N--CA 1.479 0.976 0 O-C-N 123.344 0.403 . . . . 70.34 110.461 176.816 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 78.5 p -64.63 -38.34 90.68 Favored 'General case' 0 N--CA 1.475 0.808 0 C-N-CA 123.01 0.524 . . . . 62.55 111.125 -179.804 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 7.0 tp-100 -60.83 -42.33 97.52 Favored 'General case' 0 C--N 1.354 0.782 0 O-C-N 123.704 0.628 . . . . 64.14 110.625 175.207 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 48.6 m -60.89 -48.77 80.31 Favored 'General case' 0 C--N 1.346 0.441 0 O-C-N 123.391 0.432 . . . . 65.33 110.071 175.611 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 21' ' ' LEU . . . . . 0.549 HD22 ' HA ' ' A' ' 33' ' ' LEU . 59.2 mt -64.8 -26.91 68.55 Favored 'General case' 0 N--CA 1.471 0.624 0 C-N-CA 123.62 0.768 . . . . 71.41 110.836 -178.114 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 22' ' ' LEU . . . . . 0.636 ' HA ' HD21 ' A' ' 78' ' ' LEU . 46.0 tp -68.07 -58.35 4.64 Favored 'General case' 0 C--N 1.35 0.599 0 C-N-CA 123.376 0.67 . . . . 71.43 109.564 176.767 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 41.0 mt-10 -53.91 -46.03 71.34 Favored 'General case' 0 N--CA 1.48 1.031 0 C-N-CA 124.147 0.979 . . . . 75.24 111.073 -179.955 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 24' ' ' LEU . . . . . 0.5 ' HB3' ' HB2' ' A' ' 29' ' ' GLU . 96.0 mt -67.08 -46.89 72.9 Favored 'General case' 0 CA--C 1.538 0.511 0 CA-C-N 114.661 -1.154 . . . . 43.53 111.455 -176.623 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 25' ' ' ALA . . . . . 0.435 ' HB2' HD21 ' A' ' 33' ' ' LEU . . . -64.16 -34.25 77.65 Favored 'General case' 0 N--CA 1.484 1.25 0 CA-C-N 117.971 0.351 . . . . 63.11 111.501 -179.555 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 98.0 mt-30 -63.65 -38.43 91.09 Favored 'General case' 0 N--CA 1.482 1.143 0 C-N-CA 123.333 0.653 . . . . 64.5 110.61 173.681 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 97.2 mtt180 -75.78 -17.39 59.89 Favored 'General case' 0 N--CA 1.483 1.197 0 C-N-CA 123.161 0.584 . . . . 70.21 111.868 174.775 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 92.3 20.79 34.31 Favored Glycine 0 C--N 1.346 1.127 0 N-CA-C 112.727 -0.149 . . . . 10.3 112.727 179.078 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 29' ' ' GLU . . . . . 0.5 ' HB2' ' HB3' ' A' ' 24' ' ' LEU . 49.3 mm-40 -84.54 68.77 10.44 Favored 'General case' 0 C--O 1.238 0.452 0 C-N-CA 124.312 1.045 . . . . 74.42 110.871 -179.775 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 30' ' ' TRP . . . . . . . . . . . . . 24.8 m95 -63.68 -42.18 98.07 Favored 'General case' 0 N--CA 1.475 0.788 0 CA-C-N 115.114 -0.948 . . . . 74.21 111.097 -176.134 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 9.8 m-20 -60.62 -41.68 95.33 Favored 'General case' 0 N--CA 1.478 0.971 0 C-N-CA 123.48 0.712 . . . . 74.22 110.893 -178.813 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 72.6 mt -64.47 -37.03 86.11 Favored 'General case' 0 N--CA 1.478 0.941 0 O-C-N 123.61 0.569 . . . . 62.34 111.211 -178.907 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 33' ' ' LEU . . . . . 0.549 ' HA ' HD22 ' A' ' 21' ' ' LEU . 10.7 mp -61.74 -46.92 87.54 Favored 'General case' 0 N--CA 1.486 1.325 0 CA-C-O 120.719 0.295 . . . . 74.12 110.24 172.365 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 91.2 mt -67.66 -26.97 66.47 Favored 'General case' 0 CA--C 1.549 0.915 0 C-N-CA 123.482 0.713 . . . . 64.4 112.18 -177.227 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 53.0 mt-30 -77.96 -36.78 48.72 Favored 'General case' 0 N--CA 1.48 1.035 0 C-N-CA 123.304 0.642 . . . . 74.13 110.619 176.705 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 30.9 mm-40 -82.79 -15.24 52.47 Favored 'General case' 0 N--CA 1.483 1.188 0 C-N-CA 123.09 0.556 . . . . 70.21 111.532 177.931 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 37' ' ' GLU . . . . . 0.428 ' O ' ' HG ' ' A' ' 41' ' ' LEU . 31.8 tt0 -45.49 -57.47 4.1 Favored 'General case' 0 N--CA 1.481 1.086 0 C-N-CA 124.681 1.192 . . . . 73.51 112.972 -174.823 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 46.1 t -58.04 -39.88 74.31 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.143 0 C-N-CA 123.344 0.658 . . . . 74.55 111.378 -175.514 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 74.3 m -68.38 -43.7 76.78 Favored 'General case' 0 N--CA 1.474 0.739 0 C-N-CA 123.097 0.559 . . . . 72.13 111.272 179.189 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 40' ' ' TYR . . . . . 0.408 ' O ' HG22 ' A' ' 44' ' ' ILE . 34.9 t80 -64.96 -47.51 77.36 Favored 'General case' 0 N--CA 1.471 0.61 0 O-C-N 123.824 0.703 . . . . 71.1 110.059 -177.128 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 41' ' ' LEU . . . . . 0.428 ' HG ' ' O ' ' A' ' 37' ' ' GLU . 57.8 mt -59.81 -50.53 73.46 Favored 'General case' 0 C--N 1.351 0.667 0 O-C-N 124.636 1.21 . . . . 73.24 110.082 178.952 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 53.4 tt0 -60.22 -41.72 93.69 Favored 'General case' 0 N--CA 1.476 0.87 0 O-C-N 123.637 0.585 . . . . 72.34 111.497 -178.442 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 43' ' ' SER . . . . . 0.487 ' O ' HG23 ' A' ' 47' ' ' VAL . 70.2 m -60.85 -60.38 3.88 Favored 'General case' 0 N--CA 1.471 0.591 0 C-N-CA 123.169 0.588 . . . . 75.31 110.641 -179.102 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 44' ' ' ILE . . . . . 0.458 HG12 ' HE2' ' A' ' 48' ' ' MET . 16.3 tt -63.37 -30.33 49.5 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.977 0 O-C-N 123.808 0.692 . . . . 72.42 111.321 -175.57 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 9.6 mm-40 -59.38 -55.12 38.7 Favored 'General case' 0 N--CA 1.481 1.103 0 C-N-CA 123.301 0.64 . . . . 65.41 110.796 171.226 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 46' ' ' THR . . . . . 0.411 ' O ' ' HB2' ' A' ' 50' ' ' LYS . 19.9 m -67.18 -23.8 65.8 Favored 'General case' 0 CA--C 1.55 0.967 0 CA-C-N 115.656 -0.702 . . . . 71.11 111.652 -174.369 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 47' ' ' VAL . . . . . 0.536 HG22 ' HB3' ' A' ' 10' ' ' ARG . 40.4 t -83.28 -35.82 12.2 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.086 0 C-N-CA 122.618 0.367 . . . . 72.33 111.143 176.532 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 48' ' ' MET . . . . . 0.458 ' HE2' HG12 ' A' ' 44' ' ' ILE . 74.6 mtm -70.13 -34.93 73.69 Favored 'General case' 0 N--CA 1.49 1.567 0 C-N-CA 122.504 0.321 . . . . 54.52 111.476 179.398 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 10.9 pt-20 -78.01 -22.53 49.16 Favored 'General case' 0 N--CA 1.478 0.964 0 C-N-CA 122.347 0.259 . . . . 74.22 110.443 175.776 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 50' ' ' LYS . . . . . 0.411 ' HB2' ' O ' ' A' ' 46' ' ' THR . 15.0 tppt? -69.21 133.77 48.39 Favored 'General case' 0 N--CA 1.473 0.686 0 C-N-CA 123.61 0.764 . . . . 74.04 111.117 -174.207 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 49.9 tt0 -83.72 128.41 34.51 Favored 'General case' 0 C--O 1.239 0.535 0 N-CA-C 108.886 -0.783 . . . . 71.14 108.886 174.757 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 17.1 m -70.36 134.29 86.95 Favored Pre-proline 0 CA--C 1.551 0.99 0 C-N-CA 124.058 0.943 . . . . 62.45 110.658 178.995 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 24.2 Cg_exo -66.5 152.52 80.65 Favored 'Trans proline' 0 C--N 1.378 2.089 0 C-N-CA 121.908 1.739 . . . . 74.55 111.961 171.954 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 21.3 Cg_exo -67.36 -46.78 2.61 Favored 'Trans proline' 0 C--N 1.372 1.809 0 C-N-CA 122.998 2.465 . . . . 64.11 111.685 173.354 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . -66.22 81.28 0.1 Allowed Glycine 0 C--N 1.351 1.396 0 O-C-N 124.112 0.882 . . . . 61.01 113.455 -178.651 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 56' ' ' ILE . . . . . 0.553 ' HB ' HD11 ' A' ' 113' ' ' LEU . 6.9 mt -137.87 117.6 15.37 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.515 0 C-N-CA 125.54 1.536 . . . . 75.12 107.702 178.325 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 57' ' ' THR . . . . . 0.499 ' H ' HD12 ' A' ' 60' ' ' ILE . 47.4 p -78.01 -178.26 5.44 Favored 'General case' 0 N--CA 1.473 0.682 0 C-N-CA 123.863 0.865 . . . . 71.45 110.482 -179.271 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 28.4 tpt180 -65.19 -45.17 85.88 Favored 'General case' 0 CA--C 1.542 0.644 0 CA-C-N 116.248 -0.433 . . . . 71.44 110.019 174.881 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 40.3 m -58.53 -42.46 87.82 Favored 'General case' 0 N--CA 1.485 1.276 0 CA-C-O 121.405 0.621 . . . . 71.52 111.096 179.732 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 60' ' ' ILE . . . . . 0.499 HD12 ' H ' ' A' ' 57' ' ' THR . 83.7 mt -66.68 -41.19 87.73 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.522 0 CA-C-N 115.073 -0.967 . . . . 62.04 110.104 178.25 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 58.9 tt0 -62.17 -36.22 81.19 Favored 'General case' 0 CA--C 1.547 0.844 0 C-N-CA 123.393 0.677 . . . . 73.44 110.43 177.332 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 65.9 m-20 -66.05 -46.55 77.39 Favored 'General case' 0 N--CA 1.48 1.057 0 C-N-CA 123.288 0.635 . . . . 65.41 110.764 178.518 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 63' ' ' MET . . . . . . . . . . . . . 71.1 mtm -65.74 -51.9 55.5 Favored 'General case' 0 N--CA 1.482 1.175 0 O-C-N 123.557 0.536 . . . . 43.41 111.16 -179.007 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 64' ' ' VAL . . . . . 0.516 ' O ' HG13 ' A' ' 68' ' ' ILE . 77.1 t -57.98 -56.17 17.41 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.725 0 C-N-CA 123.955 0.902 . . . . 64.32 110.809 179.997 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 65' ' ' ALA . . . . . 0.482 ' HB2' HD23 ' A' ' 109' ' ' LEU . . . -59.14 -42.2 90.13 Favored 'General case' 0 N--CA 1.487 1.41 0 C-N-CA 123.05 0.54 . . . . 33.52 110.767 179.837 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -56.34 -42.69 89.36 Favored Glycine 0 C--N 1.344 1.026 0 O-C-N 124.153 0.908 . . . . 34.02 112.12 176.814 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 67' ' ' TYR . . . . . 0.49 ' CE2' ' HG2' ' A' ' 12' ' ' GLN . 16.7 m-30 -70.7 -37.79 73.6 Favored 'General case' 0 N--CA 1.478 0.945 0 C-N-CA 123.847 0.859 . . . . 75.03 111.946 179.09 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 68' ' ' ILE . . . . . 0.516 HG13 ' O ' ' A' ' 64' ' ' VAL . 64.7 mt -58.44 -58.88 4.69 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.027 0 O-C-N 124.169 0.918 . . . . 75.34 108.851 179.185 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 69' ' ' LYS . . . . . 0.482 ' HB2' ' HE2' ' A' ' 106' ' ' TYR . 20.1 ttpp -60.63 -41.12 94.23 Favored 'General case' 0 C--N 1.347 0.462 0 O-C-N 124.151 0.907 . . . . 61.42 110.243 -179.143 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 62.3 tt0 -57.02 -47.98 79.59 Favored 'General case' 0 N--CA 1.478 0.95 0 C-N-CA 123.538 0.735 . . . . 71.21 111.406 -178.788 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 71' ' ' THR . . . . . 0.601 ' HB ' ' HA ' ' A' ' 15' ' ' ALA . 9.1 t -77.64 -25.47 49.7 Favored 'General case' 0 C--N 1.351 0.647 0 N-CA-C 110.07 -0.345 . . . . 73.53 110.07 -175.469 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 72' ' ' LEU . . . . . 0.475 ' HG ' ' O ' ' A' ' 68' ' ' ILE . 37.5 mt -67.75 -38.8 83.95 Favored 'General case' 0 C--O 1.209 -1.07 0 O-C-N 123.507 0.504 . . . . 74.21 110.107 171.026 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 75.2 m-20 -73.62 -41.22 63.08 Favored 'General case' 0 N--CA 1.484 1.234 0 C-N-CA 123.53 0.732 . . . . 65.22 110.995 -178.544 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 74' ' ' ASN . . . . . 0.437 ' HA ' HD22 ' A' ' 22' ' ' LEU . 86.4 m-20 -61.79 -52.11 65.55 Favored 'General case' 0 N--CA 1.475 0.804 0 O-C-N 123.911 0.757 . . . . 63.33 109.558 178.491 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 75' ' ' GLU . . . . . 0.421 ' O ' ' HG2' ' A' ' 79' ' ' LYS . 17.3 tt0 -76.58 -19.22 58.11 Favored 'General case' 0 CA--C 1.552 1.042 0 CA-C-N 115.642 -0.708 . . . . 73.22 111.688 -178.101 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 59.7 tt0 -68.65 -46.74 68.37 Favored 'General case' 0 N--CA 1.488 1.448 0 N-CA-C 109.547 -0.538 . . . . 75.05 109.547 173.6 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 92.3 mt -61.26 -38.87 88.26 Favored 'General case' 0 C--N 1.346 0.449 0 CA-C-N 115.661 -0.699 . . . . 60.2 109.623 174.449 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 78' ' ' LEU . . . . . 0.636 HD21 ' HA ' ' A' ' 22' ' ' LEU . 50.3 mt -59.07 -42.64 90.87 Favored 'General case' 0 C--N 1.358 0.962 0 O-C-N 123.92 0.762 . . . . 75.12 111.833 172.805 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 79' ' ' LYS . . . . . 0.421 ' HG2' ' O ' ' A' ' 75' ' ' GLU . 28.9 mmtm -57.08 -47.15 81.71 Favored 'General case' 0 N--CA 1.482 1.135 0 N-CA-C 109.735 -0.469 . . . . 74.02 109.735 176.608 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -67.6 -28.75 73.56 Favored Glycine 0 C--N 1.344 0.998 0 O-C-N 124.518 1.136 . . . . 40.35 114.17 178.754 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 5.8 tt -85.43 -39.56 17.4 Favored 'General case' 0 N--CA 1.478 0.925 0 C-N-CA 124.309 1.044 . . . . 72.51 110.528 -173.279 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 67.5 mt . . . . . 0 CA--C 1.548 0.885 0 C-N-CA 123.704 0.801 . . . . 72.24 111.265 -169.847 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 92' ' ' LEU . . . . . 0.473 HD12 ' HG2' ' A' ' 98' ' ' ARG . 80.7 mt . . . . . 0 N--CA 1.476 0.861 0 N-CA-C 108.492 -0.929 . . . . 52.4 108.492 . . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 28.3 mt -45.84 -43.83 4.55 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.819 0 C-N-CA 123.87 0.868 . . . . 73.54 110.535 171.629 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -171.09 158.96 30.74 Favored Glycine 0 C--O 1.252 1.225 0 CA-C-N 114.227 -1.352 . . . . 72.12 111.167 175.162 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 4.9 pm0 -55.56 127.34 29.3 Favored 'General case' 0 CA--C 1.552 1.056 0 C-N-CA 124.248 1.019 . . . . 71.34 110.126 172.224 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 20.1 t 76.52 -46.29 0.52 Allowed 'General case' 0 N--CA 1.487 1.397 0 C-N-CA 125.618 1.567 . . . . 73.43 113.824 178.126 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 6.5 t -52.4 -32.32 38.4 Favored 'General case' 0 N--CA 1.491 1.583 0 C-N-CA 123.947 0.899 . . . . 71.2 112.624 -169.163 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 98' ' ' ARG . . . . . 0.473 ' HG2' HD12 ' A' ' 92' ' ' LEU . 0.0 OUTLIER -68.12 -33.84 75.26 Favored 'General case' 0 CA--C 1.55 0.961 0 O-C-N 123.875 0.734 . . . . 75.2 112.852 -175.076 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 27.4 mt-30 -66.51 -39.65 88.79 Favored 'General case' 0 N--CA 1.481 1.118 0 N-CA-C 109.176 -0.675 . . . . 71.43 109.176 175.649 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.29 -35.69 81.04 Favored 'General case' 0 C--O 1.214 -0.779 0 CA-C-N 115.153 -0.93 . . . . 73.11 110.497 172.697 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 62.4 m -63.53 -45.12 92.06 Favored 'General case' 0 N--CA 1.479 0.987 0 C-N-CA 123.152 0.581 . . . . 71.2 111.292 -177.226 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 9.1 mp -76.17 -38.79 56.18 Favored 'General case' 0 N--CA 1.485 1.323 0 O-C-N 123.186 0.304 . . . . 75.14 111.494 179.103 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 4.4 t-20 -63.52 -40.32 96.72 Favored 'General case' 0 N--CA 1.486 1.342 0 CA-C-O 121.244 0.545 . . . . 50.52 110.684 177.374 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 26.1 t-20 -72.27 -38.77 68.76 Favored 'General case' 0 N--CA 1.471 0.584 0 CA-C-N 115.271 -0.877 . . . . 72.52 109.492 178.876 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -62.59 -31.36 72.18 Favored 'General case' 0 N--CA 1.476 0.848 0 C-N-CA 123.408 0.683 . . . . 64.31 111.079 175.863 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 106' ' ' TYR . . . . . 0.482 ' HE2' ' HB2' ' A' ' 69' ' ' LYS . 2.9 t80 -67.71 -50.56 56.85 Favored 'General case' 0 C--N 1.35 0.628 0 N-CA-C 108.921 -0.77 . . . . 72.32 108.921 175.808 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -62.86 -30.3 76.75 Favored Glycine 0 C--N 1.351 1.381 0 O-C-N 123.608 0.568 . . . . 74.51 113.107 177.377 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 1.2 mpt_? -77.14 -29.43 54.65 Favored 'General case' 0 N--CA 1.468 0.461 0 C-N-CA 123.985 0.914 . . . . 72.03 110.185 176.67 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 109' ' ' LEU . . . . . 0.492 HD13 ' HB2' ' A' ' 114' ' ' LEU . 34.6 tp -71.7 -34.92 70.03 Favored 'General case' 0 N--CA 1.479 1.018 0 N-CA-C 109.393 -0.595 . . . . 74.54 109.393 175.08 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 47.9 t -66.04 -42.93 88.93 Favored 'General case' 0 CA--C 1.54 0.578 0 CA-C-N 114.912 -1.04 . . . . 53.25 109.819 173.52 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . -90.27 -68.07 1.21 Allowed Glycine 0 C--N 1.364 2.138 0 CA-C-O 119.027 -0.874 . . . . 61.24 114.8 -175.816 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 112' ' ' MET . . . . . . . . . . . . . 2.8 tmm? -97.85 -66.33 0.91 Allowed 'General case' 0 N--CA 1.488 1.447 0 CA-C-N 118.647 1.224 . . . . 72.53 113.049 -174.078 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 113' ' ' LEU . . . . . 0.553 HD11 ' HB ' ' A' ' 56' ' ' ILE . 0.2 OUTLIER 171.39 50.29 0.0 OUTLIER 'General case' 0 N--CA 1.495 1.786 0 C-N-CA 124.324 1.049 . . . . 70.12 109.866 178.164 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 114' ' ' LEU . . . . . 0.492 ' HB2' HD13 ' A' ' 109' ' ' LEU . 6.0 tt . . . . . 0 N--CA 1.501 2.088 0 C-N-CA 126.136 1.774 . . . . 33.43 112.17 175.608 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 1' ' ' MET . . . . . 0.443 ' HG2' HG23 ' A' ' 5' ' ' VAL . 25.1 ttt . . . . . 0 CA--C 1.554 1.106 0 CA-C-O 119.738 -0.173 . . . . 62.21 110.938 . . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 39.8 p -51.29 -40.39 58.87 Favored 'General case' 0 N--CA 1.486 1.357 0 C-N-CA 123.802 0.841 . . . . 71.32 112.638 -174.643 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 79.6 p -64.88 -41.98 95.19 Favored 'General case' 0 C--N 1.357 0.895 0 O-C-N 123.456 0.472 . . . . 73.24 110.436 -178.268 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 4' ' ' THR . . . . . 0.476 ' HA ' ' HG2' ' A' ' 53' ' ' PRO . 33.5 m -67.57 -47.08 70.83 Favored 'General case' 0 C--N 1.356 0.878 0 O-C-N 123.632 0.582 . . . . 70.44 111.278 178.968 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 5' ' ' VAL . . . . . 0.443 HG23 ' HG2' ' A' ' 1' ' ' MET . 64.1 t -60.39 -43.27 93.55 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.411 0 C-N-CA 123.546 0.738 . . . . 71.2 110.708 -178.606 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 6' ' ' GLU . . . . . 0.464 ' O ' ' HG3' ' A' ' 10' ' ' ARG . 3.2 tm-20 -71.87 -34.2 69.02 Favored 'General case' 0 CA--C 1.54 0.594 0 CA-C-N 114.727 -1.124 . . . . 75.1 109.822 -178.014 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 59.4 t80 -67.72 -39.22 84.31 Favored 'General case' 0 CA--C 1.553 1.064 0 C-N-CA 123.578 0.751 . . . . 74.33 110.807 176.545 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 8' ' ' ILE . . . . . 0.41 HG13 ' O ' ' A' ' 4' ' ' THR . 87.8 mt -64.07 -39.94 87.28 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.965 0 N-CA-C 109.058 -0.719 . . . . 74.13 109.058 174.054 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 3.8 t-20 -66.63 -30.74 71.08 Favored 'General case' 0 C--N 1.354 0.779 0 O-C-N 123.919 0.762 . . . . 53.53 110.57 179.434 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 10' ' ' ARG . . . . . 0.464 ' HG3' ' O ' ' A' ' 6' ' ' GLU . 85.4 mtt180 -64.58 -46.08 84.27 Favored 'General case' 0 N--CA 1.477 0.91 0 C-N-CA 123.211 0.605 . . . . 62.31 109.745 173.349 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 11' ' ' TRP . . . . . 0.453 ' CD1' HG13 ' A' ' 64' ' ' VAL . 81.5 m95 -65.65 -31.73 72.92 Favored 'General case' 0 N--CA 1.48 1.033 0 O-C-N 123.618 0.574 . . . . 73.01 111.962 176.629 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 12' ' ' GLN . . . . . 0.429 ' HG2' ' CE2' ' A' ' 67' ' ' TYR . 55.3 mt-30 -61.6 -45.86 92.3 Favored 'General case' 0 C--N 1.354 0.776 0 N-CA-C 108.685 -0.857 . . . . 73.44 108.685 172.718 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 13' ' ' ARG . . . . . 0.438 ' NH2' ' HB3' ' A' ' 39' ' ' SER . 14.0 tpt180 -61.41 -49.41 76.97 Favored 'General case' 0 CA--C 1.545 0.788 0 O-C-N 123.832 0.708 . . . . 73.14 110.907 -178.221 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 14' ' ' ILE . . . . . 0.471 HD11 HG21 ' A' ' 47' ' ' VAL . 54.3 mt -62.75 -47.99 90.25 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.409 0 C-N-CA 122.658 0.383 . . . . 71.42 110.57 -178.785 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 15' ' ' ALA . . . . . 0.551 ' HA ' ' HB ' ' A' ' 71' ' ' THR . . . -59.07 -45.72 90.11 Favored 'General case' 0 N--CA 1.477 0.924 0 C-N-CA 124.148 0.979 . . . . 73.44 111.388 -178.249 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 94.5 mt -76.34 -34.13 58.98 Favored 'General case' 0 N--CA 1.482 1.17 0 O-C-N 124.344 1.028 . . . . 72.44 111.499 -175.885 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.474 ' O ' ' HG ' ' A' ' 21' ' ' LEU . 34.2 mt -64.09 -56.83 12.13 Favored 'General case' 0 N--CA 1.476 0.864 0 N-CA-C 109.242 -0.651 . . . . 72.04 109.242 176.868 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 69.0 p -63.03 -32.01 73.28 Favored 'General case' 0 N--CA 1.475 0.777 0 O-C-N 124.223 0.952 . . . . 54.5 111.582 -178.78 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 29.5 tp60 -59.63 -51.95 67.62 Favored 'General case' 0 N--CA 1.478 0.971 0 C-N-CA 123.662 0.785 . . . . 75.32 109.861 172.716 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 51.3 m -60.15 -41.97 93.88 Favored 'General case' 0 C--O 1.215 -0.759 0 O-C-N 124.163 0.914 . . . . 74.43 110.314 177.045 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 21' ' ' LEU . . . . . 0.572 HD22 ' HA ' ' A' ' 33' ' ' LEU . 35.2 mt -67.65 -33.34 74.76 Favored 'General case' 0 C--N 1.348 0.527 0 C-N-CA 123.035 0.534 . . . . 75.23 110.849 -176.459 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 22' ' ' LEU . . . . . 0.556 ' HA ' HD21 ' A' ' 78' ' ' LEU . 47.8 tp -69.83 -49.95 47.54 Favored 'General case' 0 C--O 1.244 0.771 0 O-C-N 123.74 0.65 . . . . 74.22 109.939 179.041 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 23' ' ' GLU . . . . . 0.565 ' HB3' ' HE ' ' A' ' 27' ' ' ARG . 42.5 mt-10 -55.21 -60.48 3.33 Favored 'General case' 0 C--N 1.352 0.678 0 O-C-N 124.219 0.949 . . . . 71.12 110.37 176.941 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 24' ' ' LEU . . . . . 0.486 HD23 ' HD2' ' A' ' 27' ' ' ARG . 79.1 mt -61.36 -32.19 72.09 Favored 'General case' 0 CA--C 1.542 0.639 0 C-N-CA 124.652 1.181 . . . . 74.24 111.847 -176.543 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 25' ' ' ALA . . . . . 0.469 ' HB2' HD21 ' A' ' 33' ' ' LEU . . . -61.22 -49.07 78.62 Favored 'General case' 0 N--CA 1.482 1.131 0 CA-C-O 120.873 0.368 . . . . 70.43 110.191 174.912 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 95.2 mt-30 -72.11 -22.99 61.25 Favored 'General case' 0 CA--C 1.549 0.924 0 CA-C-N 115.017 -0.992 . . . . 54.11 111.759 -179.216 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 27' ' ' ARG . . . . . 0.565 ' HE ' ' HB3' ' A' ' 23' ' ' GLU . 47.2 mtt-85 -80.52 -10.03 59.75 Favored 'General case' 0 N--CA 1.485 1.324 0 C-N-CA 123.638 0.775 . . . . 63.54 110.95 174.179 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 83.39 9.0 84.28 Favored Glycine 0 C--N 1.348 1.228 0 C-N-CA 122.673 0.178 . . . . 72.11 113.316 -178.8 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 20.9 mm-40 -86.56 55.08 3.4 Favored 'General case' 0 CA--C 1.547 0.846 0 C-N-CA 125.306 1.442 . . . . 51.22 110.777 178.836 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 30' ' ' TRP . . . . . 0.439 ' O ' ' HG ' ' A' ' 34' ' ' LEU . 86.4 m95 -63.13 -29.03 70.47 Favored 'General case' 0 N--CA 1.481 1.089 0 C-N-CA 123.681 0.792 . . . . 54.53 111.313 -177.654 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 20.1 m-20 -53.6 -48.93 68.8 Favored 'General case' 0 N--CA 1.48 1.069 0 C-N-CA 123.608 0.763 . . . . 72.1 110.131 175.43 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 0.466 HD12 HD22 ' A' ' 24' ' ' LEU . 34.7 mt -63.97 -30.67 71.73 Favored 'General case' 0 CA--C 1.542 0.654 0 CA-C-N 115.094 -0.957 . . . . 64.2 111.063 -176.242 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 33' ' ' LEU . . . . . 0.572 ' HA ' HD22 ' A' ' 21' ' ' LEU . 9.8 mp -63.96 -46.3 85.26 Favored 'General case' 0 N--CA 1.477 0.91 0 O-C-N 123.585 0.553 . . . . 75.03 110.159 171.327 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.439 ' HG ' ' O ' ' A' ' 30' ' ' TRP . 64.6 mt -63.37 -30.78 71.86 Favored 'General case' 0 N--CA 1.484 1.269 0 C-N-CA 123.367 0.667 . . . . 72.04 112.21 -177.862 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 1.3 mp0 -74.24 -49.06 24.87 Favored 'General case' 0 N--CA 1.485 1.284 0 C-N-CA 122.526 0.33 . . . . 73.11 111.009 173.798 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 36' ' ' GLN . . . . . 0.505 ' HB2' HD21 ' A' ' 21' ' ' LEU . 84.5 mm-40 -69.42 -14.44 62.9 Favored 'General case' 0 N--CA 1.48 1.034 0 C-N-CA 123.41 0.684 . . . . 74.23 111.966 179.617 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 37' ' ' GLU . . . . . 0.478 ' O ' ' HG ' ' A' ' 41' ' ' LEU . 28.2 tt0 -48.04 -54.62 12.43 Favored 'General case' 0 N--CA 1.481 1.086 0 C-N-CA 124.903 1.281 . . . . 65.33 111.876 178.536 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 59.6 t -57.4 -45.38 85.5 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.998 0 C-N-CA 123.973 0.909 . . . . 74.03 110.726 -176.494 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 39' ' ' SER . . . . . 0.438 ' HB3' ' NH2' ' A' ' 13' ' ' ARG . 41.5 m -67.08 -36.88 82.95 Favored 'General case' 0 CA--C 1.542 0.643 0 CA-C-N 114.792 -1.095 . . . . 65.21 111.401 179.056 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 76.5 t80 -69.2 -46.94 66.22 Favored 'General case' 0 N--CA 1.477 0.896 0 C-N-CA 123.745 0.818 . . . . 72.51 110.291 -176.255 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 41' ' ' LEU . . . . . 0.478 ' HG ' ' O ' ' A' ' 37' ' ' GLU . 73.9 mt -58.31 -52.18 66.69 Favored 'General case' 0 C--N 1.355 0.807 0 O-C-N 124.672 1.233 . . . . 53.14 109.13 176.773 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 50.3 tt0 -54.76 -48.22 72.92 Favored 'General case' 0 C--N 1.354 0.779 0 O-C-N 124.003 0.814 . . . . 75.11 111.498 -178.232 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 43' ' ' SER . . . . . 0.472 ' O ' HG23 ' A' ' 47' ' ' VAL . 68.1 m -61.41 -59.7 4.85 Favored 'General case' 0 CA--C 1.545 0.767 0 C-N-CA 123.069 0.548 . . . . 44.22 111.259 -178.263 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 12.6 tt -59.95 -39.37 79.96 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.145 0 O-C-N 123.821 0.701 . . . . 74.35 111.319 -172.914 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 18.3 mm-40 -65.25 -54.34 30.82 Favored 'General case' 0 N--CA 1.475 0.796 0 C-N-CA 123.554 0.741 . . . . 73.12 110.892 177.673 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 46' ' ' THR . . . . . 0.446 ' O ' ' HD3' ' A' ' 50' ' ' LYS . 87.9 m -56.47 -31.46 64.04 Favored 'General case' 0 N--CA 1.489 1.502 0 C-N-CA 123.469 0.708 . . . . 43.21 111.925 -177.831 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 47' ' ' VAL . . . . . 0.472 HG23 ' O ' ' A' ' 43' ' ' SER . 60.9 t -76.21 -46.33 33.63 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.821 0 CA-C-N 116.848 -0.16 . . . . 74.35 111.212 177.332 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 48' ' ' MET . . . . . . . . . . . . . 70.6 mtm -74.6 -21.07 59.66 Favored 'General case' 0 N--CA 1.487 1.392 0 N-CA-C 112.811 0.671 . . . . 75.24 112.811 -175.842 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 50.7 mt-10 -83.14 -37.3 23.9 Favored 'General case' 0 N--CA 1.488 1.455 0 C-N-CA 122.699 0.4 . . . . 75.23 111.07 177.681 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 50' ' ' LYS . . . . . 0.446 ' HD3' ' O ' ' A' ' 46' ' ' THR . 13.6 mptt -91.45 147.02 23.33 Favored 'General case' 0 N--CA 1.475 0.8 0 CA-C-N 115.67 -0.696 . . . . 64.52 110.036 -170.485 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 7.6 tt0 -71.83 136.52 47.04 Favored 'General case' 0 CA--C 1.539 0.539 0 CA-C-N 115.013 -0.994 . . . . 73.4 110.757 -173.655 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 52' ' ' THR . . . . . 0.77 HG21 ' HB3' ' A' ' 114' ' ' LEU . 59.9 m -70.44 133.16 87.22 Favored Pre-proline 0 CA--C 1.555 1.168 0 CA-C-N 115.263 -0.88 . . . . 74.14 110.109 173.313 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 53' ' ' PRO . . . . . 0.476 ' HG2' ' HA ' ' A' ' 4' ' ' THR . 45.4 Cg_exo -58.62 151.98 59.08 Favored 'Trans proline' 0 C--N 1.383 2.356 0 C-N-CA 122.379 2.053 . . . . 73.12 113.162 177.63 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 54' ' ' PRO . . . . . 0.427 ' HD3' ' HA ' ' A' ' 53' ' ' PRO . 18.5 Cg_exo -68.68 -46.96 1.52 Allowed 'Trans proline' 0 C--N 1.375 1.972 0 C-N-CA 122.963 2.442 . . . . 71.24 110.994 172.827 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . -68.99 87.18 0.22 Allowed Glycine 0 C--N 1.349 1.268 0 CA-C-N 114.928 -1.033 . . . . 70.32 113.134 -179.164 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 80.3 mt -128.15 123.99 61.54 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.639 0 C-N-CA 124.574 1.15 . . . . 53.21 108.005 173.891 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 57' ' ' THR . . . . . 0.462 ' H ' HD12 ' A' ' 60' ' ' ILE . 31.9 p -85.2 179.23 7.27 Favored 'General case' 0 N--CA 1.473 0.703 0 N-CA-C 109.31 -0.626 . . . . 61.44 109.31 176.249 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 39.1 tpt85 -64.43 -47.04 80.63 Favored 'General case' 0 CA--C 1.541 0.606 0 C-N-CA 122.917 0.487 . . . . 73.44 109.772 176.176 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 17.7 m -60.84 -41.61 96.17 Favored 'General case' 0 N--CA 1.475 0.811 0 C-N-CA 123.683 0.793 . . . . 52.05 111.35 179.517 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 60' ' ' ILE . . . . . 0.462 HD12 ' H ' ' A' ' 57' ' ' THR . 98.1 mt -64.28 -42.04 94.22 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.95 0 C-N-CA 123.242 0.617 . . . . 72.21 110.43 177.826 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 49.0 tt0 -58.08 -42.23 85.11 Favored 'General case' 0 CA--C 1.544 0.72 0 O-C-N 123.801 0.688 . . . . 74.14 110.548 176.359 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 35.4 m-20 -68.82 -39.31 80.08 Favored 'General case' 0 N--CA 1.48 1.026 0 C-N-CA 123.214 0.606 . . . . 72.4 112.078 -179.608 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 63' ' ' MET . . . . . . . . . . . . . 71.6 mtm -68.68 -46.17 69.77 Favored 'General case' 0 N--CA 1.482 1.175 0 O-C-N 123.322 0.389 . . . . 63.45 110.691 -179.821 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 64' ' ' VAL . . . . . 0.529 ' O ' HG13 ' A' ' 68' ' ' ILE . 70.6 t -63.91 -60.05 3.34 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.558 0 CA-C-N 115.175 -0.92 . . . . 54.1 109.916 178.827 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 65' ' ' ALA . . . . . 0.57 ' HB2' HD23 ' A' ' 109' ' ' LEU . . . -60.92 -29.55 69.67 Favored 'General case' 0 N--CA 1.493 1.689 0 C-N-CA 123.298 0.639 . . . . 53.24 112.018 -179.054 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -67.0 -42.1 92.78 Favored Glycine 0 C--N 1.345 1.073 0 O-C-N 123.66 0.6 . . . . 65.42 111.928 176.018 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 67' ' ' TYR . . . . . 0.429 ' CE2' ' HG2' ' A' ' 12' ' ' GLN . 9.8 m-30 -75.89 -29.34 58.42 Favored 'General case' 0 N--CA 1.473 0.701 0 C-N-CA 123.046 0.539 . . . . 74.22 112.276 177.289 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 68' ' ' ILE . . . . . 0.539 ' O ' ' HG ' ' A' ' 72' ' ' LEU . 47.3 mt -64.03 -50.01 79.04 Favored 'Isoleucine or valine' 0 C--N 1.355 0.845 0 N-CA-C 107.251 -1.388 . . . . 73.35 107.251 172.306 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 69' ' ' LYS . . . . . 0.565 ' HB2' ' HE2' ' A' ' 106' ' ' TYR . 48.0 tttp -52.11 -48.46 64.77 Favored 'General case' 0 N--CA 1.481 1.098 0 C-N-CA 123.967 0.907 . . . . 55.11 111.149 176.432 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 60.7 tt0 -59.53 -46.38 89.04 Favored 'General case' 0 C--N 1.348 0.505 0 O-C-N 124.534 1.146 . . . . 72.55 110.41 -176.398 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 71' ' ' THR . . . . . 0.551 ' HB ' ' HA ' ' A' ' 15' ' ' ALA . 12.3 t -78.8 -18.74 53.63 Favored 'General case' 0 C--O 1.215 -0.752 0 CA-C-O 118.525 -0.75 . . . . 74.34 110.906 -177.91 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 72' ' ' LEU . . . . . 0.539 ' HG ' ' O ' ' A' ' 68' ' ' ILE . 37.6 mt -76.63 -33.42 58.35 Favored 'General case' 0 N--CA 1.491 1.611 0 CA-C-N 118.447 0.567 . . . . 64.44 110.791 173.596 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 50.8 m-20 -69.71 -49.01 57.43 Favored 'General case' 0 N--CA 1.476 0.855 0 N-CA-C 109.114 -0.698 . . . . 64.12 109.114 175.025 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 78.6 m-20 -57.86 -41.72 82.99 Favored 'General case' 0 N--CA 1.48 1.031 0 O-C-N 124.12 0.888 . . . . 73.13 110.714 175.522 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 75' ' ' GLU . . . . . 0.458 ' O ' ' HG2' ' A' ' 79' ' ' LYS . 11.2 tp10 -53.91 -61.64 2.17 Favored 'General case' 0 N--CA 1.485 1.284 0 C-N-CA 125.389 1.476 . . . . 54.42 110.697 176.234 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 61.9 tt0 -58.13 -46.77 85.03 Favored 'General case' 0 CA--C 1.543 0.702 0 O-C-N 124.056 0.848 . . . . 73.23 111.107 -174.094 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 95.2 mt -67.18 -40.25 86.55 Favored 'General case' 0 CA--C 1.545 0.751 0 CA-C-N 115.535 -0.757 . . . . 60.03 111.607 -176.538 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 78' ' ' LEU . . . . . 0.556 HD21 ' HA ' ' A' ' 22' ' ' LEU . 15.9 mt -65.79 -46.23 79.47 Favored 'General case' 0 N--CA 1.478 0.944 0 O-C-N 123.442 0.464 . . . . 75.21 111.807 -179.031 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 79' ' ' LYS . . . . . 0.458 ' HG2' ' O ' ' A' ' 75' ' ' GLU . 22.8 mmtp -70.57 -32.92 70.51 Favored 'General case' 0 N--CA 1.481 1.1 0 CA-C-O 121.002 0.429 . . . . 75.4 109.947 -178.438 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -64.67 -28.8 73.77 Favored Glycine 0 C--N 1.345 1.076 0 CA-C-N 114.594 -1.185 . . . . 75.11 112.983 172.354 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -83.79 -38.99 20.57 Favored 'General case' 0 CA--C 1.558 1.256 0 C-N-CA 123.46 0.704 . . . . 72.21 110.527 176.813 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 78.9 mt . . . . . 0 N--CA 1.483 1.21 0 C-N-CA 123.546 0.738 . . . . 71.31 111.634 -172.624 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 92' ' ' LEU . . . . . 0.506 ' N ' ' HG ' ' A' ' 96' ' ' SER . 90.8 mt . . . . . 0 CA--C 1.549 0.908 0 CA-C-O 120.362 0.125 . . . . 55.03 111.248 . . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 5.9 mt -99.34 35.06 0.22 Allowed 'Isoleucine or valine' 0 N--CA 1.484 1.247 0 N-CA-C 108.34 -0.985 . . . . 64.43 108.34 -179.69 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 74.21 -70.87 1.53 Allowed Glycine 0 C--N 1.349 1.298 0 N-CA-C 109.255 -1.538 . . . . 74.31 109.255 -163.928 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 50.5 mt-30 -69.76 97.13 1.04 Allowed 'General case' 0 C--N 1.349 0.587 0 N-CA-C 108.038 -1.097 . . . . 74.12 108.038 161.782 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 96' ' ' SER . . . . . 0.506 ' HG ' ' N ' ' A' ' 92' ' ' LEU . 17.3 m -71.69 90.29 1.05 Allowed 'General case' 0 CA--C 1.535 0.376 0 N-CA-C 109.176 -0.676 . . . . 75.23 109.176 178.707 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 11.3 t -85.96 44.34 1.12 Allowed 'General case' 0 CA--C 1.557 1.25 0 C-N-CA 123.825 0.85 . . . . 74.34 110.111 -179.182 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 98' ' ' ARG . . . . . 0.452 ' HD2' ' H ' ' A' ' 98' ' ' ARG . 0.2 OUTLIER -58.98 -53.35 59.37 Favored 'General case' 0 CA--C 1.548 0.891 0 C-N-CA 123.974 0.91 . . . . 74.12 110.86 -174.161 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 33.9 tt0 -72.61 -50.15 27.26 Favored 'General case' 0 C--N 1.346 0.441 0 C-N-CA 123.836 0.854 . . . . 65.22 109.508 -175.399 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 71.0 mmtt -60.44 -55.47 33.14 Favored 'General case' 0 N--CA 1.472 0.674 0 O-C-N 123.971 0.795 . . . . 71.14 110.501 -173.245 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 39.0 t -72.28 -44.25 63.05 Favored 'General case' 0 CA--C 1.546 0.825 0 O-C-N 124.062 0.851 . . . . 63.14 112.344 -174.526 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 6.4 tp -72.38 -38.24 68.53 Favored 'General case' 0 N--CA 1.49 1.563 0 CA-C-N 118.532 0.605 . . . . 72.23 110.617 -174.505 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 66.5 t30 -77.59 -24.89 49.61 Favored 'General case' 0 N--CA 1.478 0.949 0 CA-C-N 116.435 -0.348 . . . . 64.31 110.682 177.237 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 2.6 t-20 -66.74 -38.29 86.36 Favored 'General case' 0 N--CA 1.488 1.445 0 C-N-CA 122.864 0.465 . . . . 71.14 109.818 171.201 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -61.34 -47.81 84.18 Favored 'General case' 0 C--N 1.352 0.7 0 O-C-N 123.896 0.748 . . . . 73.54 109.96 174.621 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 106' ' ' TYR . . . . . 0.565 ' HE2' ' HB2' ' A' ' 69' ' ' LYS . 4.6 t80 -55.93 -53.42 57.09 Favored 'General case' 0 CA--C 1.55 0.956 0 O-C-N 124.248 0.968 . . . . 73.5 111.06 176.354 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -68.5 -37.97 86.05 Favored Glycine 0 C--N 1.349 1.266 0 O-C-N 123.781 0.676 . . . . 63.45 113.268 -172.043 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 38.3 ttp-105 -71.01 -32.59 69.43 Favored 'General case' 0 CA--C 1.543 0.707 0 C-N-CA 123.665 0.786 . . . . 62.35 109.779 177.395 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 109' ' ' LEU . . . . . 0.57 HD23 ' HB2' ' A' ' 65' ' ' ALA . 47.9 tp -66.99 -46.14 75.5 Favored 'General case' 0 N--CA 1.481 1.103 0 C-N-CA 123.297 0.639 . . . . 73.11 110.778 175.129 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 23.0 t -67.83 -35.43 78.58 Favored 'General case' 0 CA--C 1.543 0.681 0 O-C-N 124.147 0.904 . . . . 51.5 110.229 -178.643 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . -84.26 -63.93 1.62 Allowed Glycine 0 C--N 1.36 1.874 0 CA-C-O 119.274 -0.737 . . . . 65.13 113.28 -176.363 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 112' ' ' MET . . . . . 0.452 ' O ' ' HB2' ' A' ' 113' ' ' LEU . 2.0 tmm? -95.24 -66.24 0.92 Allowed 'General case' 0 N--CA 1.487 1.393 0 CA-C-N 118.496 1.148 . . . . 70.02 110.351 179.586 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 113' ' ' LEU . . . . . 0.452 ' HB2' ' O ' ' A' ' 112' ' ' MET . 14.8 tp 164.4 28.17 0.0 OUTLIER 'General case' 0 N--CA 1.505 2.309 0 C-N-CA 125.445 1.498 . . . . 72.11 110.472 179.269 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 114' ' ' LEU . . . . . 0.77 ' HB3' HG21 ' A' ' 52' ' ' THR . 0.5 OUTLIER . . . . . 0 N--CA 1.501 2.12 0 C-N-CA 125.553 1.541 . . . . 71.23 111.215 -178.569 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 12.4 tpt . . . . . 0 N--CA 1.478 0.971 0 CA-C-O 119.045 -0.502 . . . . 62.31 111.548 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 46.7 p -55.46 -41.35 72.8 Favored 'General case' 0 N--CA 1.484 1.228 0 C-N-CA 122.754 0.422 . . . . 74.44 112.075 -175.94 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 14.7 m -58.35 -42.32 86.66 Favored 'General case' 0 N--CA 1.48 1.03 0 C-N-CA 123.299 0.64 . . . . 73.24 111.121 177.629 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 56.9 m -68.77 -40.62 79.6 Favored 'General case' 0 CA--C 1.544 0.744 0 C-N-CA 123.552 0.741 . . . . 65.35 111.38 177.908 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 88.4 t -63.46 -40.78 90.31 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.021 0 C-N-CA 123.06 0.544 . . . . 53.24 110.127 179.943 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 6' ' ' GLU . . . . . 0.428 ' O ' ' HG3' ' A' ' 10' ' ' ARG . 50.3 mm-40 -71.68 -35.07 70.18 Favored 'General case' 0 N--CA 1.469 0.502 0 O-C-N 123.718 0.636 . . . . 70.33 111.031 178.599 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 55.4 t80 -67.62 -45.06 76.49 Favored 'General case' 0 CA--C 1.551 1.0 0 C-N-CA 123.031 0.533 . . . . 74.43 110.529 179.62 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 8' ' ' ILE . . . . . 0.521 HD11 HG23 ' A' ' 60' ' ' ILE . 90.2 mt -62.97 -40.24 88.25 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.811 0 C-N-CA 123.621 0.768 . . . . 73.4 109.381 173.677 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 20.9 t-20 -61.79 -33.35 73.95 Favored 'General case' 0 N--CA 1.481 1.117 0 C-N-CA 124.063 0.945 . . . . 73.13 111.239 177.227 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 10' ' ' ARG . . . . . 0.654 ' HB3' HG22 ' A' ' 47' ' ' VAL . 64.0 mtt85 -68.59 -40.48 80.48 Favored 'General case' 0 CA--C 1.536 0.442 0 C-N-CA 123.124 0.569 . . . . 73.33 110.377 175.565 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 11' ' ' TRP . . . . . 0.427 ' CD1' HG13 ' A' ' 64' ' ' VAL . 74.8 m95 -69.84 -32.12 70.35 Favored 'General case' 0 N--CA 1.479 1.011 0 N-CA-C 112.14 0.422 . . . . 75.21 112.14 174.931 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 12' ' ' GLN . . . . . 0.411 ' HG3' ' O ' ' A' ' 8' ' ' ILE . 52.9 mt-30 -63.23 -42.02 99.18 Favored 'General case' 0 N--CA 1.472 0.637 0 N-CA-C 108.701 -0.851 . . . . 73.33 108.701 172.302 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 15.5 tpt180 -63.31 -50.69 69.05 Favored 'General case' 0 CA--C 1.541 0.605 0 CA-C-N 115.174 -0.921 . . . . 63.14 110.587 -177.091 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 14' ' ' ILE . . . . . 0.517 HD11 HG21 ' A' ' 47' ' ' VAL . 70.2 mt -63.11 -44.06 99.27 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.062 0 C-N-CA 123.456 0.702 . . . . 71.43 110.653 -179.041 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 15' ' ' ALA . . . . . 0.587 ' HA ' ' HB ' ' A' ' 71' ' ' THR . . . -61.21 -50.79 71.69 Favored 'General case' 0 N--CA 1.479 0.991 0 C-N-CA 124.073 0.949 . . . . 73.41 111.964 -179.672 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 97.9 mt -76.61 -35.17 58.25 Favored 'General case' 0 N--CA 1.48 1.057 0 CA-C-N 114.795 -1.093 . . . . 63.5 111.516 -172.655 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.498 ' O ' ' HG ' ' A' ' 21' ' ' LEU . 45.7 mt -66.43 -47.8 72.06 Favored 'General case' 0 N--CA 1.473 0.707 0 CA-C-O 118.971 -0.537 . . . . 75.01 109.947 175.9 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 98.2 p -65.67 -30.73 71.47 Favored 'General case' 0 N--CA 1.487 1.421 0 C-N-CA 122.611 0.364 . . . . 75.12 111.246 179.151 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 27.1 tp60 -59.31 -49.63 77.08 Favored 'General case' 0 C--N 1.354 0.799 0 O-C-N 123.737 0.648 . . . . 74.41 109.303 171.134 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 44.6 m -62.65 -41.73 99.21 Favored 'General case' 0 CA--C 1.542 0.644 0 CA-C-N 115.233 -0.894 . . . . 75.05 111.163 178.179 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 21' ' ' LEU . . . . . 0.498 ' HG ' ' O ' ' A' ' 17' ' ' LEU . 80.2 mt -63.26 -39.83 95.72 Favored 'General case' 0 N--CA 1.478 0.967 0 C-N-CA 123.64 0.776 . . . . 72.42 110.087 -177.421 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 22' ' ' LEU . . . . . 0.566 ' HA ' HD21 ' A' ' 78' ' ' LEU . 55.6 tp -64.29 -54.77 28.01 Favored 'General case' 0 CA--C 1.539 0.546 0 CA-C-N 115.628 -0.715 . . . . 71.43 110.224 178.058 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 47.3 mt-10 -54.17 -50.82 66.12 Favored 'General case' 0 N--CA 1.483 1.186 0 C-N-CA 123.862 0.865 . . . . 74.41 111.279 -178.954 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 24' ' ' LEU . . . . . 0.441 ' HB3' ' HB2' ' A' ' 29' ' ' GLU . 91.7 mt -63.47 -40.28 96.69 Favored 'General case' 0 N--CA 1.47 0.554 0 CA-C-N 115.012 -0.995 . . . . 65.23 111.067 -177.363 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 25' ' ' ALA . . . . . 0.424 ' HB2' HD21 ' A' ' 33' ' ' LEU . . . -59.91 -40.6 89.37 Favored 'General case' 0 N--CA 1.482 1.161 0 C-N-CA 123.137 0.575 . . . . 70.01 111.352 176.813 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 86.7 mt-30 -64.42 -35.8 82.08 Favored 'General case' 0 N--CA 1.48 1.067 0 C-N-CA 123.899 0.88 . . . . 73.2 110.975 175.776 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 57.7 mtt180 -82.35 -6.79 59.49 Favored 'General case' 0 N--CA 1.482 1.134 0 C-N-CA 123.914 0.886 . . . . 74.11 112.021 179.36 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 84.09 9.77 81.73 Favored Glycine 0 C--N 1.352 1.441 0 N-CA-C 113.587 0.195 . . . . 65.13 113.587 -179.916 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 29' ' ' GLU . . . . . 0.441 ' HB2' ' HB3' ' A' ' 24' ' ' LEU . 40.4 mm-40 -85.5 54.28 3.06 Favored 'General case' 0 CA--C 1.546 0.793 0 C-N-CA 124.626 1.17 . . . . 64.13 111.168 179.629 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 30' ' ' TRP . . . . . 0.492 ' O ' ' HG ' ' A' ' 34' ' ' LEU . 96.0 m95 -64.79 -28.8 69.82 Favored 'General case' 0 N--CA 1.475 0.781 0 C-N-CA 123.402 0.681 . . . . 74.32 111.797 -176.869 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 11.1 m-20 -59.54 -39.46 84.04 Favored 'General case' 0 N--CA 1.486 1.352 0 C-N-CA 123.23 0.612 . . . . 74.44 110.439 178.456 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 88.0 mt -67.82 -31.45 71.3 Favored 'General case' 0 CA--C 1.543 0.679 0 CA-C-N 115.255 -0.884 . . . . 74.11 110.963 179.135 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 33' ' ' LEU . . . . . 0.447 HD13 ' HA ' ' A' ' 30' ' ' TRP . 9.2 mp -65.44 -43.7 89.62 Favored 'General case' 0 N--CA 1.488 1.45 0 N-CA-C 110.051 -0.351 . . . . 72.54 110.051 171.627 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.492 ' HG ' ' O ' ' A' ' 30' ' ' TRP . 49.0 mt -66.3 -33.19 75.19 Favored 'General case' 0 N--CA 1.477 0.914 0 O-C-N 123.989 0.806 . . . . 70.21 111.442 -176.844 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 98.1 mt-30 -74.07 -53.88 9.02 Favored 'General case' 0 N--CA 1.477 0.903 0 C-N-CA 123.414 0.686 . . . . 54.25 110.294 177.04 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 83.5 mm-40 -63.86 -18.1 63.82 Favored 'General case' 0 N--CA 1.484 1.225 0 O-C-N 123.773 0.67 . . . . 73.23 111.637 178.848 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 37' ' ' GLU . . . . . 0.561 ' O ' ' HG ' ' A' ' 41' ' ' LEU . 30.3 tt0 -48.97 -60.97 2.32 Favored 'General case' 0 C--N 1.361 1.094 0 C-N-CA 124.523 1.129 . . . . 72.35 111.523 178.995 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 58.1 t -60.76 -40.59 85.48 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.291 0 O-C-N 123.787 0.679 . . . . 70.23 111.45 -173.973 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 50.8 m -62.22 -39.75 93.82 Favored 'General case' 0 CA--C 1.545 0.784 0 C-N-CA 123.382 0.673 . . . . 63.43 110.794 175.478 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 37.9 t80 -70.94 -40.15 72.22 Favored 'General case' 0 C--N 1.35 0.598 0 C-N-CA 124.274 1.029 . . . . 71.12 110.357 -176.976 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 41' ' ' LEU . . . . . 0.561 ' HG ' ' O ' ' A' ' 37' ' ' GLU . 67.3 mt -61.11 -51.07 70.68 Favored 'General case' 0 C--N 1.355 0.845 0 O-C-N 124.291 0.995 . . . . 73.12 108.623 178.773 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 50.8 tt0 -56.51 -42.03 77.69 Favored 'General case' 0 CA--C 1.544 0.735 0 CA-C-N 114.659 -1.155 . . . . 74.22 110.65 178.303 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 43' ' ' SER . . . . . 0.558 ' O ' HG23 ' A' ' 47' ' ' VAL . 68.8 m -61.54 -62.82 1.55 Allowed 'General case' 0 C--N 1.357 0.898 0 C-N-CA 122.959 0.504 . . . . 72.53 110.968 179.345 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 13.7 tt -64.02 -35.35 73.26 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.914 0 C-N-CA 123.836 0.854 . . . . 64.21 111.477 -169.882 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 10.7 mm-40 -65.86 -49.25 68.82 Favored 'General case' 0 C--N 1.348 0.528 0 CA-C-N 115.873 -0.603 . . . . 74.35 110.317 175.332 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 60.9 m -53.64 -39.94 65.43 Favored 'General case' 0 N--CA 1.484 1.239 0 O-C-N 123.864 0.727 . . . . 50.15 111.163 177.784 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 47' ' ' VAL . . . . . 0.654 HG22 ' HB3' ' A' ' 10' ' ' ARG . 20.9 t -68.56 -49.09 68.4 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.004 0 C-N-CA 123.104 0.562 . . . . 71.42 111.575 -178.228 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 48' ' ' MET . . . . . . . . . . . . . 70.3 mtm -75.62 -14.38 60.37 Favored 'General case' 0 N--CA 1.483 1.187 0 C-N-CA 122.507 0.323 . . . . 62.13 111.761 -177.784 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 47.0 mt-10 -95.98 -11.98 25.71 Favored 'General case' 0 N--CA 1.481 1.089 0 C-N-CA 123.724 0.81 . . . . 75.13 110.555 171.82 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 14.9 tppt? -87.2 132.94 33.72 Favored 'General case' 0 N--CA 1.472 0.628 0 N-CA-C 108.883 -0.784 . . . . 74.41 108.883 177.331 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 3.4 tt0 -66.83 131.22 45.45 Favored 'General case' 0 C--O 1.242 0.683 0 N-CA-C 108.961 -0.755 . . . . 74.15 108.961 174.634 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 22.1 m -69.25 127.09 93.08 Favored Pre-proline 0 CA--C 1.551 0.995 0 O-C-N 123.579 0.55 . . . . 72.1 109.555 175.905 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_endo -66.32 155.02 71.98 Favored 'Trans proline' 0 C--N 1.377 2.079 0 C-N-CA 122.258 1.972 . . . . 71.13 112.031 178.97 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 17.4 Cg_exo -67.85 -47.74 1.75 Allowed 'Trans proline' 0 C--N 1.372 1.798 0 C-N-CA 122.941 2.427 . . . . 75.1 111.653 177.406 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . -63.2 85.0 0.05 OUTLIER Glycine 0 C--N 1.353 1.48 0 O-C-N 124.411 1.07 . . . . 62.35 113.593 -177.413 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 59.2 mt -133.69 102.12 4.4 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.683 0 C-N-CA 124.764 1.226 . . . . 75.42 108.399 178.081 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 57' ' ' THR . . . . . 0.425 ' H ' HD12 ' A' ' 60' ' ' ILE . 40.8 p -82.42 -173.62 4.69 Favored 'General case' 0 N--CA 1.471 0.601 0 C-N-CA 123.652 0.781 . . . . 64.1 110.31 175.192 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 22.0 tpt180 -63.01 -48.82 77.14 Favored 'General case' 0 CA--C 1.54 0.596 0 C-N-CA 123.608 0.763 . . . . 72.25 110.665 179.711 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 20.3 m -56.89 -43.98 81.86 Favored 'General case' 0 N--CA 1.479 1.017 0 C-N-CA 123.43 0.692 . . . . 65.42 111.375 179.389 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 60' ' ' ILE . . . . . 0.521 HG23 HD11 ' A' ' 8' ' ' ILE . 69.6 mt -64.08 -42.27 95.09 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.808 0 CA-C-N 115.114 -0.948 . . . . 74.11 110.328 178.728 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 60.4 tt0 -61.23 -41.27 96.58 Favored 'General case' 0 CA--C 1.546 0.79 0 C-N-CA 124.09 0.956 . . . . 71.4 111.087 179.729 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 14.1 m-20 -68.27 -43.3 78.11 Favored 'General case' 0 N--CA 1.479 0.986 0 C-N-CA 123.235 0.614 . . . . 73.55 111.632 179.503 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 63' ' ' MET . . . . . . . . . . . . . 73.3 mtm -65.88 -51.3 59.92 Favored 'General case' 0 N--CA 1.482 1.129 0 O-C-N 123.206 0.316 . . . . 54.41 111.109 179.864 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 64' ' ' VAL . . . . . 0.498 ' O ' HG13 ' A' ' 68' ' ' ILE . 53.1 t -59.98 -61.12 1.63 Allowed 'Isoleucine or valine' 0 CA--C 1.543 0.703 0 C-N-CA 123.707 0.803 . . . . 73.21 110.692 -179.522 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -64.67 -32.33 73.94 Favored 'General case' 0 N--CA 1.483 1.181 0 C-N-CA 122.697 0.399 . . . . 55.24 111.706 -176.708 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -65.94 -38.78 94.51 Favored Glycine 0 C--N 1.349 1.271 0 O-C-N 123.412 0.445 . . . . 30.25 112.049 177.798 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 67' ' ' TYR . . . . . 0.439 ' O ' HG22 ' A' ' 71' ' ' THR . 8.1 m-85 -74.9 -34.39 62.16 Favored 'General case' 0 N--CA 1.469 0.524 0 C-N-CA 123.439 0.696 . . . . 75.42 111.971 177.973 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 68' ' ' ILE . . . . . 0.549 ' O ' ' HG ' ' A' ' 72' ' ' LEU . 48.1 mt -61.93 -52.69 57.54 Favored 'Isoleucine or valine' 0 C--N 1.36 1.061 0 N-CA-C 108.353 -0.98 . . . . 61.43 108.353 174.369 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 69' ' ' LYS . . . . . 0.575 ' HB2' ' HE2' ' A' ' 106' ' ' TYR . 12.1 tmtt? -53.83 -47.76 70.58 Favored 'General case' 0 N--CA 1.479 1.017 0 C-N-CA 124.542 1.137 . . . . 75.13 109.772 -179.408 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 58.0 tt0 -55.49 -54.39 44.43 Favored 'General case' 0 C--N 1.347 0.485 0 CA-C-N 114.951 -1.022 . . . . 62.34 111.974 179.626 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 71' ' ' THR . . . . . 0.587 ' HB ' ' HA ' ' A' ' 15' ' ' ALA . 10.1 t -71.48 -27.09 62.99 Favored 'General case' 0 C--O 1.251 1.169 0 CA-C-N 116.22 -0.445 . . . . 74.21 110.891 -171.816 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 72' ' ' LEU . . . . . 0.549 ' HG ' ' O ' ' A' ' 68' ' ' ILE . 43.0 mt -62.07 -55.66 26.75 Favored 'General case' 0 C--N 1.358 0.955 0 O-C-N 123.789 0.681 . . . . 71.31 109.876 173.622 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -56.29 -52.56 64.06 Favored 'General case' 0 N--CA 1.489 1.487 0 O-C-N 124.253 0.971 . . . . 74.32 111.982 -179.787 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 74' ' ' ASN . . . . . 0.431 ' N ' HD21 ' A' ' 74' ' ' ASN . 0.8 OUTLIER -58.74 -55.23 37.72 Favored 'General case' 0 C--O 1.248 0.992 0 O-C-N 124.036 0.835 . . . . 74.22 111.528 -174.786 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 75' ' ' GLU . . . . . 0.554 ' O ' ' HG2' ' A' ' 79' ' ' LYS . 14.5 tt0 -76.85 -15.4 59.72 Favored 'General case' 0 CA--C 1.545 0.763 0 CA-C-O 118.778 -0.63 . . . . 64.32 111.047 -177.107 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 76' ' ' GLN . . . . . 0.41 ' HA ' ' HG2' ' A' ' 79' ' ' LYS . 9.9 tt0 -69.46 -38.57 77.83 Favored 'General case' 0 N--CA 1.487 1.424 0 CA-C-N 118.464 0.575 . . . . 45.34 110.243 171.43 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 96.4 mt -60.62 -40.57 92.39 Favored 'General case' 0 N--CA 1.472 0.67 0 CA-C-N 115.592 -0.731 . . . . 63.34 109.087 171.031 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 78' ' ' LEU . . . . . 0.566 HD21 ' HA ' ' A' ' 22' ' ' LEU . 88.3 mt -63.76 -36.03 82.55 Favored 'General case' 0 CA--C 1.55 0.95 0 CA-C-O 118.44 -0.79 . . . . 71.12 112.262 171.634 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 79' ' ' LYS . . . . . 0.642 ' HE2' ' HB2' ' A' ' 99' ' ' GLN . 48.5 mmtm -59.34 -42.01 90.52 Favored 'General case' 0 N--CA 1.5 2.029 0 CA-C-N 119.032 0.833 . . . . 74.21 110.093 178.191 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -69.0 -43.08 74.84 Favored Glycine 0 C--N 1.349 1.297 0 CA-C-N 114.596 -1.184 . . . . 52.21 112.995 177.566 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -72.29 -33.04 67.12 Favored 'General case' 0 CA--C 1.555 1.169 0 C-N-CA 123.345 0.658 . . . . 73.51 110.436 -174.927 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 80.3 mt . . . . . 0 N--CA 1.477 0.894 0 C-N-CA 123.35 0.66 . . . . 53.12 111.053 -178.516 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 92' ' ' LEU . . . . . 0.496 ' HB2' ' HB ' ' A' ' 97' ' ' THR . 92.5 mt . . . . . 0 CA--C 1.543 0.697 0 CA-C-O 120.38 0.133 . . . . 71.31 111.294 . . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 39.0 mt -117.4 76.67 0.49 Allowed 'Isoleucine or valine' 0 CA--C 1.547 0.848 0 N-CA-C 109.042 -0.725 . . . . 71.2 109.042 -178.07 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 76.5 -77.03 1.45 Allowed Glycine 0 C--N 1.35 1.359 0 CA-C-N 115.388 -0.824 . . . . 71.31 113.604 174.272 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 2.9 mp0 -89.7 -173.13 3.82 Favored 'General case' 0 N--CA 1.478 0.952 0 C-N-CA 124.186 0.994 . . . . 75.04 110.364 178.71 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 58.8 m -63.27 95.8 0.1 Allowed 'General case' 0 CA--C 1.544 0.714 0 CA-C-N 115.063 -0.971 . . . . 61.13 110.367 174.618 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 97' ' ' THR . . . . . 0.496 ' HB ' ' HB2' ' A' ' 92' ' ' LEU . 87.3 m -100.37 -45.12 5.69 Favored 'General case' 0 C--O 1.215 -0.736 0 CA-C-N 114.796 -1.093 . . . . 73.24 111.272 -173.282 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 2.4 tmt_? -48.78 -58.24 5.11 Favored 'General case' 0 N--CA 1.482 1.165 0 C-N-CA 124.651 1.18 . . . . 71.3 112.077 -167.703 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 99' ' ' GLN . . . . . 0.642 ' HB2' ' HE2' ' A' ' 79' ' ' LYS . 48.3 tt0 -71.97 -43.81 64.57 Favored 'General case' 0 N--CA 1.472 0.659 0 N-CA-C 110.063 -0.347 . . . . 73.14 110.063 -169.729 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 29.4 ttpp -68.14 -47.38 68.25 Favored 'General case' 0 CA--C 1.546 0.802 0 C-N-CA 124.314 1.046 . . . . 64.15 111.192 -175.075 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 38.6 t -68.06 -42.6 80.22 Favored 'General case' 0 N--CA 1.472 0.671 0 C-N-CA 124.186 0.994 . . . . 62.34 110.729 -177.538 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 7.1 tp -74.56 -31.45 62.09 Favored 'General case' 0 CA--C 1.549 0.922 0 O-C-N 123.329 0.393 . . . . 71.21 111.187 -176.718 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 9.8 t30 -66.93 -41.89 86.25 Favored 'General case' 0 N--CA 1.48 1.059 0 C-N-CA 123.55 0.74 . . . . 44.43 109.696 173.938 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 27.7 t-20 -71.58 -28.88 64.13 Favored 'General case' 0 CA--C 1.54 0.568 0 CA-C-N 115.374 -0.83 . . . . 72.15 110.434 177.353 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -67.25 -38.79 85.74 Favored 'General case' 0 N--CA 1.48 1.037 0 C-N-CA 123.233 0.613 . . . . 74.54 110.454 176.627 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 106' ' ' TYR . . . . . 0.575 ' HE2' ' HB2' ' A' ' 69' ' ' LYS . 1.0 OUTLIER -61.21 -47.49 85.88 Favored 'General case' 0 C--N 1.355 0.814 0 N-CA-C 108.816 -0.809 . . . . 74.41 108.816 171.216 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -57.87 -40.69 93.47 Favored Glycine 0 C--N 1.351 1.386 0 O-C-N 123.732 0.645 . . . . 63.52 112.781 179.446 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 2.5 mmp_? -68.14 -34.17 75.84 Favored 'General case' 0 C--N 1.345 0.377 0 C-N-CA 123.508 0.723 . . . . 73.31 110.036 177.063 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 109' ' ' LEU . . . . . 0.445 ' HA ' ' N ' ' A' ' 114' ' ' LEU . 53.1 tp -68.37 -32.64 72.87 Favored 'General case' 0 N--CA 1.482 1.167 0 C-N-CA 123.174 0.589 . . . . 70.12 111.114 177.659 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 33.5 t -72.45 -42.49 64.95 Favored 'General case' 0 CA--C 1.541 0.598 0 CA-C-N 115.66 -0.7 . . . . 32.52 109.803 177.747 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . -88.71 -61.73 1.42 Allowed Glycine 0 C--N 1.355 1.611 0 C-N-CA 121.144 -0.551 . . . . 42.13 114.127 -175.773 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 112' ' ' MET . . . . . . . . . . . . . 2.2 mmm -93.72 -66.65 0.91 Allowed 'General case' 0 N--CA 1.486 1.338 0 CA-C-N 117.927 0.863 . . . . 71.34 112.904 -176.245 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 113' ' ' LEU . . . . . 0.424 ' HA ' HD23 ' A' ' 113' ' ' LEU . 6.6 mt 157.27 44.77 0.0 OUTLIER 'General case' 0 N--CA 1.503 2.183 0 C-N-CA 126.364 1.866 . . . . 64.23 108.6 -174.191 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 114' ' ' LEU . . . . . 0.445 ' N ' ' HA ' ' A' ' 109' ' ' LEU . 1.0 OUTLIER . . . . . 0 N--CA 1.503 2.194 0 C-N-CA 125.387 1.475 . . . . 74.1 111.788 174.703 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 1' ' ' MET . . . . . 0.516 ' HG3' HG23 ' A' ' 5' ' ' VAL . 21.0 ptt? . . . . . 0 N--CA 1.486 1.339 0 CA-C-O 120.963 0.411 . . . . 44.23 110.5 . . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 43.8 m -54.98 -61.32 2.39 Favored 'General case' 0 N--CA 1.482 1.141 0 C-N-CA 123.571 0.748 . . . . 53.04 112.344 -172.107 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 17.0 m -63.78 -28.66 70.02 Favored 'General case' 0 N--CA 1.478 0.962 0 C-N-CA 123.529 0.732 . . . . 74.04 112.341 -174.726 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 23.6 m -77.96 -36.56 48.98 Favored 'General case' 0 CA--C 1.549 0.934 0 C-N-CA 123.421 0.688 . . . . 51.23 111.569 -179.665 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 5' ' ' VAL . . . . . 0.516 HG23 ' HG3' ' A' ' 1' ' ' MET . 51.5 t -71.08 -38.62 72.22 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.107 0 C-N-CA 122.851 0.46 . . . . 73.44 110.143 175.76 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 6' ' ' GLU . . . . . 0.54 ' HB3' ' NH1' ' A' ' 10' ' ' ARG . 45.6 mm-40 -60.83 -45.38 94.68 Favored 'General case' 0 N--CA 1.478 0.931 0 O-C-N 123.639 0.587 . . . . 74.4 110.128 173.48 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 81.8 t80 -53.09 -58.75 5.94 Favored 'General case' 0 CA--C 1.549 0.934 0 C-N-CA 125.242 1.417 . . . . 73.2 111.534 176.646 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 8' ' ' ILE . . . . . 0.454 ' O ' ' HG3' ' A' ' 12' ' ' GLN . 70.6 mt -61.1 -45.78 97.91 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.015 0 O-C-N 123.766 0.666 . . . . 74.14 110.559 -178.78 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 4.3 t-20 -64.89 -29.54 70.5 Favored 'General case' 0 N--CA 1.482 1.132 0 C-N-CA 123.539 0.736 . . . . 65.55 111.379 -175.814 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 10' ' ' ARG . . . . . 0.593 ' HB3' HG22 ' A' ' 47' ' ' VAL . 68.3 mtt85 -78.55 -32.17 47.74 Favored 'General case' 0 CA--C 1.541 0.627 0 C-N-CA 122.986 0.514 . . . . 70.4 111.214 176.571 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 11' ' ' TRP . . . . . . . . . . . . . 85.5 m95 -71.01 -29.92 66.0 Favored 'General case' 0 N--CA 1.487 1.399 0 CA-C-N 117.53 0.15 . . . . 75.3 111.007 169.987 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 12' ' ' GLN . . . . . 0.578 ' HG2' ' CE2' ' A' ' 67' ' ' TYR . 42.9 mt-30 -63.61 -46.81 84.05 Favored 'General case' 0 C--N 1.357 0.928 0 N-CA-C 108.329 -0.989 . . . . 65.14 108.329 170.78 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 11.9 tpt180 -55.77 -49.45 73.12 Favored 'General case' 0 CA--C 1.544 0.73 0 O-C-N 124.375 1.047 . . . . 74.41 111.513 -179.118 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 54.1 mt -63.69 -45.07 98.41 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.292 0 O-C-N 123.271 0.357 . . . . 65.4 110.301 179.25 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 15' ' ' ALA . . . . . 0.594 ' HA ' ' HB ' ' A' ' 71' ' ' THR . . . -56.46 -45.45 80.87 Favored 'General case' 0 N--CA 1.485 1.321 0 C-N-CA 123.959 0.904 . . . . 43.54 111.664 178.572 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 16' ' ' LEU . . . . . 0.404 ' HG ' ' O ' ' A' ' 12' ' ' GLN . 95.9 mt -79.38 -35.75 40.28 Favored 'General case' 0 N--CA 1.478 0.933 0 CA-C-N 114.562 -1.199 . . . . 72.13 111.233 -172.352 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.472 ' O ' ' HG ' ' A' ' 21' ' ' LEU . 45.6 mt -66.21 -51.84 53.74 Favored 'General case' 0 N--CA 1.476 0.849 0 O-C-N 123.655 0.597 . . . . 74.44 109.774 178.518 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 88.4 p -62.21 -38.47 89.3 Favored 'General case' 0 N--CA 1.479 0.981 0 C-N-CA 123.229 0.612 . . . . 72.12 111.031 179.457 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 6.7 tp-100 -58.61 -48.97 79.2 Favored 'General case' 0 C--N 1.356 0.867 0 O-C-N 123.873 0.733 . . . . 74.42 110.858 174.311 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 20' ' ' SER . . . . . 0.412 ' O ' ' HG ' ' A' ' 24' ' ' LEU . 69.2 m -61.09 -46.6 89.98 Favored 'General case' 0 C--O 1.213 -0.851 0 O-C-N 124.053 0.846 . . . . 61.44 110.159 178.609 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 21' ' ' LEU . . . . . 0.472 ' HG ' ' O ' ' A' ' 17' ' ' LEU . 68.5 mt -68.44 -27.53 66.26 Favored 'General case' 0 CA--C 1.537 0.471 0 C-N-CA 123.328 0.651 . . . . 73.04 111.125 -175.469 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 22' ' ' LEU . . . . . 0.686 ' HA ' HD21 ' A' ' 78' ' ' LEU . 46.4 tp -71.67 -48.36 48.07 Favored 'General case' 0 N--CA 1.477 0.875 0 N-CA-C 109.372 -0.603 . . . . 32.44 109.372 176.639 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 23' ' ' GLU . . . . . 0.432 ' HB3' ' NH1' ' A' ' 27' ' ' ARG . 45.1 mt-10 -54.51 -55.14 32.19 Favored 'General case' 0 N--CA 1.479 0.984 0 O-C-N 124.3 1.0 . . . . 62.53 110.365 175.656 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 24' ' ' LEU . . . . . 0.412 ' HG ' ' O ' ' A' ' 20' ' ' SER . 92.5 mt -61.13 -45.7 93.58 Favored 'General case' 0 CA--C 1.541 0.632 0 CA-C-N 114.683 -1.144 . . . . 62.55 111.356 -176.445 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 25' ' ' ALA . . . . . 0.515 ' HB2' HD21 ' A' ' 33' ' ' LEU . . . -59.62 -46.65 88.36 Favored 'General case' 0 N--CA 1.482 1.142 0 C-N-CA 122.969 0.507 . . . . 51.5 111.609 -178.94 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 95.1 mt-30 -72.4 -23.04 61.04 Favored 'General case' 0 CA--C 1.549 0.905 0 CA-C-N 115.589 -0.732 . . . . 65.44 111.551 -179.174 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 27' ' ' ARG . . . . . 0.432 ' NH1' ' HB3' ' A' ' 23' ' ' GLU . 88.9 mtt180 -88.63 4.85 45.59 Favored 'General case' 0 N--CA 1.487 1.387 0 C-N-CA 123.537 0.735 . . . . 74.21 111.776 174.304 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 77.76 9.18 87.07 Favored Glycine 0 C--N 1.352 1.466 0 N-CA-C 114.122 0.409 . . . . 62.43 114.122 177.117 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 29' ' ' GLU . . . . . 0.46 ' HB3' HD12 ' A' ' 32' ' ' LEU . 18.1 mm-40 -86.04 49.65 1.82 Allowed 'General case' 0 CA--C 1.556 1.18 0 C-N-CA 124.296 1.038 . . . . 64.2 110.259 178.287 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 30' ' ' TRP . . . . . 0.485 ' HA ' HD13 ' A' ' 33' ' ' LEU . 74.8 m95 -62.5 -30.47 71.3 Favored 'General case' 0 N--CA 1.485 1.297 0 C-N-CA 123.376 0.67 . . . . 73.34 111.027 -176.406 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 17.2 m-20 -56.27 -44.72 80.01 Favored 'General case' 0 N--CA 1.472 0.657 0 C-N-CA 123.781 0.833 . . . . 52.25 111.019 176.225 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 0.46 HD12 ' HB3' ' A' ' 29' ' ' GLU . 96.2 mt -64.21 -30.1 71.17 Favored 'General case' 0 CA--C 1.552 1.033 0 CA-C-N 115.755 -0.657 . . . . 72.11 110.927 -179.912 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 33' ' ' LEU . . . . . 0.515 HD21 ' HB2' ' A' ' 25' ' ' ALA . 8.4 mp -66.75 -41.93 86.99 Favored 'General case' 0 N--CA 1.491 1.584 0 C-N-CA 122.536 0.335 . . . . 70.1 110.574 171.389 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 71.8 mt -59.61 -45.43 91.97 Favored 'General case' 0 N--CA 1.484 1.241 0 C-N-CA 123.106 0.563 . . . . 74.4 111.456 -179.217 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 10.4 mp0 -71.22 -28.16 64.0 Favored 'General case' 0 N--CA 1.483 1.213 0 C-N-CA 123.188 0.595 . . . . 71.33 111.875 177.466 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 86.3 mm-40 -88.88 -11.72 43.81 Favored 'General case' 0 N--CA 1.485 1.311 0 N-CA-C 112.907 0.706 . . . . 64.52 112.907 179.027 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 37' ' ' GLU . . . . . 0.451 ' O ' ' HG ' ' A' ' 41' ' ' LEU . 38.5 tt0 -47.52 -59.66 3.08 Favored 'General case' 0 N--CA 1.481 1.118 0 C-N-CA 124.109 0.964 . . . . 72.44 112.394 -178.696 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 73.9 t -57.52 -41.06 78.1 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.28 0 C-N-CA 123.255 0.622 . . . . 72.22 111.375 -179.365 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 42.9 m -61.98 -43.74 98.19 Favored 'General case' 0 CA--C 1.543 0.71 0 C-N-CA 123.36 0.664 . . . . 62.11 111.431 179.351 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 47.6 t80 -69.34 -48.5 61.2 Favored 'General case' 0 N--CA 1.468 0.469 0 CA-C-N 115.567 -0.742 . . . . 72.13 110.471 -176.476 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 41' ' ' LEU . . . . . 0.472 HD22 HD21 ' A' ' 92' ' ' LEU . 46.5 mt -66.08 -44.51 84.25 Favored 'General case' 0 CA--C 1.538 0.502 0 O-C-N 124.485 1.116 . . . . 65.01 110.408 -176.371 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 48.3 tt0 -58.95 -49.95 75.89 Favored 'General case' 0 N--CA 1.473 0.681 0 O-C-N 123.695 0.622 . . . . 73.14 110.132 178.576 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 43' ' ' SER . . . . . 0.563 ' O ' HG23 ' A' ' 47' ' ' VAL . 69.5 m -58.93 -55.29 37.02 Favored 'General case' 0 C--N 1.354 0.761 0 O-C-N 123.803 0.689 . . . . 64.31 111.808 -178.989 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 10.1 tt -60.38 -42.44 90.9 Favored 'Isoleucine or valine' 0 CA--C 1.557 1.236 0 C-N-CA 122.854 0.461 . . . . 73.3 111.395 -173.994 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 45' ' ' GLU . . . . . 0.434 ' O ' ' HG3' ' A' ' 49' ' ' GLU . 8.6 mm-40 -61.57 -49.25 77.42 Favored 'General case' 0 N--CA 1.48 1.066 0 C-N-CA 123.056 0.542 . . . . 72.21 111.035 176.224 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 46' ' ' THR . . . . . 0.542 ' O ' ' HD3' ' A' ' 50' ' ' LYS . 95.9 m -57.53 -43.12 84.08 Favored 'General case' 0 N--CA 1.479 1.003 0 C-N-CA 123.802 0.841 . . . . 63.55 111.825 -177.141 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 47' ' ' VAL . . . . . 0.593 HG22 ' HB3' ' A' ' 10' ' ' ARG . 30.5 t -67.82 -42.56 86.07 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.717 0 C-N-CA 122.868 0.467 . . . . 73.34 110.163 -179.543 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 48' ' ' MET . . . . . . . . . . . . . 79.1 mtm -70.58 -15.57 62.77 Favored 'General case' 0 N--CA 1.48 1.074 0 N-CA-C 112.286 0.476 . . . . 75.14 112.286 177.809 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 49' ' ' GLU . . . . . 0.434 ' HG3' ' O ' ' A' ' 45' ' ' GLU . 62.5 mt-10 -73.29 -35.99 66.22 Favored 'General case' 0 N--CA 1.488 1.463 0 CA-C-N 118.152 0.433 . . . . 61.44 111.436 171.664 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 50' ' ' LYS . . . . . 0.542 ' HD3' ' O ' ' A' ' 46' ' ' THR . 10.8 mptt -78.32 135.86 37.59 Favored 'General case' 0 N--CA 1.483 1.2 0 C-N-CA 123.162 0.585 . . . . 74.31 111.192 -170.552 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 50.1 tt0 -69.15 148.29 50.13 Favored 'General case' 0 N--CA 1.474 0.747 0 C-N-CA 124.276 1.03 . . . . 71.51 110.791 177.632 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 25.1 m -65.7 127.03 92.75 Favored Pre-proline 0 CA--C 1.555 1.137 0 C-N-CA 123.893 0.877 . . . . 61.44 110.643 178.296 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 15.3 Cg_exo -69.84 151.32 68.56 Favored 'Trans proline' 0 C--N 1.38 2.235 0 C-N-CA 121.912 1.741 . . . . 64.43 111.372 173.01 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 41.7 Cg_endo -67.81 -44.12 4.5 Favored 'Trans proline' 0 C--N 1.372 1.774 0 C-N-CA 122.999 2.466 . . . . 74.5 112.035 173.832 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . -76.68 66.86 2.68 Favored Glycine 0 C--N 1.352 1.427 0 CA-C-N 116.029 -0.532 . . . . 50.02 113.645 -178.349 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 56' ' ' ILE . . . . . 0.426 HG23 HG22 ' A' ' 60' ' ' ILE . 58.2 mt -110.0 106.45 20.75 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.653 0 N-CA-C 107.41 -1.329 . . . . 73.22 107.41 170.107 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 57' ' ' THR . . . . . 0.434 ' H ' HD12 ' A' ' 60' ' ' ILE . 31.2 p -75.08 178.8 5.41 Favored 'General case' 0 N--CA 1.473 0.723 0 C-N-CA 122.911 0.484 . . . . 73.35 110.244 -179.314 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 40.8 tpt85 -64.08 -46.53 83.88 Favored 'General case' 0 N--CA 1.471 0.606 0 C-N-CA 123.273 0.629 . . . . 70.05 109.961 -179.964 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 31.8 m -63.01 -40.57 98.17 Favored 'General case' 0 CA--C 1.547 0.827 0 CA-C-N 115.596 -0.729 . . . . 70.22 111.34 178.264 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 60' ' ' ILE . . . . . 0.434 HD12 ' H ' ' A' ' 57' ' ' THR . 74.8 mt -63.16 -41.41 92.72 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.163 0 C-N-CA 122.962 0.505 . . . . 60.44 110.608 176.064 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 61.1 tt0 -59.82 -42.65 93.99 Favored 'General case' 0 N--CA 1.476 0.859 0 C-N-CA 123.641 0.776 . . . . 73.3 110.429 179.493 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 50.0 m-20 -68.23 -45.65 72.7 Favored 'General case' 0 N--CA 1.48 1.025 0 O-C-N 123.563 0.54 . . . . 75.02 112.227 178.374 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 63' ' ' MET . . . . . . . . . . . . . 65.4 mtm -64.24 -49.93 69.99 Favored 'General case' 0 N--CA 1.486 1.337 0 C-N-CA 122.331 0.253 . . . . 72.31 110.876 -177.281 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 64' ' ' VAL . . . . . 0.503 ' O ' HG13 ' A' ' 68' ' ' ILE . 82.1 t -60.46 -54.99 27.5 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.815 0 O-C-N 124.171 0.919 . . . . 64.14 110.945 178.238 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -65.99 -28.8 69.15 Favored 'General case' 0 N--CA 1.494 1.765 0 CA-C-N 118.492 0.587 . . . . 74.5 112.083 -178.817 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -69.23 -38.86 82.63 Favored Glycine 0 C--N 1.343 0.966 0 N-CA-C 111.386 -0.685 . . . . 71.31 111.386 176.407 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 67' ' ' TYR . . . . . 0.578 ' CE2' ' HG2' ' A' ' 12' ' ' GLN . 10.8 m-85 -71.0 -36.01 72.29 Favored 'General case' 0 N--CA 1.467 0.413 0 C-N-CA 123.605 0.762 . . . . 64.11 111.134 175.059 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 68' ' ' ILE . . . . . 0.562 ' O ' ' HG ' ' A' ' 72' ' ' LEU . 60.8 mt -63.18 -48.54 87.14 Favored 'Isoleucine or valine' 0 C--N 1.36 1.042 0 N-CA-C 108.649 -0.871 . . . . 73.2 108.649 176.22 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 69' ' ' LYS . . . . . 0.616 ' HB2' ' HE2' ' A' ' 106' ' ' TYR . 0.7 OUTLIER -57.67 -48.22 80.12 Favored 'General case' 0 C--N 1.356 0.861 0 C-N-CA 123.58 0.752 . . . . 72.3 110.297 -179.06 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 9.2 tt0 -60.22 -45.7 92.32 Favored 'General case' 0 C--N 1.347 0.489 0 O-C-N 124.491 1.119 . . . . 65.52 110.979 -179.026 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 71' ' ' THR . . . . . 0.594 ' HB ' ' HA ' ' A' ' 15' ' ' ALA . 15.1 t -77.9 -22.97 48.87 Favored 'General case' 0 C--N 1.354 0.779 0 CA-C-O 119.329 -0.367 . . . . 74.12 110.257 -175.554 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 72' ' ' LEU . . . . . 0.562 ' HG ' ' O ' ' A' ' 68' ' ' ILE . 28.6 mt -63.81 -50.94 66.97 Favored 'General case' 0 C--N 1.359 0.986 0 N-CA-C 108.524 -0.917 . . . . 74.13 108.524 171.831 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 73' ' ' ASP . . . . . 0.477 ' O ' ' HG ' ' A' ' 77' ' ' LEU . 60.6 m-20 -62.4 -53.75 50.42 Favored 'General case' 0 N--CA 1.476 0.842 0 O-C-N 124.363 1.039 . . . . 72.32 111.264 -178.349 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 74' ' ' ASN . . . . . 0.469 ' HA ' HD22 ' A' ' 22' ' ' LEU . 74.7 m-20 -54.32 -53.93 47.25 Favored 'General case' 0 N--CA 1.487 1.403 0 C-N-CA 123.647 0.779 . . . . 61.43 110.825 -178.904 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 43.1 tt0 -66.47 -31.03 71.51 Favored 'General case' 0 CA--C 1.549 0.942 0 C-N-CA 123.802 0.841 . . . . 70.15 111.548 -178.46 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 76' ' ' GLN . . . . . 0.495 ' HB2' ' O ' ' A' ' 72' ' ' LEU . 8.1 tt0 -74.86 -36.36 62.32 Favored 'General case' 0 N--CA 1.482 1.155 0 N-CA-C 109.906 -0.405 . . . . 52.3 109.906 -178.597 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 77' ' ' LEU . . . . . 0.477 ' HG ' ' O ' ' A' ' 73' ' ' ASP . 89.5 mt -67.38 -40.7 85.7 Favored 'General case' 0 C--N 1.351 0.654 0 O-C-N 123.84 0.712 . . . . 64.25 109.347 176.602 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 78' ' ' LEU . . . . . 0.686 HD21 ' HA ' ' A' ' 22' ' ' LEU . 73.0 mt -63.82 -62.85 1.38 Allowed 'General case' 0 N--CA 1.482 1.131 0 C-N-CA 123.915 0.886 . . . . 44.33 112.242 177.739 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 79' ' ' LYS . . . . . 0.443 ' HA ' HD12 ' A' ' 82' ' ' LEU . 1.0 OUTLIER -66.43 -32.89 74.54 Favored 'General case' 0 N--CA 1.476 0.873 0 C-N-CA 123.558 0.743 . . . . 72.2 110.479 -174.442 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -65.85 -40.68 95.65 Favored Glycine 0 C--N 1.349 1.262 0 CA-C-N 115.832 -0.622 . . . . 62.31 112.353 173.843 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 81' ' ' LEU . . . . . 0.433 ' HB2' ' O ' ' A' ' 77' ' ' LEU . 6.0 tt -62.13 -40.22 95.18 Favored 'General case' 0 N--CA 1.487 1.377 0 C-N-CA 124.217 1.007 . . . . 72.13 109.612 175.743 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 82' ' ' LEU . . . . . 0.443 HD12 ' HA ' ' A' ' 79' ' ' LYS . 99.1 mt . . . . . 0 C--N 1.358 0.96 0 O-C-N 124.07 0.856 . . . . 72.42 110.11 -179.391 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 92' ' ' LEU . . . . . 0.472 HD21 HD22 ' A' ' 41' ' ' LEU . 59.5 mt . . . . . 0 N--CA 1.484 1.254 0 N-CA-C 108.317 -0.994 . . . . 60.23 108.317 . . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 93' ' ' ILE . . . . . 0.539 ' HB ' HG21 ' A' ' 97' ' ' THR . 68.7 mt -51.26 -40.88 23.66 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.61 0 CA-C-O 121.364 0.602 . . . . 55.31 110.401 167.072 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 179.07 -174.69 46.7 Favored Glycine 0 C--O 1.242 0.63 0 CA-C-N 114.724 -1.125 . . . . 25.24 110.711 175.211 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 18.3 mm100 -75.82 149.53 37.87 Favored 'General case' 0 CA--C 1.541 0.631 0 N-CA-C 110.172 -0.307 . . . . 60.53 110.172 174.722 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 29.9 t 75.77 -16.6 0.58 Allowed 'General case' 0 N--CA 1.484 1.247 0 C-N-CA 125.865 1.666 . . . . 44.02 113.119 -174.554 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 97' ' ' THR . . . . . 0.539 HG21 ' HB ' ' A' ' 93' ' ' ILE . 86.7 m -59.52 -36.86 76.93 Favored 'General case' 0 N--CA 1.477 0.89 0 C-N-CA 123.4 0.68 . . . . 70.24 112.186 -176.109 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 98' ' ' ARG . . . . . 0.547 ' HG3' ' H ' ' A' ' 99' ' ' GLN . 0.0 OUTLIER -56.42 -57.28 12.98 Favored 'General case' 0 CA--C 1.554 1.119 0 O-C-N 123.434 0.459 . . . . 74.32 111.665 -178.936 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 99' ' ' GLN . . . . . 0.547 ' H ' ' HG3' ' A' ' 98' ' ' ARG . 23.1 tm0? -78.64 -42.48 28.65 Favored 'General case' 0 C--N 1.349 0.558 0 N-CA-C 109.28 -0.637 . . . . 73.12 109.28 -170.643 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 4.5 tppp? -62.53 -52.36 63.77 Favored 'General case' 0 CA--C 1.539 0.525 0 O-C-N 123.707 0.629 . . . . 74.55 110.992 -176.592 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 33.3 t -72.89 -36.87 67.41 Favored 'General case' 0 CA--C 1.543 0.692 0 O-C-N 123.61 0.569 . . . . 74.51 111.449 -174.973 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 5.0 tp -75.98 -32.81 59.65 Favored 'General case' 0 N--CA 1.487 1.403 0 CA-C-N 118.21 0.459 . . . . 63.21 111.4 -177.743 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 7.5 t30 -78.91 -31.03 45.14 Favored 'General case' 0 N--CA 1.489 1.517 0 C-N-CA 123.326 0.65 . . . . 62.55 110.35 176.87 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 53.1 t30 -66.03 -38.75 89.21 Favored 'General case' 0 N--CA 1.487 1.393 0 C-N-CA 123.604 0.761 . . . . 75.45 109.384 171.859 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -60.49 -48.57 81.18 Favored 'General case' 0 CA--C 1.54 0.586 0 CA-C-N 115.002 -0.999 . . . . 73.52 110.522 175.459 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 106' ' ' TYR . . . . . 0.616 ' HE2' ' HB2' ' A' ' 69' ' ' LYS . 6.3 t80 -56.28 -45.07 80.29 Favored 'General case' 0 C--N 1.355 0.84 0 O-C-N 123.62 0.575 . . . . 72.42 110.18 174.702 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -58.32 -43.56 95.55 Favored Glycine 0 C--N 1.354 1.568 0 O-C-N 123.842 0.714 . . . . 71.33 112.882 -177.285 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 99.7 mtt180 -68.47 -37.93 80.6 Favored 'General case' 0 CA--C 1.544 0.715 0 C-N-CA 123.196 0.598 . . . . 73.52 111.116 177.615 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 109' ' ' LEU . . . . . 0.492 ' HA ' ' N ' ' A' ' 114' ' ' LEU . 35.8 tp -72.84 -31.15 64.57 Favored 'General case' 0 N--CA 1.488 1.449 0 C-N-CA 123.06 0.544 . . . . 65.42 111.554 -178.383 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 33.3 t -79.87 -32.55 40.43 Favored 'General case' 0 CA--C 1.537 0.48 0 C-N-CA 123.789 0.836 . . . . 65.05 109.337 178.148 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . -87.9 -64.35 1.36 Allowed Glycine 0 C--N 1.36 1.904 0 CA-C-O 119.164 -0.798 . . . . 62.21 113.606 -178.439 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 112' ' ' MET . . . . . . . . . . . . . 21.7 mmm -96.98 -69.0 0.77 Allowed 'General case' 0 N--CA 1.489 1.518 0 CA-C-N 118.34 1.07 . . . . 74.04 113.194 178.058 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 13.6 tp 172.03 25.7 0.0 OUTLIER 'General case' 0 N--CA 1.495 1.786 0 O-C-N 123.77 0.669 . . . . 74.24 110.888 -173.3 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 114' ' ' LEU . . . . . 0.492 ' N ' ' HA ' ' A' ' 109' ' ' LEU . 41.5 tp . . . . . 0 N--CA 1.501 2.092 0 C-N-CA 126.571 1.948 . . . . 71.14 111.9 -177.443 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 1' ' ' MET . . . . . 0.605 ' HG2' ' HB ' ' A' ' 4' ' ' THR . 0.0 OUTLIER . . . . . 0 CA--C 1.55 0.96 0 N-CA-C 109.362 -0.607 . . . . 74.14 109.362 . . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 42.2 p -57.81 -48.05 80.85 Favored 'General case' 0 N--CA 1.479 1.011 0 C-N-CA 124.411 1.084 . . . . 62.24 113.555 -166.531 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 36.2 m -66.08 -38.52 88.49 Favored 'General case' 0 N--CA 1.476 0.873 0 O-C-N 123.522 0.514 . . . . 70.54 111.543 -176.078 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 4' ' ' THR . . . . . 0.618 ' HA ' ' HG3' ' A' ' 53' ' ' PRO . 15.0 m -76.24 -38.65 56.07 Favored 'General case' 0 N--CA 1.475 0.822 0 O-C-N 123.576 0.547 . . . . 62.25 112.155 -176.575 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 85.5 t -67.86 -40.52 83.7 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.87 0 N-CA-C 109.612 -0.514 . . . . 74.33 109.612 177.109 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 6' ' ' GLU . . . . . 0.505 ' O ' ' HG3' ' A' ' 10' ' ' ARG . 2.6 tm-20 -64.67 -36.83 85.53 Favored 'General case' 0 CA--C 1.549 0.922 0 C-N-CA 123.666 0.786 . . . . 73.34 109.854 175.694 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 7' ' ' PHE . . . . . 0.44 ' HZ ' HD13 ' A' ' 114' ' ' LEU . 81.3 t80 -64.26 -47.21 80.49 Favored 'General case' 0 N--CA 1.481 1.083 0 C-N-CA 124.764 1.225 . . . . 75.35 111.851 177.342 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 8' ' ' ILE . . . . . 0.436 ' O ' ' HG3' ' A' ' 12' ' ' GLN . 79.1 mt -62.99 -39.71 86.23 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.91 0 N-CA-C 109.042 -0.725 . . . . 41.42 109.042 175.588 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 2.4 t-20 -61.06 -35.54 77.21 Favored 'General case' 0 N--CA 1.484 1.231 0 C-N-CA 124.695 1.198 . . . . 61.21 111.151 178.146 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 10' ' ' ARG . . . . . 0.505 ' HG3' ' O ' ' A' ' 6' ' ' GLU . 42.1 mtt180 -59.15 -56.7 18.86 Favored 'General case' 0 N--CA 1.474 0.757 0 C-N-CA 123.473 0.709 . . . . 65.01 109.269 172.416 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 11' ' ' TRP . . . . . 0.424 ' CD1' HG13 ' A' ' 64' ' ' VAL . 93.8 m95 -69.68 -23.47 63.46 Favored 'General case' 0 N--CA 1.468 0.468 0 CA-C-N 114.966 -1.015 . . . . 74.52 112.758 -175.704 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 12' ' ' GLN . . . . . 0.436 ' HG3' ' O ' ' A' ' 8' ' ' ILE . 59.3 mt-30 -66.84 -50.37 62.77 Favored 'General case' 0 N--CA 1.473 0.724 0 N-CA-C 108.141 -1.059 . . . . 71.12 108.141 172.436 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 13' ' ' ARG . . . . . 0.575 ' HE ' HD11 ' A' ' 17' ' ' LEU . 13.2 tpt180 -57.25 -47.9 80.21 Favored 'General case' 0 CA--C 1.549 0.922 0 O-C-N 124.249 0.968 . . . . 71.45 111.221 -177.758 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 14' ' ' ILE . . . . . 0.661 HD11 HG21 ' A' ' 47' ' ' VAL . 49.0 mt -67.95 -46.17 82.45 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.063 0 CA-C-N 115.744 -0.662 . . . . 72.03 110.247 -177.309 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 15' ' ' ALA . . . . . 0.431 ' HB1' ' OE1' ' A' ' 70' ' ' GLN . . . -61.55 -44.79 96.4 Favored 'General case' 0 N--CA 1.484 1.265 0 C-N-CA 123.614 0.766 . . . . 64.11 112.038 -178.449 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 85.4 mt -71.18 -44.68 64.98 Favored 'General case' 0 N--CA 1.477 0.897 0 CA-C-N 114.838 -1.073 . . . . 64.24 110.843 -175.541 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.575 HD11 ' HE ' ' A' ' 13' ' ' ARG . 43.0 mt -72.24 -31.94 66.25 Favored 'General case' 0 N--CA 1.477 0.912 0 CA-C-O 118.874 -0.584 . . . . 71.01 112.025 -178.094 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 83.0 p -70.71 -39.45 73.41 Favored 'General case' 0 N--CA 1.486 1.34 0 CA-C-N 118.406 0.548 . . . . 73.1 110.284 175.944 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 19.4 tp60 -57.89 -43.6 86.22 Favored 'General case' 0 C--O 1.25 1.083 0 CA-C-N 115.344 -0.844 . . . . 75.35 110.079 172.183 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 49.8 m -60.01 -57.88 10.94 Favored 'General case' 0 C--N 1.353 0.753 0 CA-C-N 114.832 -1.076 . . . . 73.01 109.98 176.772 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 21' ' ' LEU . . . . . 0.539 HD22 ' HG ' ' A' ' 33' ' ' LEU . 65.1 mt -57.64 -33.77 68.64 Favored 'General case' 0 N--CA 1.479 0.989 0 C-N-CA 123.607 0.763 . . . . 63.15 111.241 -175.421 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 22' ' ' LEU . . . . . 0.65 ' HA ' HD21 ' A' ' 78' ' ' LEU . 64.4 tp -63.34 -61.55 2.27 Favored 'General case' 0 C--O 1.251 1.149 0 O-C-N 123.791 0.682 . . . . 72.31 110.315 177.375 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 23' ' ' GLU . . . . . 0.468 ' O ' ' HG3' ' A' ' 27' ' ' ARG . 94.6 mt-10 -57.81 -48.0 80.99 Favored 'General case' 0 C--N 1.356 0.88 0 O-C-N 124.178 0.924 . . . . 74.52 110.58 -177.392 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 95.7 mt -62.02 -39.44 92.27 Favored 'General case' 0 N--CA 1.476 0.861 0 C-N-CA 124.558 1.143 . . . . 71.55 111.757 -176.605 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 25' ' ' ALA . . . . . 0.433 ' HB2' HD21 ' A' ' 33' ' ' LEU . . . -61.11 -44.36 97.47 Favored 'General case' 0 N--CA 1.484 1.228 0 CA-C-O 121.138 0.494 . . . . 53.23 110.904 175.958 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 81.5 mt-30 -68.03 -32.24 72.47 Favored 'General case' 0 CA--C 1.551 0.997 0 CA-C-N 114.937 -1.029 . . . . 70.24 111.471 177.3 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 27' ' ' ARG . . . . . 0.468 ' HG3' ' O ' ' A' ' 23' ' ' GLU . 89.3 mtt-85 -74.67 -20.06 60.02 Favored 'General case' 0 N--CA 1.486 1.366 0 C-N-CA 123.74 0.816 . . . . 74.11 111.226 178.811 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 94.44 5.68 61.66 Favored Glycine 0 C--N 1.351 1.385 0 O-C-N 123.272 0.358 . . . . 71.22 112.72 -176.237 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 29' ' ' GLU . . . . . 0.419 ' HG2' ' HB2' ' A' ' 27' ' ' ARG . 7.6 mm-40 -83.07 52.79 2.26 Favored 'General case' 0 CA--C 1.549 0.94 0 C-N-CA 124.058 0.943 . . . . 71.03 110.541 178.989 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 30' ' ' TRP . . . . . 0.468 ' O ' ' HG ' ' A' ' 34' ' ' LEU . 94.6 m95 -66.87 -23.81 66.06 Favored 'General case' 0 N--CA 1.473 0.695 0 C-N-CA 123.56 0.744 . . . . 71.43 111.454 -178.936 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 15.2 m-20 -54.22 -46.67 72.57 Favored 'General case' 0 N--CA 1.478 0.928 0 C-N-CA 123.754 0.821 . . . . 74.22 110.078 172.098 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 93.5 mt -63.26 -33.83 76.35 Favored 'General case' 0 C--O 1.215 -0.725 0 CA-C-N 114.905 -1.043 . . . . 75.05 110.81 178.069 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 33' ' ' LEU . . . . . 0.539 ' HG ' HD22 ' A' ' 21' ' ' LEU . 8.1 mp -68.36 -39.89 81.66 Favored 'General case' 0 N--CA 1.488 1.457 0 CA-C-N 118.053 0.388 . . . . 73.31 111.202 174.138 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.468 ' HG ' ' O ' ' A' ' 30' ' ' TRP . 93.8 mt -65.03 -38.37 90.67 Favored 'General case' 0 N--CA 1.487 1.386 0 C-N-CA 123.555 0.742 . . . . 62.51 111.542 -177.681 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 1.7 mp0 -77.22 -56.86 4.2 Favored 'General case' 0 N--CA 1.475 0.809 0 CA-C-N 116.068 -0.514 . . . . 64.53 110.643 176.986 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 82.3 mm-40 -66.81 -14.56 62.8 Favored 'General case' 0 N--CA 1.484 1.227 0 CA-C-O 118.726 -0.654 . . . . 50.15 112.6 -174.956 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 42.9 tt0 -52.79 -57.8 8.99 Favored 'General case' 0 N--CA 1.481 1.115 0 C-N-CA 123.666 0.786 . . . . 74.55 111.308 175.577 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 61.5 t -56.97 -43.88 81.61 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.163 0 C-N-CA 123.515 0.726 . . . . 70.22 111.318 -175.078 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 18.5 p -74.88 -45.49 42.59 Favored 'General case' 0 N--CA 1.477 0.91 0 C-N-CA 123.643 0.777 . . . . 63.14 112.343 -175.255 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 27.0 t80 -62.9 -42.78 99.9 Favored 'General case' 0 N--CA 1.482 1.155 0 C-N-CA 124.02 0.928 . . . . 73.54 110.821 179.963 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 41' ' ' LEU . . . . . 0.682 ' HA ' HG22 ' A' ' 44' ' ' ILE . 88.5 mt -78.47 -31.43 47.88 Favored 'General case' 0 C--O 1.222 -0.378 0 CA-C-N 115.556 -0.747 . . . . 64.33 111.175 -176.444 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 23.4 tm0? -59.59 -43.6 93.63 Favored 'General case' 0 N--CA 1.476 0.864 0 N-CA-C 108.831 -0.803 . . . . 71.15 108.831 170.005 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 43' ' ' SER . . . . . 0.565 ' O ' HG23 ' A' ' 47' ' ' VAL . 61.6 m -60.59 -55.08 37.68 Favored 'General case' 0 C--N 1.353 0.728 0 O-C-N 123.946 0.779 . . . . 72.33 111.106 178.478 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 44' ' ' ILE . . . . . 0.682 HG22 ' HA ' ' A' ' 41' ' ' LEU . 17.2 tt -65.42 -34.51 70.92 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.329 0 C-N-CA 123.019 0.528 . . . . 74.0 111.697 -172.961 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 21.6 mm-40 -61.27 -50.35 73.38 Favored 'General case' 0 C--N 1.356 0.882 0 C-N-CA 123.494 0.718 . . . . 63.35 109.836 172.078 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 46' ' ' THR . . . . . 0.422 ' O ' ' HB2' ' A' ' 50' ' ' LYS . 97.5 m -54.12 -39.02 66.04 Favored 'General case' 0 N--CA 1.481 1.105 0 C-N-CA 124.352 1.061 . . . . 72.31 111.534 177.419 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 47' ' ' VAL . . . . . 0.661 HG21 HD11 ' A' ' 14' ' ' ILE . 84.5 t -68.57 -45.0 82.41 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.969 0 C-N-CA 124.005 0.922 . . . . 75.4 111.447 -178.317 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 48' ' ' MET . . . . . . . . . . . . . 77.5 mtm -67.34 -31.49 71.79 Favored 'General case' 0 N--CA 1.482 1.149 0 O-C-N 123.491 0.494 . . . . 73.55 111.29 178.214 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 48.2 mt-10 -72.2 -31.2 65.67 Favored 'General case' 0 N--CA 1.481 1.086 0 C-N-CA 123.652 0.781 . . . . 60.32 110.975 174.576 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 50' ' ' LYS . . . . . 0.422 ' HB2' ' O ' ' A' ' 46' ' ' THR . 4.6 tppt? -79.5 160.44 26.53 Favored 'General case' 0 N--CA 1.474 0.755 0 C-N-CA 123.151 0.58 . . . . 44.01 111.858 -168.871 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 52.6 tt0 -81.95 124.87 30.13 Favored 'General case' 0 C--O 1.241 0.642 0 CA-C-N 115.165 -0.925 . . . . 64.3 110.814 -176.968 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 52' ' ' THR . . . . . 0.791 HG21 ' HB3' ' A' ' 114' ' ' LEU . 96.7 m -69.93 122.85 87.35 Favored Pre-proline 0 CA--C 1.551 0.984 0 N-CA-C 109.162 -0.681 . . . . 74.03 109.162 166.765 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 53' ' ' PRO . . . . . 0.618 ' HG3' ' HA ' ' A' ' 4' ' ' THR . 72.0 Cg_endo -69.28 156.91 63.23 Favored 'Trans proline' 0 C--N 1.369 1.645 0 C-N-CA 123.002 2.468 . . . . 62.24 112.573 178.458 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 56.7 Cg_endo -70.7 -44.61 1.36 Allowed 'Trans proline' 0 C--N 1.371 1.723 0 C-N-CA 122.526 2.151 . . . . 74.43 111.471 172.194 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . -75.04 68.93 1.94 Allowed Glycine 0 C--N 1.352 1.419 0 N-CA-C 115.048 0.779 . . . . 41.01 115.048 -172.087 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 56' ' ' ILE . . . . . 0.527 HG23 HG22 ' A' ' 60' ' ' ILE . 84.5 mt -110.24 108.46 25.48 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.656 0 N-CA-C 107.579 -1.267 . . . . 72.34 107.579 176.53 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 42.8 p -82.27 -172.45 3.99 Favored 'General case' 0 N--CA 1.483 1.176 0 C-N-CA 123.016 0.526 . . . . 71.33 110.552 -177.625 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 29.8 tpt85 -63.06 -60.33 3.59 Favored 'General case' 0 N--CA 1.475 0.794 0 C-N-CA 123.275 0.63 . . . . 64.14 110.639 -178.771 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 21.0 m -62.4 -33.6 75.09 Favored 'General case' 0 N--CA 1.475 0.798 0 C-N-CA 123.595 0.758 . . . . 51.34 111.731 -178.101 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 60' ' ' ILE . . . . . 0.527 HG22 HG23 ' A' ' 56' ' ' ILE . 74.4 mt -65.07 -43.68 95.85 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.81 0 C-N-CA 122.921 0.488 . . . . 55.42 110.125 175.087 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 60.3 tt0 -64.55 -36.64 84.89 Favored 'General case' 0 N--CA 1.48 1.072 0 C-N-CA 123.322 0.649 . . . . 73.12 111.036 179.196 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 26.5 m-20 -65.64 -46.66 78.36 Favored 'General case' 0 N--CA 1.474 0.731 0 C-N-CA 123.001 0.52 . . . . 75.32 110.853 176.976 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 63' ' ' MET . . . . . . . . . . . . . 73.3 mtm -65.96 -46.67 77.27 Favored 'General case' 0 N--CA 1.476 0.867 0 O-C-N 123.307 0.38 . . . . 72.15 111.014 -179.692 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 64' ' ' VAL . . . . . 0.494 ' O ' HG13 ' A' ' 68' ' ' ILE . 52.0 t -63.78 -60.55 2.58 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.566 0 C-N-CA 123.474 0.709 . . . . 74.41 110.615 -178.535 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 65' ' ' ALA . . . . . 0.571 ' HB2' HD23 ' A' ' 109' ' ' LEU . . . -60.59 -33.11 72.25 Favored 'General case' 0 N--CA 1.487 1.397 0 O-C-N 123.403 0.44 . . . . 62.53 111.519 -179.896 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -65.03 -38.04 94.95 Favored Glycine 0 C--N 1.347 1.146 0 CA-C-N 116.3 -0.409 . . . . 63.44 112.316 175.743 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 67' ' ' TYR . . . . . 0.5 ' O ' HG22 ' A' ' 71' ' ' THR . 17.4 m-30 -74.72 -33.55 62.4 Favored 'General case' 0 N--CA 1.473 0.679 0 C-N-CA 123.218 0.607 . . . . 53.4 111.238 177.563 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 68' ' ' ILE . . . . . 0.494 HG13 ' O ' ' A' ' 64' ' ' VAL . 59.8 mt -63.68 -49.06 83.83 Favored 'Isoleucine or valine' 0 C--N 1.36 1.052 0 N-CA-C 108.663 -0.866 . . . . 71.41 108.663 175.63 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 69' ' ' LYS . . . . . 0.51 ' HB2' ' HE2' ' A' ' 106' ' ' TYR . 44.0 tptt -56.33 -44.65 80.21 Favored 'General case' 0 C--N 1.349 0.555 0 C-N-CA 123.572 0.749 . . . . 74.11 110.901 174.64 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 70' ' ' GLN . . . . . 0.431 ' OE1' ' HB1' ' A' ' 15' ' ' ALA . 63.4 tt0 -61.47 -45.72 93.06 Favored 'General case' 0 C--N 1.349 0.549 0 O-C-N 123.679 0.612 . . . . 71.02 111.077 -177.49 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 71' ' ' THR . . . . . 0.5 HG22 ' O ' ' A' ' 67' ' ' TYR . 3.0 t -74.7 -39.73 61.78 Favored 'General case' 0 C--N 1.355 0.824 0 CA-C-O 119.646 -0.216 . . . . 75.52 111.12 -175.185 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 72' ' ' LEU . . . . . 0.487 HD21 ' HB2' ' A' ' 102' ' ' LEU . 44.2 mt -64.85 -39.0 92.85 Favored 'General case' 0 N--CA 1.472 0.67 0 C-N-CA 122.11 0.164 . . . . 75.31 111.069 178.578 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 73' ' ' ASP . . . . . 0.444 ' O ' ' HG ' ' A' ' 77' ' ' LEU . 14.2 t70 -65.71 -59.63 3.72 Favored 'General case' 0 CA--C 1.543 0.686 0 O-C-N 123.994 0.809 . . . . 70.42 109.677 -178.702 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 84.1 m-20 -59.52 -45.22 92.38 Favored 'General case' 0 N--CA 1.485 1.317 0 C-N-CA 124.036 0.934 . . . . 55.11 111.778 -176.2 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 3.3 tm-20 -75.05 -29.86 60.85 Favored 'General case' 0 CA--C 1.555 1.166 0 CA-C-N 115.661 -0.7 . . . . 73.24 110.413 -174.477 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 9.4 tt0 -75.27 -29.62 60.21 Favored 'General case' 0 N--CA 1.488 1.458 0 O-C-N 122.056 -0.403 . . . . 75.33 110.746 175.076 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 77' ' ' LEU . . . . . 0.444 ' HG ' ' O ' ' A' ' 73' ' ' ASP . 93.2 mt -65.43 -39.99 92.77 Favored 'General case' 0 N--CA 1.48 1.07 0 N-CA-C 109.428 -0.582 . . . . 61.01 109.428 172.475 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 78' ' ' LEU . . . . . 0.65 HD21 ' HA ' ' A' ' 22' ' ' LEU . 72.7 mt -58.23 -47.67 82.81 Favored 'General case' 0 N--CA 1.477 0.889 0 CA-C-N 115.378 -0.828 . . . . 74.32 111.246 170.476 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 79' ' ' LYS . . . . . 0.421 ' HA ' ' HD3' ' A' ' 79' ' ' LYS . 25.9 mmtp -66.92 -28.56 68.4 Favored 'General case' 0 N--CA 1.475 0.81 0 C-N-CA 123.161 0.584 . . . . 62.24 112.463 -177.991 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -72.26 -33.99 61.38 Favored Glycine 0 C--N 1.347 1.175 0 N-CA-C 111.572 -0.611 . . . . 54.02 111.572 171.259 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 7.1 tt -73.61 -36.11 65.45 Favored 'General case' 0 CA--C 1.554 1.125 0 C-N-CA 124.224 1.009 . . . . 41.3 110.266 177.762 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 82' ' ' LEU . . . . . 0.411 ' HG ' ' O ' ' A' ' 78' ' ' LEU . 95.1 mt . . . . . 0 C--N 1.357 0.929 0 C-N-CA 123.078 0.551 . . . . 73.32 111.258 -171.973 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 92' ' ' LEU . . . . . 0.491 HD11 HD22 ' A' ' 41' ' ' LEU . 64.4 mt . . . . . 0 N--CA 1.49 1.536 0 N-CA-C 110.324 -0.25 . . . . 73.12 110.324 . . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 59.0 mt -62.03 92.16 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.482 1.14 0 C-N-CA 124.365 1.066 . . . . 63.21 111.877 -172.954 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 60.78 30.57 73.05 Favored Glycine 0 C--N 1.353 1.499 0 CA-C-N 115.769 -0.651 . . . . 63.24 113.506 178.83 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 21.0 pt20 42.18 36.39 0.7 Allowed 'General case' 0 N--CA 1.497 1.918 0 C-N-CA 126.297 1.839 . . . . 73.14 112.849 -172.392 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 72.7 m -155.0 -168.48 2.89 Favored 'General case' 0 N--CA 1.48 1.051 0 C-N-CA 125.719 1.608 . . . . 73.11 107.873 178.138 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 54.0 m 76.83 -42.53 0.42 Allowed 'General case' 0 N--CA 1.49 1.564 0 C-N-CA 124.678 1.191 . . . . 73.31 113.473 170.159 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 1.1 tmm_? -50.81 -51.24 52.77 Favored 'General case' 0 N--CA 1.482 1.135 0 C-N-CA 125.301 1.44 . . . . 75.13 111.522 -170.291 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 30.8 tt0 -61.61 -45.82 92.44 Favored 'General case' 0 C--N 1.355 0.831 0 O-C-N 123.496 0.497 . . . . 71.21 109.975 -175.781 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 64.4 tttp -68.29 -29.26 67.99 Favored 'General case' 0 N--CA 1.482 1.162 0 O-C-N 124.098 0.874 . . . . 71.04 111.737 179.542 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 35.1 t -72.79 -41.29 65.14 Favored 'General case' 0 N--CA 1.478 0.957 0 C-N-CA 123.361 0.665 . . . . 44.43 110.282 -177.551 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 102' ' ' LEU . . . . . 0.487 ' HB2' HD21 ' A' ' 72' ' ' LEU . 9.2 mp -79.36 -23.73 43.16 Favored 'General case' 0 N--CA 1.476 0.841 0 CA-C-N 116.07 -0.514 . . . . 61.25 110.934 174.97 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -72.46 -34.15 67.52 Favored 'General case' 0 N--CA 1.482 1.175 0 N-CA-C 108.602 -0.888 . . . . 72.15 108.602 174.476 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 9.6 t30 -71.65 -37.34 70.83 Favored 'General case' 0 N--CA 1.474 0.753 0 CA-C-N 115.213 -0.903 . . . . 73.11 109.226 174.037 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 105' ' ' ALA . . . . . 0.454 ' O ' ' HG ' ' A' ' 114' ' ' LEU . . . -61.1 -48.96 79.25 Favored 'General case' 0 CA--C 1.538 0.502 0 O-C-N 123.733 0.646 . . . . 75.24 110.315 175.504 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 106' ' ' TYR . . . . . 0.51 ' HE2' ' HB2' ' A' ' 69' ' ' LYS . 7.8 t80 -61.14 -51.9 67.14 Favored 'General case' 0 CA--C 1.541 0.611 0 CA-C-N 116.008 -0.542 . . . . 73.34 109.733 179.564 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -63.37 -44.48 96.78 Favored Glycine 0 C--N 1.354 1.581 0 O-C-N 124.212 0.945 . . . . 74.35 113.19 -173.815 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 5.8 tpm_? -69.13 -34.29 74.79 Favored 'General case' 0 C--N 1.348 0.522 0 C-N-CA 122.996 0.518 . . . . 72.33 109.909 179.935 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 109' ' ' LEU . . . . . 0.571 HD23 ' HB2' ' A' ' 65' ' ' ALA . 54.9 tp -65.91 -45.76 80.75 Favored 'General case' 0 N--CA 1.488 1.426 0 C-N-CA 123.055 0.542 . . . . 62.2 110.616 176.072 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 42.4 t -59.59 -48.58 81.11 Favored 'General case' 0 CA--C 1.531 0.249 0 O-C-N 124.738 1.274 . . . . 73.12 110.551 -176.471 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . -85.4 -59.32 1.94 Allowed Glycine 0 C--N 1.356 1.646 0 CA-C-O 119.299 -0.723 . . . . 65.52 112.957 -178.463 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 112' ' ' MET . . . . . . . . . . . . . 8.0 tpt -93.07 -70.4 0.7 Allowed 'General case' 0 N--CA 1.489 1.479 0 CA-C-N 118.216 1.008 . . . . 75.52 113.143 -178.011 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 113' ' ' LEU . . . . . 0.416 HD11 ' HB ' ' A' ' 56' ' ' ILE . 15.1 tp 168.36 13.9 0.0 OUTLIER 'General case' 0 N--CA 1.507 2.379 0 C-N-CA 123.575 0.75 . . . . 74.44 112.267 -173.498 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 114' ' ' LEU . . . . . 0.791 ' HB3' HG21 ' A' ' 52' ' ' THR . 0.9 OUTLIER . . . . . 0 N--CA 1.502 2.138 0 C-N-CA 125.089 1.356 . . . . 72.32 109.98 -176.153 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 1' ' ' MET . . . . . 0.435 ' O ' HG23 ' A' ' 5' ' ' VAL . 16.5 tpt . . . . . 0 N--CA 1.487 1.376 0 CA-C-O 119.325 -0.369 . . . . 70.34 111.383 . . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 30.5 p -55.63 -51.36 67.45 Favored 'General case' 0 N--CA 1.489 1.488 0 C-N-CA 123.224 0.61 . . . . 54.1 112.229 -176.647 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 35.6 m -64.55 -29.58 70.61 Favored 'General case' 0 CA--C 1.541 0.601 0 CA-C-N 115.551 -0.749 . . . . 72.5 111.14 178.576 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 4' ' ' THR . . . . . 0.503 ' HA ' ' HG3' ' A' ' 53' ' ' PRO . 4.5 m -74.13 -33.3 63.5 Favored 'General case' 0 N--CA 1.473 0.688 0 C-N-CA 123.36 0.664 . . . . 70.13 110.976 178.845 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 5' ' ' VAL . . . . . 0.435 HG23 ' O ' ' A' ' 1' ' ' MET . 89.5 t -69.39 -45.64 78.33 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.793 0 N-CA-C 109.273 -0.64 . . . . 71.53 109.273 177.045 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 25.1 mm-40 -55.07 -47.76 74.43 Favored 'General case' 0 N--CA 1.478 0.961 0 O-C-N 123.627 0.579 . . . . 73.31 110.831 172.789 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 7' ' ' PHE . . . . . 0.672 ' HZ ' HD11 ' A' ' 109' ' ' LEU . 72.8 t80 -55.38 -61.8 2.09 Favored 'General case' 0 CA--C 1.558 1.275 0 C-N-CA 124.621 1.168 . . . . 73.11 111.922 -178.573 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 8' ' ' ILE . . . . . 0.411 ' O ' ' HG3' ' A' ' 12' ' ' GLN . 65.2 mt -57.77 -48.79 82.8 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.08 0 C-N-CA 123.473 0.709 . . . . 63.35 110.615 -178.905 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 66.0 t30 -65.32 -37.82 88.28 Favored 'General case' 0 N--CA 1.473 0.679 0 O-C-N 124.067 0.855 . . . . 71.24 111.818 -171.329 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 56.3 mtt180 -69.67 -38.59 77.11 Favored 'General case' 0 CA--C 1.543 0.677 0 CA-C-N 116.151 -0.477 . . . . 75.12 110.343 176.674 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 11' ' ' TRP . . . . . . . . . . . . . 80.0 m95 -68.82 -27.92 66.28 Favored 'General case' 0 N--CA 1.488 1.44 0 N-CA-C 112.054 0.39 . . . . 63.24 112.054 174.419 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 12' ' ' GLN . . . . . 0.411 ' HG3' ' O ' ' A' ' 8' ' ' ILE . 56.1 mt-30 -64.12 -47.69 79.0 Favored 'General case' 0 N--CA 1.478 0.945 0 N-CA-C 109.083 -0.71 . . . . 52.14 109.083 172.581 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 15.7 tpt180 -54.24 -49.75 68.77 Favored 'General case' 0 CA--C 1.548 0.875 0 C-N-CA 124.036 0.934 . . . . 73.12 110.889 177.735 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 14' ' ' ILE . . . . . 0.487 HD11 HG21 ' A' ' 47' ' ' VAL . 96.9 mt -59.95 -52.56 59.7 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.894 0 C-N-CA 124.236 1.015 . . . . 74.14 111.582 -178.104 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -60.06 -45.2 93.64 Favored 'General case' 0 N--CA 1.474 0.746 0 C-N-CA 123.599 0.759 . . . . 72.05 112.037 -176.55 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 96.1 mt -69.27 -40.8 77.56 Favored 'General case' 0 N--CA 1.475 0.804 0 CA-C-N 114.956 -1.02 . . . . 55.25 111.107 -177.517 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.51 ' O ' ' HG ' ' A' ' 21' ' ' LEU . 43.1 mt -62.19 -51.92 65.87 Favored 'General case' 0 N--CA 1.478 0.927 0 C-N-CA 122.798 0.439 . . . . 63.03 110.485 177.894 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 77.8 p -61.94 -40.41 95.43 Favored 'General case' 0 N--CA 1.475 0.817 0 C-N-CA 123.275 0.63 . . . . 71.01 111.501 -176.676 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 6.6 tp-100 -63.75 -42.24 97.87 Favored 'General case' 0 C--N 1.36 1.034 0 O-C-N 123.294 0.371 . . . . 61.14 110.428 176.694 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 65.5 m -60.52 -45.45 93.79 Favored 'General case' 0 CA--C 1.538 0.498 0 O-C-N 123.468 0.48 . . . . 52.04 110.712 176.248 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 21' ' ' LEU . . . . . 0.668 HD22 ' HA ' ' A' ' 33' ' ' LEU . 69.6 mt -63.29 -33.54 75.73 Favored 'General case' 0 N--CA 1.476 0.839 0 C-N-CA 123.347 0.659 . . . . 75.2 110.696 -179.092 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 22' ' ' LEU . . . . . 0.661 ' HA ' HD21 ' A' ' 78' ' ' LEU . 57.9 tp -67.56 -53.34 29.2 Favored 'General case' 0 CA--C 1.544 0.724 0 C-N-CA 123.183 0.593 . . . . 62.42 110.677 178.036 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 23' ' ' GLU . . . . . 0.413 ' O ' ' HG3' ' A' ' 27' ' ' ARG . 37.3 mt-10 -56.23 -47.87 77.62 Favored 'General case' 0 N--CA 1.481 1.093 0 C-N-CA 123.874 0.87 . . . . 54.12 110.556 179.035 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 24' ' ' LEU . . . . . 0.496 HD22 HD12 ' A' ' 32' ' ' LEU . 87.6 mt -66.02 -35.34 80.3 Favored 'General case' 0 C--O 1.217 -0.653 0 CA-C-N 114.961 -1.018 . . . . 55.05 110.996 -177.138 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 25' ' ' ALA . . . . . 0.521 ' HB2' HD21 ' A' ' 33' ' ' LEU . . . -65.04 -38.97 92.61 Favored 'General case' 0 N--CA 1.482 1.154 0 CA-C-O 121.019 0.438 . . . . 63.31 111.27 175.397 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 96.7 mt-30 -70.94 -27.72 63.97 Favored 'General case' 0 N--CA 1.48 1.041 0 CA-C-N 115.323 -0.853 . . . . 75.1 111.333 177.456 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 27' ' ' ARG . . . . . 0.454 ' HD2' HD23 ' A' ' 24' ' ' LEU . 96.9 mtt180 -78.07 -26.85 48.43 Favored 'General case' 0 N--CA 1.478 0.97 0 C-N-CA 123.385 0.674 . . . . 64.23 110.469 172.469 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 95.54 13.95 49.17 Favored Glycine 0 C--N 1.346 1.121 0 CA-C-N 115.992 -0.549 . . . . 70.12 113.37 -177.534 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 29' ' ' GLU . . . . . 0.431 ' HG2' ' HB2' ' A' ' 27' ' ' ARG . 8.7 mm-40 -84.88 59.38 5.55 Favored 'General case' 0 CA--C 1.553 1.076 0 C-N-CA 123.961 0.904 . . . . 70.53 110.326 176.713 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 30' ' ' TRP . . . . . . . . . . . . . 95.2 m95 -65.4 -22.3 66.77 Favored 'General case' 0 N--CA 1.485 1.302 0 C-N-CA 123.875 0.87 . . . . 74.54 111.714 -177.734 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 11.9 m-20 -53.56 -53.27 54.13 Favored 'General case' 0 C--N 1.35 0.62 0 O-C-N 123.753 0.658 . . . . 60.23 109.919 171.354 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 0.496 HD12 HD22 ' A' ' 24' ' ' LEU . 78.5 mt -63.19 -27.25 69.24 Favored 'General case' 0 N--CA 1.475 0.788 0 O-C-N 124.082 0.864 . . . . 73.53 111.444 -175.198 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 33' ' ' LEU . . . . . 0.668 ' HA ' HD22 ' A' ' 21' ' ' LEU . 9.0 mp -69.2 -54.92 12.33 Favored 'General case' 0 N--CA 1.479 0.988 0 C-N-CA 122.551 0.34 . . . . 65.24 110.421 174.253 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 91.0 mt -63.96 -29.03 70.23 Favored 'General case' 0 N--CA 1.484 1.255 0 O-C-N 123.814 0.696 . . . . 45.11 112.017 -176.344 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 94.1 mt-30 -71.67 -43.32 66.24 Favored 'General case' 0 N--CA 1.476 0.87 0 C-N-CA 123.374 0.669 . . . . 72.34 110.7 176.889 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 81.9 mm-40 -85.56 -14.47 45.7 Favored 'General case' 0 N--CA 1.481 1.095 0 C-N-CA 123.166 0.586 . . . . 71.4 112.369 -178.219 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 41.2 tt0 -51.81 -55.79 17.82 Favored 'General case' 0 N--CA 1.479 1.004 0 C-N-CA 125.069 1.348 . . . . 72.34 112.54 -173.621 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 63.9 t -62.77 -44.61 99.63 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.895 0 C-N-CA 122.754 0.421 . . . . 54.2 111.101 -175.407 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 65.3 m -65.43 -38.62 90.45 Favored 'General case' 0 N--CA 1.481 1.086 0 C-N-CA 123.021 0.528 . . . . 63.13 111.029 -178.908 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 46.1 t80 -66.73 -54.46 22.66 Favored 'General case' 0 CA--C 1.539 0.554 0 CA-C-N 115.262 -0.881 . . . . 74.03 110.761 -178.924 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 41' ' ' LEU . . . . . 0.489 HD22 HD21 ' A' ' 92' ' ' LEU . 75.3 mt -62.11 -38.71 89.95 Favored 'General case' 0 N--CA 1.477 0.88 0 O-C-N 123.746 0.654 . . . . 72.34 110.375 -177.641 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 54.0 tt0 -53.53 -57.23 11.44 Favored 'General case' 0 C--O 1.247 0.925 0 C-N-CA 124.253 1.021 . . . . 63.41 110.329 174.682 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 43' ' ' SER . . . . . 0.537 ' O ' HG23 ' A' ' 47' ' ' VAL . 51.6 m -54.02 -60.65 3.05 Favored 'General case' 0 CA--C 1.544 0.713 0 O-C-N 124.56 1.163 . . . . 73.4 111.397 179.496 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 44' ' ' ILE . . . . . 0.463 HG13 HD13 ' A' ' 14' ' ' ILE . 19.0 tt -60.15 -40.82 84.6 Favored 'Isoleucine or valine' 0 C--O 1.257 1.493 0 C-N-CA 123.677 0.791 . . . . 62.21 112.974 -168.586 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 45' ' ' GLU . . . . . 0.438 ' HG2' ' O ' ' A' ' 41' ' ' LEU . 23.1 mm-40 -67.99 -45.55 73.79 Favored 'General case' 0 C--N 1.348 0.538 0 CA-C-N 116.521 -0.309 . . . . 75.22 110.189 178.036 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 41.4 m -62.25 -26.36 68.34 Favored 'General case' 0 CA--C 1.56 1.349 0 O-C-N 123.38 0.425 . . . . 42.32 112.031 178.66 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 47' ' ' VAL . . . . . 0.537 HG23 ' O ' ' A' ' 43' ' ' SER . 59.3 t -72.12 -46.57 58.06 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.434 0 C-N-CA 122.718 0.407 . . . . 72.1 110.502 175.933 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 48' ' ' MET . . . . . . . . . . . . . 71.6 mtm -67.74 -26.43 66.13 Favored 'General case' 0 N--CA 1.488 1.43 0 N-CA-C 111.77 0.285 . . . . 72.03 111.77 178.822 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 42.8 mt-10 -81.53 -20.6 39.69 Favored 'General case' 0 N--CA 1.479 0.987 0 C-N-CA 123.69 0.796 . . . . 70.14 111.192 175.451 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -75.8 136.44 40.24 Favored 'General case' 0 C--O 1.244 0.781 0 N-CA-C 109.291 -0.633 . . . . 72.34 109.291 -179.706 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 7.2 tt0 -61.86 113.85 3.01 Favored 'General case' 0 C--O 1.241 0.656 0 O-C-N 123.448 0.467 . . . . 64.15 110.007 178.73 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 52' ' ' THR . . . . . 0.441 HG21 ' O ' ' A' ' 114' ' ' LEU . 89.3 m -65.26 128.47 93.82 Favored Pre-proline 0 CA--C 1.553 1.064 0 CA-C-N 115.769 -0.65 . . . . 74.22 109.71 173.883 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 53' ' ' PRO . . . . . 0.503 ' HG3' ' HA ' ' A' ' 4' ' ' THR . 29.3 Cg_endo -60.27 153.52 58.86 Favored 'Trans proline' 0 C--N 1.375 1.948 0 C-N-CA 122.915 2.41 . . . . 62.21 112.608 178.93 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 54' ' ' PRO . . . . . 0.468 ' HD3' ' HA ' ' A' ' 53' ' ' PRO . 5.0 Cg_exo -81.63 -49.16 0.05 OUTLIER 'Trans proline' 0 C--N 1.369 1.627 0 C-N-CA 123.117 2.544 . . . . 71.24 112.973 179.479 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . -78.53 80.9 1.39 Allowed Glycine 0 C--N 1.348 1.22 0 CA-C-N 116.498 -0.319 . . . . 73.2 112.509 -175.208 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 56' ' ' ILE . . . . . 0.629 HG21 HD22 ' A' ' 114' ' ' LEU . 74.2 mt -121.83 144.0 32.51 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.786 0 C-N-CA 123.977 0.911 . . . . 71.03 109.428 -179.039 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 57' ' ' THR . . . . . 0.411 ' H ' HD12 ' A' ' 60' ' ' ILE . 66.0 p -99.88 170.25 8.65 Favored 'General case' 0 N--CA 1.479 1.014 0 C-N-CA 123.554 0.742 . . . . 72.21 111.005 177.466 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 13.3 tpt180 -64.65 -35.42 80.97 Favored 'General case' 0 C--N 1.357 0.897 0 C-N-CA 123.208 0.603 . . . . 64.21 111.439 178.164 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 20.4 m -59.9 -41.81 92.48 Favored 'General case' 0 N--CA 1.482 1.138 0 CA-C-O 121.175 0.512 . . . . 74.53 110.768 178.518 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 60' ' ' ILE . . . . . 0.411 HD12 ' H ' ' A' ' 57' ' ' THR . 83.3 mt -66.93 -39.26 83.1 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.603 0 CA-C-N 114.996 -1.002 . . . . 75.14 110.03 176.109 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 61' ' ' GLN . . . . . 0.539 HE21 ' HA ' ' A' ' 110' ' ' SER . 52.3 tt0 -60.89 -35.72 77.36 Favored 'General case' 0 N--CA 1.481 1.076 0 C-N-CA 123.727 0.811 . . . . 60.44 111.16 176.876 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 57.8 m-20 -73.84 -45.42 51.33 Favored 'General case' 0 N--CA 1.478 0.958 0 C-N-CA 123.073 0.549 . . . . 74.21 111.468 -179.57 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 63' ' ' MET . . . . . . . . . . . . . 67.1 mtm -66.05 -51.36 58.95 Favored 'General case' 0 N--CA 1.481 1.119 0 C-N-CA 122.708 0.403 . . . . 74.35 110.889 -179.888 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 64' ' ' VAL . . . . . 0.429 ' O ' HG13 ' A' ' 68' ' ' ILE . 77.3 t -63.13 -59.56 4.17 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.538 0 C-N-CA 123.356 0.662 . . . . 72.34 111.364 -179.871 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 65' ' ' ALA . . . . . 0.54 ' HB2' HD23 ' A' ' 109' ' ' LEU . . . -69.14 -22.47 63.94 Favored 'General case' 0 N--CA 1.485 1.313 0 CA-C-N 118.491 0.587 . . . . 74.24 111.326 -176.606 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -67.42 -38.98 91.45 Favored Glycine 0 C--N 1.348 1.195 0 N-CA-C 111.886 -0.485 . . . . 74.24 111.886 170.752 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 67' ' ' TYR . . . . . 0.417 ' O ' HG22 ' A' ' 71' ' ' THR . 1.8 m-30 -74.92 -32.32 61.75 Favored 'General case' 0 C--O 1.241 0.636 0 C-N-CA 123.405 0.682 . . . . 65.31 112.034 175.603 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 68' ' ' ILE . . . . . 0.535 HD12 HD22 ' A' ' 109' ' ' LEU . 19.5 mt -68.53 -38.79 79.65 Favored 'Isoleucine or valine' 0 C--N 1.357 0.894 0 N-CA-C 108.495 -0.928 . . . . 73.13 108.495 175.03 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 12.3 tmtt? -57.73 -48.81 78.55 Favored 'General case' 0 N--CA 1.48 1.034 0 C-N-CA 123.767 0.827 . . . . 73.42 108.791 175.63 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 70' ' ' GLN . . . . . 0.5 ' HG2' HD21 ' A' ' 74' ' ' ASN . 64.6 tt0 -53.58 -49.91 66.71 Favored 'General case' 0 CA--C 1.544 0.734 0 O-C-N 124.522 1.139 . . . . 64.24 110.718 178.652 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 71' ' ' THR . . . . . 0.417 HG22 ' O ' ' A' ' 67' ' ' TYR . 2.9 t -75.12 -21.56 58.78 Favored 'General case' 0 C--N 1.358 0.959 0 CA-C-O 119.293 -0.384 . . . . 63.32 111.925 -178.542 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 72' ' ' LEU . . . . . 0.486 ' HG ' ' O ' ' A' ' 68' ' ' ILE . 25.4 mt -61.36 -52.43 64.67 Favored 'General case' 0 N--CA 1.487 1.406 0 N-CA-C 108.852 -0.796 . . . . 62.22 108.852 173.064 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 5.3 m-20 -61.66 -57.39 12.19 Favored 'General case' 0 N--CA 1.475 0.785 0 O-C-N 124.064 0.853 . . . . 71.21 110.846 178.675 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 74' ' ' ASN . . . . . 0.5 HD21 ' HG2' ' A' ' 70' ' ' GLN . 79.9 m-20 -51.87 -54.43 29.27 Favored 'General case' 0 N--CA 1.484 1.247 0 C-N-CA 124.177 0.991 . . . . 73.33 111.434 -174.403 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 75' ' ' GLU . . . . . 0.599 ' O ' ' HG2' ' A' ' 79' ' ' LYS . 10.4 mm-40 -60.26 -57.16 13.98 Favored 'General case' 0 C--O 1.221 -0.427 0 CA-C-N 115.268 -0.878 . . . . 65.5 111.295 179.224 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 9.3 tt0 -62.61 -29.64 70.75 Favored 'General case' 0 N--CA 1.484 1.247 0 O-C-N 123.67 0.606 . . . . 65.51 112.182 -172.014 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 77.2 mt -72.23 -40.89 67.41 Favored 'General case' 0 N--CA 1.473 0.711 0 C-N-CA 123.613 0.765 . . . . 72.23 110.042 175.604 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 78' ' ' LEU . . . . . 0.661 HD21 ' HA ' ' A' ' 22' ' ' LEU . 71.9 mt -61.94 -36.9 82.78 Favored 'General case' 0 N--CA 1.488 1.435 0 C-N-CA 123.135 0.574 . . . . 63.53 111.559 173.158 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 79' ' ' LYS . . . . . 0.599 ' HG2' ' O ' ' A' ' 75' ' ' GLU . 33.7 mmtm -69.21 -47.64 64.26 Favored 'General case' 0 N--CA 1.473 0.723 0 N-CA-C 109.18 -0.674 . . . . 72.41 109.18 -177.634 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -64.68 -29.09 74.28 Favored Glycine 0 C--N 1.35 1.315 0 CA-C-N 115.283 -0.872 . . . . 51.14 112.731 175.782 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 2.6 tt -69.82 -40.39 75.95 Favored 'General case' 0 CA--C 1.547 0.854 0 C-N-CA 123.724 0.81 . . . . 73.44 109.321 177.418 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 93.1 mt . . . . . 0 C--N 1.352 0.699 0 N-CA-C 109.468 -0.567 . . . . 74.32 109.468 179.196 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 92' ' ' LEU . . . . . 0.489 HD21 HD22 ' A' ' 41' ' ' LEU . 81.0 mt . . . . . 0 N--CA 1.481 1.087 0 CA-C-O 121.149 0.499 . . . . 71.01 111.112 . . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 59.5 mt -98.42 -34.23 4.49 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.884 0 C-N-CA 123.52 0.728 . . . . 74.42 109.444 175.239 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 140.31 -28.0 2.49 Favored Glycine 0 C--N 1.337 0.627 0 N-CA-C 110.281 -1.127 . . . . 74.23 110.281 -173.309 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 21.6 mp0 -98.74 146.84 25.48 Favored 'General case' 0 C--O 1.245 0.85 0 N-CA-C 107.649 -1.241 . . . . 75.53 107.649 173.765 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 52.8 p -72.08 83.08 0.98 Allowed 'General case' 0 CA--C 1.545 0.753 0 CA-C-O 121.804 0.811 . . . . 62.33 110.249 179.516 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 7.1 t -107.17 3.46 25.69 Favored 'General case' 0 CA--C 1.541 0.621 0 CA-C-N 115.058 -0.974 . . . . 70.54 111.425 -171.078 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 98' ' ' ARG . . . . . 0.467 ' HG2' HD11 ' A' ' 92' ' ' LEU . 0.0 OUTLIER -59.93 -61.97 2.22 Favored 'General case' 0 N--CA 1.482 1.131 0 CA-C-N 117.959 0.345 . . . . 71.42 110.432 -170.384 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 1.4 tm0? -72.68 -41.12 65.69 Favored 'General case' 0 N--CA 1.467 0.378 0 CA-C-N 115.541 -0.754 . . . . 73.21 109.799 -174.478 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 40.3 ttmt -63.28 -55.08 27.73 Favored 'General case' 0 C--N 1.348 0.539 0 O-C-N 123.754 0.659 . . . . 73.42 111.26 -175.1 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 33.7 t -75.14 -28.48 60.17 Favored 'General case' 0 N--CA 1.476 0.845 0 C-N-CA 123.357 0.663 . . . . 65.05 111.733 -174.939 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 102' ' ' LEU . . . . . 0.418 HD12 ' HA ' ' A' ' 102' ' ' LEU . 10.5 tp -75.84 -35.57 59.91 Favored 'General case' 0 CA--C 1.549 0.937 0 CA-C-N 118.18 0.445 . . . . 75.13 110.657 178.526 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 5.0 t-20 -78.86 -26.48 44.04 Favored 'General case' 0 N--CA 1.481 1.089 0 C-N-CA 123.428 0.691 . . . . 74.33 110.248 176.58 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 3.5 t30 -67.53 -50.42 58.76 Favored 'General case' 0 N--CA 1.476 0.862 0 C-N-CA 123.927 0.891 . . . . 72.31 109.386 173.543 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 105' ' ' ALA . . . . . 0.452 ' O ' ' HB2' ' A' ' 109' ' ' LEU . . . -56.23 -46.62 79.47 Favored 'General case' 0 C--N 1.35 0.596 0 CA-C-N 115.096 -0.956 . . . . 51.23 110.244 175.959 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 106' ' ' TYR . . . . . . . . . . . . . 6.4 t80 -57.6 -43.06 84.41 Favored 'General case' 0 N--CA 1.478 0.931 0 C-N-CA 124.539 1.135 . . . . 65.14 110.705 176.215 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -62.33 -51.55 55.68 Favored Glycine 0 C--N 1.348 1.232 0 O-C-N 123.595 0.56 . . . . 53.44 113.094 -176.453 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.81 -33.13 74.2 Favored 'General case' 0 C--O 1.251 1.137 0 C-N-CA 122.548 0.339 . . . . 62.52 110.459 177.717 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 109' ' ' LEU . . . . . 0.761 ' HA ' ' HA ' ' A' ' 114' ' ' LEU . 4.6 tp -61.92 -55.1 33.07 Favored 'General case' 0 C--N 1.354 0.774 0 O-C-N 124.213 0.945 . . . . 70.11 110.596 -177.733 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 110' ' ' SER . . . . . 0.539 ' HA ' HE21 ' A' ' 61' ' ' GLN . 17.2 m -78.62 -18.05 55.1 Favored 'General case' 0 CA--C 1.542 0.65 0 CA-C-N 114.965 -1.016 . . . . 63.04 110.526 179.084 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . -73.01 -62.41 3.15 Favored Glycine 0 C--N 1.359 1.836 0 CA-C-O 118.571 -1.127 . . . . 73.44 114.74 -176.565 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 112' ' ' MET . . . . . . . . . . . . . 2.8 tmm? -94.5 -63.93 1.13 Allowed 'General case' 0 N--CA 1.503 2.213 0 CA-C-N 119.487 1.644 . . . . 71.41 111.162 -175.139 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 2.5 tm? 170.75 60.8 0.0 OUTLIER 'General case' 0 N--CA 1.48 1.041 0 N-CA-C 105.487 -2.042 . . . . 73.25 105.487 -177.649 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 114' ' ' LEU . . . . . 0.761 ' HA ' ' HA ' ' A' ' 109' ' ' LEU . 5.4 mp . . . . . 0 N--CA 1.475 0.82 0 CA-C-N 113.02 -1.9 . . . . 74.12 115.33 171.53 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 20.2 ptt? . . . . . 0 N--CA 1.479 1.005 0 CA-C-O 121.293 0.568 . . . . 71.33 109.888 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 52.0 p -56.79 -33.12 66.35 Favored 'General case' 0 N--CA 1.482 1.16 0 C-N-CA 123.52 0.728 . . . . 63.45 111.971 -176.012 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 59.2 p -63.39 -43.41 97.65 Favored 'General case' 0 CA--C 1.549 0.92 0 C-N-CA 123.502 0.721 . . . . 35.11 110.995 175.098 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 27.6 m -69.63 -37.53 76.85 Favored 'General case' 0 N--CA 1.478 0.934 0 C-N-CA 123.581 0.752 . . . . 63.31 111.581 179.211 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 89.3 t -64.47 -47.16 90.52 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.819 0 C-N-CA 123.078 0.551 . . . . 72.34 109.858 179.664 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 16.7 mm-40 -60.26 -42.44 95.34 Favored 'General case' 0 C--O 1.218 -0.595 0 O-C-N 123.897 0.748 . . . . 64.33 110.563 173.495 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 35.7 t80 -59.19 -53.51 57.46 Favored 'General case' 0 CA--C 1.546 0.805 0 C-N-CA 123.626 0.77 . . . . 74.52 111.181 -176.851 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 52.0 mt -63.04 -45.89 97.62 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.033 0 C-N-CA 123.184 0.594 . . . . 73.24 110.311 179.226 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 3.4 t-20 -63.49 -32.99 74.6 Favored 'General case' 0 N--CA 1.48 1.028 0 C-N-CA 123.615 0.766 . . . . 64.33 111.454 -176.398 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 10' ' ' ARG . . . . . 0.477 ' O ' ' HB3' ' A' ' 13' ' ' ARG . 94.7 mtt180 -79.59 -29.39 41.16 Favored 'General case' 0 C--O 1.214 -0.775 0 CA-C-N 115.828 -0.624 . . . . 73.14 110.5 177.202 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 11' ' ' TRP . . . . . . . . . . . . . 79.3 m95 -76.6 -19.71 57.55 Favored 'General case' 0 N--CA 1.479 1.004 0 CA-C-O 119.186 -0.435 . . . . 73.3 111.053 171.362 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 51.3 mt-30 -68.73 -48.87 62.7 Favored 'General case' 0 N--CA 1.481 1.102 0 N-CA-C 108.196 -1.038 . . . . 75.04 108.196 168.265 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 13' ' ' ARG . . . . . 0.477 ' HB3' ' O ' ' A' ' 10' ' ' ARG . 17.6 tpt180 -48.25 -52.33 21.63 Favored 'General case' 0 CA--C 1.554 1.1 0 C-N-CA 124.939 1.296 . . . . 61.25 110.997 173.771 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 14' ' ' ILE . . . . . 0.465 HG13 ' O ' ' A' ' 10' ' ' ARG . 74.7 mt -69.08 -48.35 69.97 Favored 'Isoleucine or valine' 0 CA--C 1.558 1.267 0 C-N-CA 123.774 0.83 . . . . 54.42 111.267 -177.053 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -60.66 -48.4 81.93 Favored 'General case' 0 N--CA 1.487 1.424 0 C-N-CA 123.562 0.745 . . . . 54.45 111.964 -177.328 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 95.4 mt -69.26 -44.29 72.2 Favored 'General case' 0 CA--C 1.539 0.544 0 CA-C-N 115.079 -0.964 . . . . 61.04 111.046 -177.074 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.431 ' O ' ' HG ' ' A' ' 21' ' ' LEU . 42.3 mt -68.45 -32.41 72.41 Favored 'General case' 0 N--CA 1.482 1.171 0 CA-C-O 119.129 -0.463 . . . . 70.13 112.091 -179.502 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 78.7 p -68.38 -43.64 76.9 Favored 'General case' 0 N--CA 1.481 1.115 0 CA-C-N 118.181 0.446 . . . . 65.3 110.129 176.299 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 6.8 tp-100 -63.58 -37.56 87.77 Favored 'General case' 0 C--N 1.355 0.839 0 O-C-N 123.858 0.724 . . . . 74.11 110.789 176.841 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 52.5 m -62.52 -53.49 54.02 Favored 'General case' 0 C--N 1.348 0.542 0 CA-C-N 115.85 -0.614 . . . . 71.11 110.075 176.364 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 21' ' ' LEU . . . . . 0.545 HD22 ' HA ' ' A' ' 33' ' ' LEU . 57.9 mt -58.0 -35.6 71.46 Favored 'General case' 0 N--CA 1.477 0.916 0 O-C-N 123.833 0.708 . . . . 71.32 111.224 -178.569 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 22' ' ' LEU . . . . . 0.652 HD22 ' HA ' ' A' ' 74' ' ' ASN . 53.5 tp -65.83 -57.25 8.39 Favored 'General case' 0 N--CA 1.475 0.817 0 O-C-N 123.364 0.415 . . . . 62.24 111.152 178.914 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 23' ' ' GLU . . . . . 0.451 ' O ' ' HG3' ' A' ' 27' ' ' ARG . 43.6 mt-10 -57.21 -50.76 71.85 Favored 'General case' 0 N--CA 1.481 1.076 0 O-C-N 123.628 0.58 . . . . 75.4 110.297 -179.366 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 24' ' ' LEU . . . . . 0.462 HD23 ' HD2' ' A' ' 27' ' ' ARG . 95.0 mt -61.11 -33.49 73.45 Favored 'General case' 0 N--CA 1.474 0.768 0 C-N-CA 124.469 1.107 . . . . 74.31 111.735 -178.747 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 25' ' ' ALA . . . . . 0.547 ' HB2' HD21 ' A' ' 33' ' ' LEU . . . -61.62 -48.52 80.54 Favored 'General case' 0 N--CA 1.477 0.882 0 CA-C-O 120.957 0.408 . . . . 35.43 110.378 173.869 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 81.3 mt-30 -67.62 -22.43 65.34 Favored 'General case' 0 CA--C 1.551 0.99 0 CA-C-N 115.156 -0.929 . . . . 72.34 111.607 178.848 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 27' ' ' ARG . . . . . 0.462 ' HD2' HD23 ' A' ' 24' ' ' LEU . 73.3 mtt180 -85.72 -6.76 59.08 Favored 'General case' 0 N--CA 1.482 1.145 0 C-N-CA 124.062 0.945 . . . . 73.12 112.012 177.86 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 81.78 8.16 87.13 Favored Glycine 0 C--N 1.352 1.469 0 N-CA-C 113.612 0.205 . . . . 72.44 113.612 -178.397 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 36.8 mm-40 -82.26 60.98 5.26 Favored 'General case' 0 CA--C 1.545 0.757 0 C-N-CA 124.571 1.148 . . . . 60.01 111.404 179.912 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 30' ' ' TRP . . . . . 0.478 ' O ' ' HG ' ' A' ' 34' ' ' LEU . 45.9 m95 -65.99 -29.06 69.38 Favored 'General case' 0 N--CA 1.481 1.106 0 C-N-CA 122.992 0.517 . . . . 62.13 110.819 -177.154 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 -62.02 -46.96 86.9 Favored 'General case' 0 N--CA 1.475 0.791 0 C-N-CA 123.522 0.729 . . . . 71.43 109.771 177.295 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 0.431 ' HB3' HD13 ' A' ' 24' ' ' LEU . 61.1 mt -62.14 -28.77 69.88 Favored 'General case' 0 N--CA 1.476 0.873 0 C-N-CA 123.068 0.547 . . . . 72.44 111.385 176.722 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 33' ' ' LEU . . . . . 0.547 HD21 ' HB2' ' A' ' 25' ' ' ALA . 10.7 mp -68.86 -42.03 77.61 Favored 'General case' 0 C--N 1.357 0.897 0 CA-C-O 119.047 -0.501 . . . . 72.22 110.742 171.769 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.478 ' HG ' ' O ' ' A' ' 30' ' ' TRP . 83.8 mt -64.18 -43.54 94.79 Favored 'General case' 0 N--CA 1.487 1.387 0 C-N-CA 123.558 0.743 . . . . 71.41 111.565 -177.847 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 1.4 mp0 -65.43 -57.78 7.47 Favored 'General case' 0 N--CA 1.478 0.958 0 C-N-CA 123.137 0.575 . . . . 75.33 110.471 177.777 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 84.6 mm-40 -74.14 -11.31 60.27 Favored 'General case' 0 N--CA 1.479 0.99 0 C-N-CA 123.502 0.721 . . . . 74.43 112.723 -175.378 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 35.2 tt0 -53.65 -54.74 33.44 Favored 'General case' 0 N--CA 1.487 1.399 0 C-N-CA 123.876 0.87 . . . . 62.14 110.485 172.742 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 57.4 t -59.99 -47.94 89.77 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.514 0 O-C-N 124.248 0.968 . . . . 75.43 110.177 -179.344 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 16.3 m -55.6 -57.31 12.48 Favored 'General case' 0 CA--C 1.548 0.884 0 C-N-CA 124.037 0.935 . . . . 75.32 111.498 -179.265 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 28.5 t80 -63.87 -52.02 61.89 Favored 'General case' 0 CA--C 1.54 0.57 0 C-N-CA 124.97 1.308 . . . . 71.13 112.069 -173.73 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 41' ' ' LEU . . . . . 0.496 ' HA ' HG22 ' A' ' 44' ' ' ILE . 96.3 mt -72.22 -39.37 68.59 Favored 'General case' 0 N--CA 1.468 0.471 0 CA-C-N 115.969 -0.56 . . . . 71.24 111.659 -172.605 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 29.1 tt0 -60.0 -42.74 94.92 Favored 'General case' 0 CA--C 1.546 0.824 0 N-CA-C 109.68 -0.489 . . . . 73.11 109.68 173.866 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 43' ' ' SER . . . . . 0.436 ' O ' HG23 ' A' ' 47' ' ' VAL . 69.5 m -58.21 -54.84 42.48 Favored 'General case' 0 N--CA 1.483 1.189 0 C-N-CA 123.169 0.588 . . . . 73.12 112.151 176.892 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 44' ' ' ILE . . . . . 0.496 HG22 ' HA ' ' A' ' 41' ' ' LEU . 16.3 tt -62.83 -41.84 94.11 Favored 'Isoleucine or valine' 0 C--O 1.25 1.11 0 O-C-N 123.632 0.582 . . . . 71.33 111.146 -171.947 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 45' ' ' GLU . . . . . 0.496 ' O ' ' HG3' ' A' ' 49' ' ' GLU . 16.0 mm-40 -58.86 -51.02 71.82 Favored 'General case' 0 C--N 1.356 0.859 0 CA-C-N 115.801 -0.636 . . . . 62.43 110.166 174.812 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 46' ' ' THR . . . . . 0.514 ' O ' ' HD3' ' A' ' 50' ' ' LYS . 93.8 m -58.0 -36.31 72.48 Favored 'General case' 0 CA--C 1.55 0.976 0 O-C-N 124.319 1.012 . . . . 64.33 112.403 -178.115 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 47' ' ' VAL . . . . . 0.445 HG21 HD11 ' A' ' 14' ' ' ILE . 87.7 t -68.0 -45.42 83.69 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.063 0 C-N-CA 122.58 0.352 . . . . 63.41 110.167 177.721 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 48' ' ' MET . . . . . . . . . . . . . 65.8 mtm -76.0 -14.41 60.23 Favored 'General case' 0 N--CA 1.486 1.358 0 N-CA-C 112.989 0.737 . . . . 73.22 112.989 -177.799 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 49' ' ' GLU . . . . . 0.496 ' HG3' ' O ' ' A' ' 45' ' ' GLU . 69.0 mt-10 -70.53 -35.51 73.21 Favored 'General case' 0 N--CA 1.484 1.259 0 CA-C-O 120.839 0.352 . . . . 72.45 111.063 172.988 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 50' ' ' LYS . . . . . 0.514 ' HD3' ' O ' ' A' ' 46' ' ' THR . 13.4 mptt -90.21 166.84 13.13 Favored 'General case' 0 N--CA 1.477 0.915 0 C-N-CA 123.8 0.84 . . . . 61.04 110.65 -173.801 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 20.4 pt20 -71.92 146.78 47.59 Favored 'General case' 0 C--O 1.243 0.756 0 CA-C-N 115.431 -0.804 . . . . 72.23 110.635 -179.613 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 52' ' ' THR . . . . . 0.578 HG22 HD11 ' A' ' 56' ' ' ILE . 39.5 m -83.98 122.81 76.13 Favored Pre-proline 0 CA--C 1.546 0.807 0 N-CA-C 108.559 -0.904 . . . . 72.52 108.559 171.477 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 22.9 Cg_endo -57.38 157.06 23.32 Favored 'Trans proline' 0 C--N 1.379 2.149 0 C-N-CA 123.02 2.48 . . . . 51.13 113.411 -177.104 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 20.5 Cg_exo -68.22 -48.13 1.38 Allowed 'Trans proline' 0 C--N 1.371 1.755 0 C-N-CA 122.647 2.231 . . . . 71.12 112.354 174.394 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . -74.71 76.64 1.15 Allowed Glycine 0 C--N 1.351 1.378 0 CA-C-N 115.701 -0.681 . . . . 63.41 113.549 -175.97 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 56' ' ' ILE . . . . . 0.669 ' O ' ' HB ' ' A' ' 60' ' ' ILE . 26.6 mt -106.15 -14.14 9.26 Favored 'Isoleucine or valine' 0 C--O 1.202 -1.444 0 C-N-CA 123.583 0.753 . . . . 73.44 110.453 -179.989 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 73.6 p 38.82 -178.18 0.0 OUTLIER 'General case' 0 N--CA 1.506 2.338 0 N-CA-C 114.931 1.456 . . . . 73.13 114.931 -173.734 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 13.8 tpt85 -73.95 -37.04 64.67 Favored 'General case' 0 N--CA 1.476 0.854 0 O-C-N 120.482 -1.386 . . . . 74.5 108.378 171.194 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 33.4 m -62.51 -55.46 27.28 Favored 'General case' 0 C--O 1.246 0.875 0 C-N-CA 124.282 1.033 . . . . 73.1 111.93 -178.211 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 60' ' ' ILE . . . . . 0.669 ' HB ' ' O ' ' A' ' 56' ' ' ILE . 66.9 mt -75.03 -27.57 20.07 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.916 0 N-CA-C 109.046 -0.724 . . . . 75.23 109.046 -176.928 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 60.9 tt0 -57.23 -45.63 83.72 Favored 'General case' 0 C--N 1.376 1.732 0 CA-C-N 118.31 0.505 . . . . 65.24 110.862 171.915 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 65.9 m-20 -66.65 -41.78 87.7 Favored 'General case' 0 N--CA 1.472 0.666 0 O-C-N 123.591 0.557 . . . . 74.1 111.325 178.686 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 63' ' ' MET . . . . . . . . . . . . . 63.5 mtm -63.61 -54.78 30.53 Favored 'General case' 0 N--CA 1.486 1.343 0 O-C-N 123.318 0.386 . . . . 73.41 111.775 -179.455 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 64' ' ' VAL . . . . . 0.428 ' O ' HG13 ' A' ' 68' ' ' ILE . 73.5 t -59.04 -52.39 61.25 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.841 0 C-N-CA 123.719 0.808 . . . . 62.34 111.38 176.673 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 65' ' ' ALA . . . . . 0.465 ' HB2' HD23 ' A' ' 109' ' ' LEU . . . -64.46 -26.87 68.63 Favored 'General case' 0 N--CA 1.487 1.406 0 C-N-CA 122.534 0.333 . . . . 54.25 111.47 -179.836 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 66' ' ' GLY . . . . . 0.411 ' O ' ' HG3' ' A' ' 70' ' ' GLN . . . -68.1 -40.55 88.22 Favored Glycine 0 C--N 1.342 0.915 0 N-CA-C 111.296 -0.722 . . . . 73.4 111.296 174.357 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 67' ' ' TYR . . . . . 0.512 ' O ' HG23 ' A' ' 71' ' ' THR . 19.0 m-30 -67.06 -41.05 87.13 Favored 'General case' 0 N--CA 1.468 0.453 0 C-N-CA 123.533 0.733 . . . . 71.12 110.914 175.425 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 68' ' ' ILE . . . . . 0.584 ' O ' ' HG ' ' A' ' 72' ' ' LEU . 48.5 mt -61.09 -40.89 87.26 Favored 'Isoleucine or valine' 0 C--N 1.358 0.939 0 O-C-N 123.904 0.752 . . . . 63.24 109.001 174.665 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 69' ' ' LYS . . . . . 0.555 ' HA ' ' HE2' ' A' ' 69' ' ' LYS . 0.6 OUTLIER -58.72 -42.94 89.91 Favored 'General case' 0 N--CA 1.474 0.758 0 C-N-CA 123.305 0.642 . . . . 74.33 110.128 179.738 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 70' ' ' GLN . . . . . 0.411 ' HG3' ' O ' ' A' ' 66' ' ' GLY . 75.7 mt-30 -58.91 -45.92 89.18 Favored 'General case' 0 N--CA 1.476 0.84 0 O-C-N 124.176 0.922 . . . . 71.14 111.082 175.01 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 71' ' ' THR . . . . . 0.512 HG23 ' O ' ' A' ' 67' ' ' TYR . 10.0 p -60.59 -39.29 87.55 Favored 'General case' 0 N--CA 1.486 1.367 0 CA-C-O 120.862 0.363 . . . . 61.24 110.291 -178.63 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 72' ' ' LEU . . . . . 0.584 ' HG ' ' O ' ' A' ' 68' ' ' ILE . 52.7 mt -64.33 -54.59 30.7 Favored 'General case' 0 C--N 1.355 0.828 0 CA-C-N 115.144 -0.935 . . . . 74.43 109.812 -178.128 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 15.8 m-20 -58.7 -59.37 5.51 Favored 'General case' 0 N--CA 1.487 1.414 0 O-C-N 123.558 0.536 . . . . 74.14 111.243 178.542 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 74' ' ' ASN . . . . . 0.652 ' HA ' HD22 ' A' ' 22' ' ' LEU . 87.0 m-20 -56.71 -57.88 10.51 Favored 'General case' 0 N--CA 1.479 1.02 0 C-N-CA 124.471 1.108 . . . . 64.31 112.019 -173.59 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 75' ' ' GLU . . . . . 0.522 ' O ' ' HG2' ' A' ' 79' ' ' LYS . 61.8 tt0 -73.02 -29.25 62.87 Favored 'General case' 0 CA--C 1.545 0.78 0 CA-C-O 118.696 -0.668 . . . . 74.44 111.129 -172.694 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 52.2 tt0 -66.97 -38.43 86.07 Favored 'General case' 0 N--CA 1.491 1.578 0 CA-C-N 118.444 0.566 . . . . 70.44 110.763 173.536 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 92.6 mt -66.19 -30.56 71.05 Favored 'General case' 0 N--CA 1.471 0.583 0 N-CA-C 109.993 -0.373 . . . . 65.12 109.993 175.571 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 78' ' ' LEU . . . . . 0.609 HD21 ' HA ' ' A' ' 22' ' ' LEU . 85.3 mt -71.98 -35.01 69.37 Favored 'General case' 0 N--CA 1.479 1.019 0 C-N-CA 123.111 0.564 . . . . 65.02 111.912 170.437 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 79' ' ' LYS . . . . . 0.522 ' HG2' ' O ' ' A' ' 75' ' ' GLU . 35.5 mmtm -60.7 -43.92 97.17 Favored 'General case' 0 N--CA 1.485 1.28 0 N-CA-C 109.19 -0.67 . . . . 65.13 109.19 174.997 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -75.23 -33.44 53.88 Favored Glycine 0 C--N 1.346 1.117 0 CA-C-N 114.674 -1.148 . . . . 52.33 113.643 -179.431 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 5.4 tt -73.24 -60.13 2.39 Favored 'General case' 0 N--CA 1.477 0.91 0 C-N-CA 123.367 0.667 . . . . 71.25 109.407 -178.247 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 74.3 mt . . . . . 0 CA--C 1.544 0.738 0 CA-C-N 114.909 -1.041 . . . . 72.22 112.113 -171.018 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 92' ' ' LEU . . . . . 0.499 HD22 HH12 ' A' ' 98' ' ' ARG . 33.0 mt . . . . . 0 N--CA 1.486 1.348 0 N-CA-C 109.222 -0.658 . . . . 70.41 109.222 . . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 36.7 mt -68.71 145.52 13.38 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.943 0 C-N-CA 123.729 0.812 . . . . 71.53 109.617 176.473 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -64.64 138.63 40.41 Favored Glycine 0 C--N 1.348 1.2 0 O-C-N 123.551 0.532 . . . . 53.14 113.996 -175.881 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 51.3 tt0 61.56 88.19 0.09 Allowed 'General case' 0 CA--C 1.554 1.12 0 C-N-CA 125.127 1.371 . . . . 61.21 113.103 173.007 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 45.2 m 47.03 68.01 0.7 Allowed 'General case' 0 N--CA 1.486 1.337 0 C-N-CA 125.017 1.327 . . . . 70.33 114.114 163.922 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 12.0 t -96.48 -34.22 11.57 Favored 'General case' 0 N--CA 1.474 0.753 0 C-N-CA 122.49 0.316 . . . . 71.53 111.399 -177.25 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 98' ' ' ARG . . . . . 0.538 ' HA ' ' NE ' ' A' ' 98' ' ' ARG . 0.2 OUTLIER -62.61 -51.16 68.4 Favored 'General case' 0 C--N 1.353 0.752 0 O-C-N 123.584 0.552 . . . . 75.01 112.488 -161.486 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 22.7 tp60 -55.66 -55.58 30.53 Favored 'General case' 0 CA--C 1.545 0.765 0 O-C-N 124.159 0.912 . . . . 74.34 111.157 -176.519 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 24.1 tptp -70.88 -51.84 23.82 Favored 'General case' 0 CA--C 1.54 0.58 0 CA-C-N 115.585 -0.734 . . . . 71.2 111.153 -171.573 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 40.6 t -69.05 -38.36 79.08 Favored 'General case' 0 N--CA 1.474 0.748 0 C-N-CA 123.698 0.799 . . . . 71.52 112.353 -173.236 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 13.9 tp -83.5 -33.63 25.5 Favored 'General case' 0 N--CA 1.476 0.86 0 C-N-CA 122.485 0.314 . . . . 64.24 110.866 -174.405 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 27.9 t-20 -69.09 -34.23 74.79 Favored 'General case' 0 N--CA 1.482 1.158 0 N-CA-C 110.109 -0.33 . . . . 72.5 110.109 171.723 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 104' ' ' ASN . . . . . 0.453 ' O ' ' HG2' ' A' ' 108' ' ' ARG . 27.4 t-20 -60.88 -46.19 91.6 Favored 'General case' 0 N--CA 1.478 0.957 0 C-N-CA 123.16 0.584 . . . . 72.53 109.479 171.671 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -57.09 -42.79 81.38 Favored 'General case' 0 N--CA 1.477 0.887 0 O-C-N 124.018 0.824 . . . . 50.51 111.24 178.841 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 106' ' ' TYR . . . . . 0.402 ' HE2' ' HB2' ' A' ' 69' ' ' LYS . 9.1 t80 -58.47 -51.56 69.34 Favored 'General case' 0 CA--C 1.547 0.848 0 O-C-N 123.737 0.648 . . . . 74.02 110.276 175.384 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -65.79 -38.59 94.54 Favored Glycine 0 C--N 1.353 1.521 0 O-C-N 123.909 0.755 . . . . 72.1 113.232 -174.568 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 108' ' ' ARG . . . . . 0.453 ' HG2' ' O ' ' A' ' 104' ' ' ASN . 21.3 mmt180 -70.2 -35.62 74.03 Favored 'General case' 0 C--N 1.348 0.526 0 C-N-CA 122.998 0.519 . . . . 73.34 109.62 179.248 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 109' ' ' LEU . . . . . 0.465 HD23 ' HB2' ' A' ' 65' ' ' ALA . 53.2 tp -63.81 -52.69 59.07 Favored 'General case' 0 N--CA 1.48 1.058 0 C-N-CA 122.803 0.441 . . . . 73.13 110.216 175.782 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 16.2 t -62.91 -37.44 86.97 Favored 'General case' 0 CA--C 1.54 0.581 0 O-C-N 125.109 1.506 . . . . 71.24 111.03 -172.677 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . -91.05 -62.08 1.24 Allowed Glycine 0 C--N 1.35 1.326 0 CA-C-O 119.919 -0.378 . . . . 75.23 113.869 178.252 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 112' ' ' MET . . . . . . . . . . . . . 7.3 tpt -93.18 -65.81 0.97 Allowed 'General case' 0 N--CA 1.487 1.425 0 N-CA-C 113.167 0.802 . . . . 65.31 113.167 -168.213 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 14.4 tp 168.08 16.75 0.0 OUTLIER 'General case' 0 N--CA 1.504 2.271 0 C-N-CA 124.336 1.055 . . . . 71.21 110.917 -173.911 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 114' ' ' LEU . . . . . 0.445 ' N ' ' HA ' ' A' ' 109' ' ' LEU . 0.7 OUTLIER . . . . . 0 N--CA 1.502 2.13 0 C-N-CA 125.158 1.383 . . . . 71.21 110.098 -171.633 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 23.4 ttt . . . . . 0 N--CA 1.48 1.027 0 CA-C-O 119.773 -0.156 . . . . 71.11 111.083 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 87.1 m -52.0 -49.16 63.85 Favored 'General case' 0 N--CA 1.484 1.228 0 C-N-CA 123.387 0.675 . . . . 73.14 111.865 -178.08 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 22.9 m -63.08 -35.37 80.04 Favored 'General case' 0 N--CA 1.471 0.596 0 C-N-CA 123.708 0.803 . . . . 52.32 111.479 -178.901 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 4' ' ' THR . . . . . 0.558 HG21 HD13 ' A' ' 60' ' ' ILE . 5.0 m -68.42 -47.9 66.06 Favored 'General case' 0 CA--C 1.544 0.732 0 C-N-CA 123.461 0.704 . . . . 71.15 110.875 179.37 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 76.5 t -65.23 -39.51 85.66 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.979 0 C-N-CA 123.595 0.758 . . . . 63.11 110.484 -178.2 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 39.0 mm-40 -59.73 -49.23 78.53 Favored 'General case' 0 C--N 1.35 0.615 0 C-N-CA 123.291 0.636 . . . . 72.54 110.218 172.479 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 29.3 t80 -59.35 -45.78 90.45 Favored 'General case' 0 CA--C 1.551 1.0 0 C-N-CA 124.296 1.038 . . . . 74.34 110.873 -176.188 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 8' ' ' ILE . . . . . 0.464 HD11 HG23 ' A' ' 60' ' ' ILE . 77.7 mt -66.8 -42.95 90.0 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.914 0 C-N-CA 123.943 0.897 . . . . 71.05 110.693 179.635 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 28.5 t-20 -66.64 -34.18 77.31 Favored 'General case' 0 N--CA 1.485 1.32 0 C-N-CA 123.531 0.732 . . . . 64.32 111.355 -178.16 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 75.9 mtt180 -68.57 -41.42 79.72 Favored 'General case' 0 CA--C 1.537 0.469 0 CA-C-N 115.601 -0.727 . . . . 74.43 109.383 174.521 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 11' ' ' TRP . . . . . 0.468 ' HH2' ' HG ' ' A' ' 102' ' ' LEU . 42.5 m95 -65.66 -29.26 69.8 Favored 'General case' 0 N--CA 1.477 0.884 0 O-C-N 123.458 0.474 . . . . 73.25 111.632 173.905 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 50.1 mt-30 -61.91 -50.08 73.61 Favored 'General case' 0 C--N 1.359 0.987 0 N-CA-C 108.568 -0.901 . . . . 63.54 108.568 172.506 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 14.6 tpt180 -57.67 -49.25 77.12 Favored 'General case' 0 CA--C 1.545 0.785 0 O-C-N 124.103 0.877 . . . . 74.32 111.411 -179.078 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 14' ' ' ILE . . . . . 0.458 HD11 HG21 ' A' ' 47' ' ' VAL . 65.6 mt -63.59 -48.34 87.28 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.359 0 C-N-CA 123.427 0.691 . . . . 72.04 111.051 -177.897 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 15' ' ' ALA . . . . . 0.463 ' HB1' ' OE1' ' A' ' 70' ' ' GLN . . . -60.72 -47.79 84.69 Favored 'General case' 0 N--CA 1.478 0.934 0 C-N-CA 124.296 1.038 . . . . 70.55 111.412 -177.813 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 96.3 mt -74.69 -34.13 62.59 Favored 'General case' 0 N--CA 1.481 1.11 0 CA-C-N 114.756 -1.111 . . . . 72.04 111.452 -176.531 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.495 ' O ' ' HG ' ' A' ' 21' ' ' LEU . 18.6 mt -63.95 -54.97 26.27 Favored 'General case' 0 C--N 1.36 1.058 0 N-CA-C 109.41 -0.589 . . . . 61.54 109.41 175.745 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 79.6 p -59.63 -35.38 74.28 Favored 'General case' 0 CA--C 1.544 0.749 0 O-C-N 123.894 0.746 . . . . 63.12 111.276 -178.568 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 23.7 tp60 -62.29 -49.16 76.76 Favored 'General case' 0 N--CA 1.478 0.932 0 C-N-CA 123.503 0.721 . . . . 61.42 110.907 174.673 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 57.1 m -60.58 -43.21 97.57 Favored 'General case' 0 N--CA 1.472 0.665 0 C-N-CA 123.33 0.652 . . . . 54.01 110.444 177.023 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 21' ' ' LEU . . . . . 0.693 HD22 ' HA ' ' A' ' 33' ' ' LEU . 77.2 mt -68.75 -28.81 67.14 Favored 'General case' 0 C--N 1.346 0.415 0 C-N-CA 123.959 0.904 . . . . 74.45 110.288 -177.015 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 22' ' ' LEU . . . . . 0.597 ' HA ' HD21 ' A' ' 78' ' ' LEU . 35.8 tp -68.65 -51.26 43.9 Favored 'General case' 0 C--N 1.354 0.779 0 O-C-N 123.859 0.725 . . . . 53.42 109.652 175.928 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 76.2 mm-40 -51.87 -54.61 27.21 Favored 'General case' 0 N--CA 1.478 0.94 0 O-C-N 124.091 0.869 . . . . 74.22 110.526 175.799 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 24' ' ' LEU . . . . . 0.553 ' HB3' ' HB2' ' A' ' 29' ' ' GLU . 95.5 mt -64.2 -37.27 86.87 Favored 'General case' 0 CA--C 1.545 0.768 0 CA-C-N 114.505 -1.225 . . . . 73.44 111.46 -174.196 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 25' ' ' ALA . . . . . 0.629 ' HB2' HD21 ' A' ' 33' ' ' LEU . . . -66.7 -38.12 86.09 Favored 'General case' 0 N--CA 1.489 1.511 0 C-N-CA 122.837 0.455 . . . . 71.3 111.378 177.73 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 87.1 mt-30 -67.01 -26.76 66.95 Favored 'General case' 0 N--CA 1.478 0.96 0 C-N-CA 123.84 0.856 . . . . 71.33 110.833 175.481 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 59.2 mtt180 -88.51 -15.19 35.89 Favored 'General case' 0 N--CA 1.481 1.091 0 C-N-CA 124.025 0.93 . . . . 74.32 111.874 175.086 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 81.44 35.77 22.15 Favored Glycine 0 C--N 1.352 1.443 0 C-N-CA 123.01 0.338 . . . . 60.43 113.285 178.999 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 29' ' ' GLU . . . . . 0.553 ' HB2' ' HB3' ' A' ' 24' ' ' LEU . 13.6 mm-40 -97.83 59.89 1.48 Allowed 'General case' 0 CA--C 1.545 0.774 0 C-N-CA 124.806 1.243 . . . . 74.24 109.527 -177.551 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 30' ' ' TRP . . . . . 0.401 ' O ' ' HG ' ' A' ' 34' ' ' LEU . 61.3 m95 -53.58 -38.71 64.17 Favored 'General case' 0 N--CA 1.485 1.319 0 C-N-CA 124.245 1.018 . . . . 71.52 112.028 -174.421 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 31' ' ' ASP . . . . . 0.43 ' O ' ' HG3' ' A' ' 35' ' ' GLN . 4.2 m-20 -58.0 -50.15 74.39 Favored 'General case' 0 N--CA 1.483 1.186 0 C-N-CA 123.743 0.817 . . . . 72.3 110.652 -179.272 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 95.7 mt -62.89 -31.52 72.58 Favored 'General case' 0 N--CA 1.479 0.993 0 C-N-CA 123.93 0.892 . . . . 61.51 111.755 -176.778 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 33' ' ' LEU . . . . . 0.693 ' HA ' HD22 ' A' ' 21' ' ' LEU . 11.2 mp -66.26 -45.78 79.35 Favored 'General case' 0 N--CA 1.478 0.956 0 C-N-CA 123.045 0.538 . . . . 74.23 110.54 173.131 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.401 ' HG ' ' O ' ' A' ' 30' ' ' TRP . 81.1 mt -69.31 -24.77 63.98 Favored 'General case' 0 CA--C 1.548 0.897 0 CA-C-N 115.84 -0.618 . . . . 75.15 111.712 179.43 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 35' ' ' GLN . . . . . 0.43 ' HG3' ' O ' ' A' ' 31' ' ' ASP . 95.1 mt-30 -77.84 -32.42 52.13 Favored 'General case' 0 N--CA 1.474 0.752 0 C-N-CA 122.822 0.449 . . . . 74.33 111.24 178.067 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 36' ' ' GLN . . . . . 0.569 ' HB2' HD21 ' A' ' 21' ' ' LEU . 87.0 mm-40 -90.67 -14.63 31.89 Favored 'General case' 0 N--CA 1.483 1.183 0 C-N-CA 123.101 0.56 . . . . 74.51 112.37 174.746 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 42.2 tt0 -47.83 -56.37 7.62 Favored 'General case' 0 N--CA 1.488 1.462 0 C-N-CA 124.104 0.962 . . . . 71.4 112.871 -176.998 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 91.9 t -60.88 -43.9 96.65 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.869 0 C-N-CA 123.057 0.543 . . . . 74.45 111.684 -175.3 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 44.7 p -68.47 -34.75 76.49 Favored 'General case' 0 N--CA 1.473 0.723 0 C-N-CA 122.903 0.481 . . . . 65.45 111.148 -178.725 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 66.2 t80 -69.02 -51.74 35.93 Favored 'General case' 0 CA--C 1.541 0.61 0 C-N-CA 123.707 0.803 . . . . 75.2 110.027 -179.478 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 72.7 mt -63.73 -43.46 96.45 Favored 'General case' 0 N--CA 1.473 0.71 0 O-C-N 124.254 0.972 . . . . 61.22 110.834 -179.284 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 53.3 tt0 -67.57 -45.81 74.52 Favored 'General case' 0 N--CA 1.476 0.837 0 C-N-CA 123.027 0.531 . . . . 74.3 111.102 -176.903 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 43' ' ' SER . . . . . 0.489 ' O ' HG23 ' A' ' 47' ' ' VAL . 68.7 m -65.74 -42.43 90.98 Favored 'General case' 0 N--CA 1.474 0.757 0 O-C-N 123.312 0.383 . . . . 61.44 111.457 -178.941 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 44' ' ' ILE . . . . . 0.423 HG13 HD13 ' A' ' 14' ' ' ILE . 15.7 tt -69.45 -35.74 68.25 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.019 0 O-C-N 123.077 0.235 . . . . 63.03 110.704 -178.147 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 9.6 mm-40 -59.12 -44.91 92.03 Favored 'General case' 0 C--N 1.359 1.019 0 C-N-CA 123.428 0.691 . . . . 73.5 110.527 171.726 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 90.0 m -58.61 -45.3 89.47 Favored 'General case' 0 CA--C 1.544 0.738 0 O-C-N 124.277 0.986 . . . . 74.13 111.261 178.604 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 47' ' ' VAL . . . . . 0.489 HG23 ' O ' ' A' ' 43' ' ' SER . 57.8 t -64.04 -47.85 88.53 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.172 0 C-N-CA 123.108 0.563 . . . . 70.32 111.443 -178.468 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 48' ' ' MET . . . . . . . . . . . . . 73.6 mtm -73.51 -24.02 60.1 Favored 'General case' 0 N--CA 1.48 1.034 0 CA-C-N 115.95 -0.568 . . . . 73.23 111.642 -177.397 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 9.8 tp10 -82.16 -35.33 28.52 Favored 'General case' 0 N--CA 1.475 0.777 0 C-N-CA 122.847 0.459 . . . . 72.51 110.396 178.169 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 12.3 mptt -84.62 151.46 24.48 Favored 'General case' 0 N--CA 1.479 0.991 0 C-N-CA 123.475 0.71 . . . . 62.15 110.874 -176.971 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 8.7 tt0 -76.23 132.9 40.18 Favored 'General case' 0 CA--C 1.543 0.707 0 CA-C-N 114.76 -1.109 . . . . 61.25 110.921 -175.131 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 24.1 m -74.46 125.65 89.58 Favored Pre-proline 0 CA--C 1.551 0.989 0 C-N-CA 123.712 0.805 . . . . 72.42 109.079 170.314 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 73.7 Cg_endo -72.45 152.05 54.19 Favored 'Trans proline' 0 C--N 1.373 1.864 0 C-N-CA 122.075 1.85 . . . . 62.04 112.777 -178.903 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 52.8 Cg_exo -58.72 -44.94 32.43 Favored 'Trans proline' 0 C--N 1.378 2.099 0 C-N-CA 123.716 2.944 . . . . 72.55 113.583 176.427 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . -63.83 80.38 0.05 OUTLIER Glycine 0 C--N 1.351 1.409 0 O-C-N 124.342 1.027 . . . . 40.23 114.117 -176.849 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 72.5 mt -130.49 111.61 21.08 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.673 0 C-N-CA 124.804 1.242 . . . . 65.31 108.752 178.522 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 57' ' ' THR . . . . . 0.467 ' H ' HD12 ' A' ' 60' ' ' ILE . 74.2 p -80.23 175.14 10.91 Favored 'General case' 0 N--CA 1.471 0.577 0 C-N-CA 123.47 0.708 . . . . 73.54 109.454 172.544 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 26.3 tpt180 -63.94 -38.96 93.01 Favored 'General case' 0 CA--C 1.541 0.622 0 CA-C-O 119.428 -0.32 . . . . 72.53 110.398 177.538 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 21.9 m -59.41 -47.39 85.62 Favored 'General case' 0 CA--C 1.548 0.889 0 C-N-CA 122.987 0.515 . . . . 71.22 110.854 178.252 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 60' ' ' ILE . . . . . 0.558 HD13 HG21 ' A' ' 4' ' ' THR . 93.5 mt -61.09 -42.17 92.18 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.149 0 C-N-CA 123.623 0.769 . . . . 63.41 110.372 176.159 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 64.4 tt0 -62.54 -38.7 91.01 Favored 'General case' 0 CA--C 1.547 0.837 0 C-N-CA 124.024 0.929 . . . . 70.33 111.092 -179.171 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 63.9 m-20 -67.68 -43.52 80.0 Favored 'General case' 0 N--CA 1.48 1.028 0 C-N-CA 123.433 0.693 . . . . 73.14 110.79 177.686 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 63' ' ' MET . . . . . . . . . . . . . 72.3 mtm -64.46 -52.39 58.23 Favored 'General case' 0 N--CA 1.48 1.054 0 O-C-N 123.72 0.638 . . . . 62.2 111.447 -178.356 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 64' ' ' VAL . . . . . 0.465 ' O ' HG13 ' A' ' 68' ' ' ILE . 92.4 t -60.71 -50.42 80.53 Favored 'Isoleucine or valine' 0 C--N 1.353 0.739 0 C-N-CA 123.71 0.804 . . . . 72.14 110.372 -179.747 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 65' ' ' ALA . . . . . 0.404 ' HB2' HD23 ' A' ' 109' ' ' LEU . . . -61.91 -36.5 81.52 Favored 'General case' 0 N--CA 1.484 1.231 0 O-C-N 123.432 0.457 . . . . 72.31 111.327 179.78 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -64.25 -38.81 96.41 Favored Glycine 0 C--N 1.345 1.038 0 O-C-N 123.73 0.644 . . . . 33.4 112.402 178.41 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 67' ' ' TYR . . . . . 0.528 ' O ' HG22 ' A' ' 71' ' ' THR . 17.9 m-30 -72.58 -42.32 64.71 Favored 'General case' 0 N--CA 1.471 0.577 0 C-N-CA 123.277 0.631 . . . . 74.35 111.452 179.371 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 68' ' ' ILE . . . . . 0.522 ' O ' ' HG ' ' A' ' 72' ' ' LEU . 68.0 mt -56.49 -52.22 55.52 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.112 0 N-CA-C 108.652 -0.87 . . . . 75.51 108.652 175.207 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 69' ' ' LYS . . . . . 0.549 ' HB2' ' HE2' ' A' ' 106' ' ' TYR . 13.5 tmtt? -53.35 -45.8 69.3 Favored 'General case' 0 N--CA 1.476 0.842 0 C-N-CA 125.25 1.42 . . . . 71.42 110.345 179.125 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 70' ' ' GLN . . . . . 0.463 ' OE1' ' HB1' ' A' ' 15' ' ' ALA . 61.4 tt0 -61.39 -49.1 78.25 Favored 'General case' 0 C--N 1.349 0.557 0 CA-C-N 115.428 -0.806 . . . . 73.43 111.328 -176.158 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 71' ' ' THR . . . . . 0.528 HG22 ' O ' ' A' ' 67' ' ' TYR . 1.0 OUTLIER -73.18 -23.59 60.44 Favored 'General case' 0 N--CA 1.474 0.736 0 CA-C-O 119.469 -0.3 . . . . 64.15 110.874 -178.871 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 72' ' ' LEU . . . . . 0.522 ' HG ' ' O ' ' A' ' 68' ' ' ILE . 37.4 mt -61.21 -55.61 30.2 Favored 'General case' 0 C--N 1.363 1.16 0 N-CA-C 108.878 -0.786 . . . . 63.42 108.878 173.175 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 73' ' ' ASP . . . . . 0.427 ' O ' ' HG ' ' A' ' 77' ' ' LEU . 4.5 m-20 -55.09 -61.89 2.02 Favored 'General case' 0 N--CA 1.482 1.133 0 O-C-N 124.505 1.128 . . . . 75.32 111.001 177.373 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 74' ' ' ASN . . . . . 0.529 ' HA ' HD22 ' A' ' 22' ' ' LEU . 83.0 m-20 -53.5 -54.7 33.41 Favored 'General case' 0 N--CA 1.478 0.933 0 O-C-N 124.506 1.129 . . . . 74.23 112.294 -172.292 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 75' ' ' GLU . . . . . 0.41 ' HB3' ' NH2' ' A' ' 98' ' ' ARG . 5.4 tt0 -73.03 -32.77 65.31 Favored 'General case' 0 CA--C 1.547 0.832 0 O-C-N 123.211 0.32 . . . . 72.43 111.516 -174.634 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 60.8 tt0 -64.9 -37.15 86.69 Favored 'General case' 0 N--CA 1.484 1.266 0 CA-C-O 120.764 0.316 . . . . 73.3 110.197 175.43 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 77' ' ' LEU . . . . . 0.427 ' HG ' ' O ' ' A' ' 73' ' ' ASP . 96.8 mt -68.72 -34.92 76.45 Favored 'General case' 0 CA--C 1.539 0.539 0 CA-C-N 116.057 -0.52 . . . . 61.34 110.198 176.142 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 78' ' ' LEU . . . . . 0.597 HD21 ' HA ' ' A' ' 22' ' ' LEU . 57.3 mt -61.04 -39.88 91.47 Favored 'General case' 0 N--CA 1.483 1.193 0 C-N-CA 122.89 0.476 . . . . 73.12 111.03 171.675 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 48.8 mmtm -65.01 -45.57 84.97 Favored 'General case' 0 C--O 1.22 -0.449 0 CA-C-N 116.416 -0.356 . . . . 74.02 110.334 178.224 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -71.32 -25.24 75.83 Favored Glycine 0 CA--C 1.531 1.081 0 O-C-N 124.104 0.877 . . . . 74.15 113.851 -179.294 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 6.4 tt -86.05 -64.26 1.18 Allowed 'General case' 0 N--CA 1.48 1.052 0 C-N-CA 123.312 0.645 . . . . 64.22 109.613 -178.002 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 25.6 mt . . . . . 0 N--CA 1.479 1.008 0 C-N-CA 123.914 0.885 . . . . 71.3 112.167 -168.511 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 75.7 mt . . . . . 0 CA--C 1.54 0.582 0 CA-C-O 120.792 0.33 . . . . 71.2 110.852 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 62.6 mt -90.05 -40.01 12.57 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.69 0 N-CA-C 108.259 -1.015 . . . . 74.22 108.259 174.161 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 178.92 -56.67 0.09 OUTLIER Glycine 0 C--N 1.345 1.032 0 CA-C-N 114.446 -1.252 . . . . 75.33 110.176 177.037 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 13.8 pt20 -81.27 175.32 10.7 Favored 'General case' 0 C--O 1.244 0.784 0 C-N-CA 123.626 0.77 . . . . 63.42 110.764 176.811 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 35.0 p -83.99 51.67 2.11 Favored 'General case' 0 CA--C 1.552 1.042 0 C-N-CA 124.369 1.067 . . . . 65.11 110.666 177.937 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 15.2 t -67.56 -9.76 45.62 Favored 'General case' 0 N--CA 1.479 1.01 0 C-N-CA 124.189 0.996 . . . . 64.32 112.837 -174.325 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 98' ' ' ARG . . . . . 0.594 HH11 HD22 ' A' ' 102' ' ' LEU . 2.0 tmm_? -51.28 -50.34 59.47 Favored 'General case' 0 N--CA 1.479 1.003 0 C-N-CA 125.265 1.426 . . . . 74.41 111.506 -176.439 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 24.7 tm0? -57.26 -53.3 59.71 Favored 'General case' 0 N--CA 1.474 0.752 0 C-N-CA 124.025 0.93 . . . . 74.43 110.053 -176.887 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 61.5 tttp -65.02 -49.16 71.25 Favored 'General case' 0 C--O 1.218 -0.567 0 O-C-N 124.016 0.823 . . . . 74.3 111.425 -176.589 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 51.1 m -60.27 -43.98 95.72 Favored 'General case' 0 CA--C 1.542 0.649 0 C-N-CA 123.587 0.755 . . . . 71.21 111.584 -173.877 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 102' ' ' LEU . . . . . 0.594 HD22 HH11 ' A' ' 98' ' ' ARG . 10.8 mp -78.45 -35.64 46.48 Favored 'General case' 0 N--CA 1.48 1.026 0 N-CA-C 112.306 0.484 . . . . 71.21 112.306 -179.08 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 26.9 t-20 -69.41 -37.84 77.65 Favored 'General case' 0 N--CA 1.484 1.254 0 CA-C-O 121.035 0.445 . . . . 63.45 110.392 179.727 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -73.72 -36.51 65.21 Favored 'General case' 0 N--CA 1.47 0.561 0 CA-C-N 115.615 -0.721 . . . . 74.24 109.164 176.768 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -61.56 -36.76 81.53 Favored 'General case' 0 C--N 1.358 0.937 0 O-C-N 123.605 0.566 . . . . 73.53 110.892 173.715 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 106' ' ' TYR . . . . . 0.549 ' HE2' ' HB2' ' A' ' 69' ' ' LYS . 2.3 t80 -67.45 -42.03 83.75 Favored 'General case' 0 CA--C 1.541 0.614 0 N-CA-C 108.964 -0.754 . . . . 73.42 108.964 176.762 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -67.01 -31.79 78.97 Favored Glycine 0 CA--C 1.535 1.283 0 O-C-N 123.59 0.556 . . . . 54.24 113.449 177.809 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 52.6 mtp180 -71.7 -41.59 68.43 Favored 'General case' 0 N--CA 1.474 0.759 0 C-N-CA 123.694 0.798 . . . . 75.25 109.643 176.668 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 109' ' ' LEU . . . . . 0.404 HD23 ' HB2' ' A' ' 65' ' ' ALA . 34.8 tp -66.73 -46.59 75.01 Favored 'General case' 0 C--N 1.351 0.635 0 O-C-N 124.248 0.968 . . . . 71.15 110.021 -179.471 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 33.8 t -66.07 -36.16 82.45 Favored 'General case' 0 CA--C 1.536 0.439 0 C-N-CA 124.221 1.008 . . . . 73.52 110.548 177.556 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . -77.84 -66.18 1.8 Allowed Glycine 0 C--N 1.36 1.878 0 C-N-CA 120.692 -0.766 . . . . 73.25 112.702 -176.728 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 112' ' ' MET . . . . . . . . . . . . . 41.7 mmm -99.13 -72.89 0.64 Allowed 'General case' 0 N--CA 1.481 1.101 0 CA-C-N 118.315 1.057 . . . . 72.32 111.647 172.524 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER 171.4 33.27 0.0 OUTLIER 'General case' 0 N--CA 1.487 1.415 0 C-N-CA 125.85 1.66 . . . . 75.55 109.666 -178.66 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 11.5 tp . . . . . 0 N--CA 1.491 1.604 0 C-N-CA 125.242 1.417 . . . . 73.21 113.941 170.011 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 25.0 ptm . . . . . 0 N--CA 1.485 1.28 0 N-CA-C 111.936 0.347 . . . . 71.42 111.936 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 28.6 m -62.69 -40.19 96.36 Favored 'General case' 0 N--CA 1.482 1.127 0 C-N-CA 122.931 0.492 . . . . 74.15 111.531 -176.111 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 14.3 m -65.59 -35.99 82.44 Favored 'General case' 0 N--CA 1.476 0.871 0 C-N-CA 122.964 0.505 . . . . 72.5 110.467 176.331 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 4' ' ' THR . . . . . 0.555 ' HA ' ' HG2' ' A' ' 53' ' ' PRO . 33.5 m -66.4 -50.0 64.93 Favored 'General case' 0 C--N 1.361 1.086 0 C-N-CA 123.602 0.761 . . . . 74.1 111.3 179.241 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 59.0 t -60.45 -40.02 82.91 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.084 0 C-N-CA 123.401 0.68 . . . . 73.34 110.022 179.173 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 6' ' ' GLU . . . . . 0.478 ' O ' ' HG3' ' A' ' 10' ' ' ARG . 0.2 OUTLIER -63.68 -41.42 98.15 Favored 'General case' 0 CA--C 1.548 0.895 0 CA-C-N 115.326 -0.852 . . . . 62.42 110.293 176.823 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 7' ' ' PHE . . . . . 0.598 ' HD1' HH11 ' A' ' 10' ' ' ARG . 39.4 t80 -69.44 -40.71 77.04 Favored 'General case' 0 N--CA 1.483 1.198 0 C-N-CA 123.968 0.907 . . . . 73.23 111.316 -176.665 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 8' ' ' ILE . . . . . 0.465 ' O ' ' HG3' ' A' ' 12' ' ' GLN . 76.7 mt -60.73 -42.48 92.26 Favored 'Isoleucine or valine' 0 C--N 1.353 0.733 0 N-CA-C 108.593 -0.892 . . . . 73.21 108.593 172.863 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 66.0 t30 -66.46 -27.62 67.95 Favored 'General case' 0 N--CA 1.475 0.823 0 O-C-N 124.354 1.034 . . . . 72.52 111.426 -179.835 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 10' ' ' ARG . . . . . 0.633 ' HB3' HG22 ' A' ' 47' ' ' VAL . 53.8 mtt180 -71.36 -39.02 71.54 Favored 'General case' 0 N--CA 1.475 0.802 0 C-N-CA 123.442 0.697 . . . . 74.23 110.764 174.465 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 11' ' ' TRP . . . . . 0.452 ' CD1' HG13 ' A' ' 64' ' ' VAL . 92.1 m95 -75.17 -24.18 57.84 Favored 'General case' 0 N--CA 1.477 0.875 0 CA-C-N 116.25 -0.432 . . . . 71.54 111.654 173.871 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 12' ' ' GLN . . . . . 0.504 ' HG2' ' CE2' ' A' ' 67' ' ' TYR . 55.7 mt-30 -68.59 -39.74 80.81 Favored 'General case' 0 N--CA 1.473 0.692 0 N-CA-C 108.743 -0.836 . . . . 65.52 108.743 170.11 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 22.4 tpt180 -60.19 -53.51 56.84 Favored 'General case' 0 CA--C 1.545 0.759 0 C-N-CA 124.174 0.99 . . . . 75.21 110.658 178.748 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 14' ' ' ILE . . . . . 0.477 HG22 ' OG1' ' A' ' 71' ' ' THR . 49.1 mt -66.32 -42.74 91.22 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.006 0 O-C-N 123.338 0.399 . . . . 71.54 110.45 -178.466 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 15' ' ' ALA . . . . . 0.598 ' HA ' ' HB ' ' A' ' 71' ' ' THR . . . -60.34 -48.04 83.46 Favored 'General case' 0 N--CA 1.486 1.337 0 C-N-CA 123.249 0.619 . . . . 43.12 112.1 -178.776 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 92.1 mt -70.11 -44.36 69.14 Favored 'General case' 0 N--CA 1.481 1.098 0 O-C-N 124.304 1.003 . . . . 72.32 110.856 -175.985 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.495 ' O ' ' HG ' ' A' ' 21' ' ' LEU . 49.3 mt -62.62 -53.43 54.68 Favored 'General case' 0 C--N 1.354 0.799 0 O-C-N 123.606 0.566 . . . . 72.22 110.527 179.982 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 94.9 p -60.8 -37.84 83.31 Favored 'General case' 0 N--CA 1.479 0.975 0 C-N-CA 123.338 0.655 . . . . 44.15 111.432 -178.51 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 29.8 tp60 -62.65 -48.11 80.78 Favored 'General case' 0 C--N 1.36 1.025 0 O-C-N 123.939 0.775 . . . . 71.45 110.348 177.699 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 20' ' ' SER . . . . . 0.407 ' O ' ' HG ' ' A' ' 24' ' ' LEU . 65.2 m -58.91 -49.04 79.29 Favored 'General case' 0 C--O 1.213 -0.855 0 O-C-N 123.944 0.777 . . . . 41.4 110.3 176.405 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 21' ' ' LEU . . . . . 0.587 HD22 ' HA ' ' A' ' 33' ' ' LEU . 79.7 mt -64.43 -31.33 72.5 Favored 'General case' 0 N--CA 1.475 0.807 0 C-N-CA 123.93 0.892 . . . . 71.24 111.28 -176.471 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 22' ' ' LEU . . . . . 0.603 ' HA ' HD21 ' A' ' 78' ' ' LEU . 69.9 tp -67.42 -55.42 13.74 Favored 'General case' 0 C--N 1.353 0.738 0 C-N-CA 123.191 0.596 . . . . 54.43 109.766 176.996 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 45.5 mt-10 -55.05 -50.69 68.47 Favored 'General case' 0 C--N 1.352 0.689 0 O-C-N 124.635 1.209 . . . . 70.3 110.549 179.933 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 24' ' ' LEU . . . . . 0.487 ' HB3' ' HB2' ' A' ' 29' ' ' GLU . 93.7 mt -63.38 -36.22 82.98 Favored 'General case' 0 CA--C 1.544 0.736 0 C-N-CA 124.508 1.123 . . . . 71.33 111.251 -177.46 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -63.9 -41.16 97.77 Favored 'General case' 0 N--CA 1.485 1.277 0 C-N-CA 122.87 0.468 . . . . 73.24 111.279 174.948 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 86.3 mt-30 -71.41 -23.38 61.86 Favored 'General case' 0 N--CA 1.483 1.195 0 C-N-CA 123.892 0.877 . . . . 73.32 111.289 177.958 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 89.0 mtt180 -91.98 -11.59 35.66 Favored 'General case' 0 N--CA 1.481 1.113 0 C-N-CA 123.943 0.897 . . . . 75.32 111.685 176.649 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 88.21 6.98 73.95 Favored Glycine 0 C--N 1.349 1.284 0 CA-C-O 119.924 -0.375 . . . . 73.11 113.941 178.549 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 29' ' ' GLU . . . . . 0.487 ' HB2' ' HB3' ' A' ' 24' ' ' LEU . 44.2 mm-40 -79.01 55.91 1.87 Allowed 'General case' 0 N--CA 1.484 1.23 0 C-N-CA 124.805 1.242 . . . . 65.42 111.643 176.424 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 30' ' ' TRP . . . . . 0.624 ' HH2' HD22 ' A' ' 81' ' ' LEU . 93.8 m95 -64.17 -27.51 69.12 Favored 'General case' 0 N--CA 1.481 1.08 0 C-N-CA 124.162 0.985 . . . . 54.32 111.904 -177.492 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 4.9 m-20 -56.94 -47.86 79.67 Favored 'General case' 0 CA--C 1.539 0.536 0 C-N-CA 124.12 0.968 . . . . 70.02 110.353 176.275 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 98.4 mt -64.84 -26.8 68.49 Favored 'General case' 0 CA--C 1.546 0.826 0 CA-C-N 115.574 -0.739 . . . . 74.41 111.204 179.983 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 33' ' ' LEU . . . . . 0.587 ' HA ' HD22 ' A' ' 21' ' ' LEU . 9.8 mp -68.93 -39.63 79.5 Favored 'General case' 0 N--CA 1.484 1.249 0 C-N-CA 122.465 0.306 . . . . 73.0 110.458 171.34 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.42 ' HG ' ' O ' ' A' ' 30' ' ' TRP . 75.7 mt -66.69 -37.92 85.71 Favored 'General case' 0 N--CA 1.487 1.385 0 O-C-N 123.585 0.553 . . . . 65.24 111.975 -179.681 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 1.3 mp0 -71.67 -49.19 42.0 Favored 'General case' 0 N--CA 1.485 1.315 0 C-N-CA 122.638 0.375 . . . . 74.34 110.957 177.598 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 36' ' ' GLN . . . . . 0.476 ' HB2' HD21 ' A' ' 21' ' ' LEU . 87.4 mm-40 -74.42 -13.44 60.72 Favored 'General case' 0 N--CA 1.478 0.955 0 C-N-CA 123.22 0.608 . . . . 72.23 111.96 -179.563 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 37' ' ' GLU . . . . . 0.512 ' O ' ' HG ' ' A' ' 41' ' ' LEU . 32.4 tt0 -48.51 -61.14 2.17 Favored 'General case' 0 N--CA 1.486 1.332 0 C-N-CA 124.672 1.189 . . . . 72.42 111.885 177.584 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 66.0 t -53.55 -46.27 59.91 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.346 0 O-C-N 124.322 1.014 . . . . 73.23 111.235 -176.517 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 44.6 m -65.66 -38.51 89.51 Favored 'General case' 0 CA--C 1.544 0.748 0 CA-C-N 114.99 -1.005 . . . . 54.45 111.727 179.818 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 40' ' ' TYR . . . . . 0.414 ' O ' HG22 ' A' ' 44' ' ' ILE . 40.0 t80 -69.29 -46.08 68.04 Favored 'General case' 0 N--CA 1.476 0.87 0 C-N-CA 123.056 0.542 . . . . 73.21 110.564 -177.758 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 41' ' ' LEU . . . . . 0.512 ' HG ' ' O ' ' A' ' 37' ' ' GLU . 49.9 mt -55.75 -51.79 66.15 Favored 'General case' 0 C--N 1.355 0.829 0 O-C-N 124.673 1.233 . . . . 63.2 109.81 177.382 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 50.1 tt0 -54.54 -48.02 72.48 Favored 'General case' 0 C--N 1.355 0.812 0 CA-C-N 114.62 -1.173 . . . . 45.23 111.017 179.404 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 43' ' ' SER . . . . . 0.54 ' O ' HG23 ' A' ' 47' ' ' VAL . 67.5 m -59.03 -62.18 2.08 Favored 'General case' 0 C--N 1.349 0.552 0 O-C-N 124.057 0.848 . . . . 74.35 111.307 -177.721 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 44' ' ' ILE . . . . . 0.414 HG22 ' O ' ' A' ' 40' ' ' TYR . 14.6 tt -64.52 -34.78 71.84 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.955 0 O-C-N 123.571 0.544 . . . . 72.0 111.628 -171.46 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 45' ' ' GLU . . . . . 0.538 ' HG2' HD22 ' A' ' 92' ' ' LEU . 17.6 mm-40 -58.93 -53.02 63.15 Favored 'General case' 0 N--CA 1.484 1.237 0 C-N-CA 122.663 0.385 . . . . 70.03 110.539 171.947 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 87.2 m -56.43 -40.31 74.54 Favored 'General case' 0 C--N 1.358 0.949 0 C-N-CA 123.502 0.721 . . . . 71.01 111.486 -178.654 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 47' ' ' VAL . . . . . 0.633 HG22 ' HB3' ' A' ' 10' ' ' ARG . 44.9 t -70.36 -41.22 78.43 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.078 0 C-N-CA 123.406 0.682 . . . . 73.33 111.293 -177.055 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 48' ' ' MET . . . . . . . . . . . . . 77.3 mtm -71.34 -30.8 66.62 Favored 'General case' 0 N--CA 1.486 1.361 0 C-N-CA 122.505 0.322 . . . . 75.32 111.667 179.519 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 62.3 mt-10 -82.57 -8.3 59.61 Favored 'General case' 0 N--CA 1.482 1.167 0 C-N-CA 123.314 0.646 . . . . 73.33 111.334 176.332 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -90.41 139.9 30.23 Favored 'General case' 0 N--CA 1.469 0.502 0 C-N-CA 123.002 0.521 . . . . 72.24 110.407 -176.002 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 7.7 tt0 -68.78 140.97 55.31 Favored 'General case' 0 CA--C 1.537 0.477 0 C-N-CA 124.172 0.989 . . . . 74.21 109.893 174.784 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 52' ' ' THR . . . . . 0.433 ' HA ' ' HD3' ' A' ' 53' ' ' PRO . 25.2 m -83.76 128.18 64.5 Favored Pre-proline 0 CA--C 1.547 0.844 0 N-CA-C 109.548 -0.538 . . . . 63.4 109.548 174.709 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 53' ' ' PRO . . . . . 0.555 ' HG2' ' HA ' ' A' ' 4' ' ' THR . 25.7 Cg_exo -65.57 155.07 70.89 Favored 'Trans proline' 0 C--N 1.376 1.99 0 C-N-CA 123.086 2.524 . . . . 52.02 113.548 -179.422 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 54' ' ' PRO . . . . . 0.485 ' HA ' HD11 ' A' ' 113' ' ' LEU . 37.9 Cg_endo -66.1 -47.46 3.47 Favored 'Trans proline' 0 C--N 1.382 2.292 0 C-N-CA 123.165 2.577 . . . . 73.43 112.687 176.736 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . -75.34 78.89 1.09 Allowed Glycine 0 C--N 1.343 0.938 0 O-C-N 123.748 0.655 . . . . 72.2 113.882 -172.824 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 65.4 mt -116.88 117.16 54.49 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.651 0 N-CA-C 108.134 -1.062 . . . . 72.14 108.134 173.99 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 62.8 p -95.92 -168.05 1.69 Allowed 'General case' 0 N--CA 1.476 0.866 0 C-N-CA 123.663 0.785 . . . . 75.11 110.024 179.11 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 32.5 tpt180 -58.82 -63.76 1.18 Allowed 'General case' 0 C--N 1.355 0.819 0 C-N-CA 124.025 0.93 . . . . 72.21 110.271 175.355 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 13.1 m -59.84 -38.04 80.94 Favored 'General case' 0 C--N 1.353 0.73 0 O-C-N 123.989 0.805 . . . . 53.42 111.655 -175.111 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 60' ' ' ILE . . . . . 0.485 HD13 HG21 ' A' ' 4' ' ' THR . 94.5 mt -61.62 -48.79 87.11 Favored 'Isoleucine or valine' 0 C--N 1.357 0.923 0 O-C-N 123.833 0.708 . . . . 75.44 110.28 176.71 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 49.8 tt0 -59.26 -41.69 89.41 Favored 'General case' 0 N--CA 1.479 1.022 0 C-N-CA 123.259 0.623 . . . . 75.34 111.261 -179.211 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 23.6 m-20 -74.04 -32.81 63.5 Favored 'General case' 0 N--CA 1.476 0.833 0 N-CA-C 112.297 0.48 . . . . 63.44 112.297 -178.54 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 63' ' ' MET . . . . . . . . . . . . . 67.8 mtm -71.51 -43.55 66.29 Favored 'General case' 0 N--CA 1.486 1.374 0 CA-C-N 118.194 0.452 . . . . 74.21 110.432 177.408 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 64' ' ' VAL . . . . . 0.483 ' O ' HG13 ' A' ' 68' ' ' ILE . 78.9 t -63.65 -61.64 1.58 Allowed 'Isoleucine or valine' 0 CA--C 1.54 0.576 0 O-C-N 123.936 0.772 . . . . 73.42 109.443 177.68 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -63.26 -26.45 68.79 Favored 'General case' 0 N--CA 1.485 1.287 0 C-N-CA 123.433 0.693 . . . . 31.31 112.442 -179.201 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -66.17 -46.69 78.11 Favored Glycine 0 C--N 1.343 0.958 0 N-CA-C 111.581 -0.607 . . . . 40.43 111.581 174.797 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 67' ' ' TYR . . . . . 0.504 ' CE2' ' HG2' ' A' ' 12' ' ' GLN . 12.6 m-30 -77.15 -23.17 51.67 Favored 'General case' 0 N--CA 1.468 0.446 0 CA-C-O 118.8 -0.619 . . . . 65.24 112.12 178.095 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 68' ' ' ILE . . . . . 0.483 HG13 ' O ' ' A' ' 64' ' ' VAL . 49.4 mt -68.96 -53.68 24.72 Favored 'Isoleucine or valine' 0 C--N 1.363 1.156 0 N-CA-C 108.04 -1.096 . . . . 73.24 108.04 172.472 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 69' ' ' LYS . . . . . 0.511 ' HB2' ' HE2' ' A' ' 106' ' ' TYR . 49.9 tptt -54.14 -46.18 72.15 Favored 'General case' 0 N--CA 1.487 1.394 0 C-N-CA 123.641 0.776 . . . . 75.43 110.962 178.106 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 62.9 tt0 -57.84 -50.2 74.09 Favored 'General case' 0 CA--C 1.537 0.456 0 O-C-N 124.3 1.0 . . . . 72.35 109.99 179.532 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 71' ' ' THR . . . . . 0.598 ' HB ' ' HA ' ' A' ' 15' ' ' ALA . 11.5 t -74.16 -20.44 60.22 Favored 'General case' 0 C--O 1.207 -1.179 0 CA-C-O 118.539 -0.743 . . . . 71.3 111.632 -178.818 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 72' ' ' LEU . . . . . 0.56 HD21 ' HB3' ' A' ' 102' ' ' LEU . 17.9 mt -70.15 -40.04 74.98 Favored 'General case' 0 N--CA 1.484 1.237 0 CA-C-N 118.622 0.646 . . . . 73.22 109.436 175.464 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 71.5 m-20 -66.88 -52.54 42.17 Favored 'General case' 0 C--N 1.342 0.266 0 O-C-N 123.898 0.749 . . . . 62.23 109.799 178.808 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 74' ' ' ASN . . . . . 0.518 ' HA ' HD22 ' A' ' 22' ' ' LEU . 53.9 m-20 -58.04 -50.45 73.39 Favored 'General case' 0 N--CA 1.479 1.025 0 C-N-CA 123.661 0.785 . . . . 73.24 110.932 -179.523 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 75' ' ' GLU . . . . . 0.495 ' O ' ' HG2' ' A' ' 79' ' ' LYS . 4.8 tp10 -57.35 -60.2 3.99 Favored 'General case' 0 N--CA 1.473 0.724 0 C-N-CA 124.162 0.985 . . . . 72.32 110.564 179.674 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 7.8 tt0 -61.29 -35.48 77.45 Favored 'General case' 0 N--CA 1.479 1.002 0 C-N-CA 123.985 0.914 . . . . 71.21 111.658 -171.525 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 77' ' ' LEU . . . . . 0.418 ' O ' ' HB2' ' A' ' 81' ' ' LEU . 63.5 mt -60.35 -51.29 70.13 Favored 'General case' 0 C--N 1.357 0.902 0 O-C-N 123.862 0.726 . . . . 74.14 109.426 173.579 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 78' ' ' LEU . . . . . 0.603 HD21 ' HA ' ' A' ' 22' ' ' LEU . 75.6 mt -59.03 -39.4 81.83 Favored 'General case' 0 N--CA 1.484 1.246 0 O-C-N 123.765 0.666 . . . . 74.24 112.45 177.952 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 79' ' ' LYS . . . . . 0.495 ' HG2' ' O ' ' A' ' 75' ' ' GLU . 7.8 mmpt? -65.5 -40.19 92.76 Favored 'General case' 0 CA--C 1.546 0.802 0 N-CA-C 109.618 -0.512 . . . . 70.24 109.618 -178.079 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -85.5 -8.87 79.99 Favored Glycine 0 C--N 1.349 1.257 0 CA-C-N 115.347 -0.842 . . . . 61.22 113.586 176.291 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 81' ' ' LEU . . . . . 0.624 HD22 ' HH2' ' A' ' 30' ' ' TRP . 2.5 tt -81.99 -41.85 20.18 Favored 'General case' 0 N--CA 1.479 0.996 0 C-N-CA 123.114 0.565 . . . . 72.55 109.635 178.693 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 82' ' ' LEU . . . . . 0.436 ' HG ' ' O ' ' A' ' 78' ' ' LEU . 97.1 mt . . . . . 0 N--CA 1.482 1.144 0 N-CA-C 112.68 0.622 . . . . 70.23 112.68 -173.976 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 92' ' ' LEU . . . . . 0.538 HD22 ' HG2' ' A' ' 45' ' ' GLU . 20.8 mt . . . . . 0 N--CA 1.474 0.767 0 CA-C-O 118.459 -0.781 . . . . 71.43 109.003 . . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 65.3 mt -42.52 -48.24 1.1 Allowed 'Isoleucine or valine' 0 C--N 1.367 1.368 0 C-N-CA 124.151 0.98 . . . . 65.22 110.341 167.915 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 169.87 -133.97 3.0 Favored Glycine 0 C--N 1.344 1.009 0 CA-C-N 115.534 -0.757 . . . . 23.21 111.424 171.211 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -69.91 154.72 41.59 Favored 'General case' 0 CA--C 1.548 0.871 0 C-N-CA 123.077 0.551 . . . . 70.53 110.919 173.493 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 19.6 m 66.12 -82.91 0.03 OUTLIER 'General case' 0 N--CA 1.48 1.068 0 C-N-CA 125.15 1.38 . . . . 73.34 110.749 -175.766 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 97' ' ' THR . . . . . 0.462 ' HB ' ' HD3' ' A' ' 98' ' ' ARG . 28.6 m 47.02 -82.35 0.01 OUTLIER 'General case' 0 CA--C 1.553 1.072 0 C-N-CA 126.23 1.812 . . . . 55.2 114.795 175.676 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 98' ' ' ARG . . . . . 0.606 ' H ' ' HD3' ' A' ' 98' ' ' ARG . 0.8 OUTLIER -57.48 -56.44 21.79 Favored 'General case' 0 N--CA 1.477 0.919 0 C-N-CA 124.593 1.157 . . . . 74.41 111.539 -164.993 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 51.3 tt0 -61.28 -54.89 38.27 Favored 'General case' 0 CA--C 1.539 0.547 0 CA-C-N 114.672 -1.149 . . . . 64.21 110.596 -174.142 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 87.9 tttt -64.99 -53.65 42.85 Favored 'General case' 0 N--CA 1.476 0.854 0 O-C-N 123.719 0.637 . . . . 73.22 111.704 -176.034 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 44.8 t -57.48 -49.26 76.87 Favored 'General case' 0 N--CA 1.478 0.938 0 C-N-CA 123.773 0.829 . . . . 72.33 111.772 -174.747 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 102' ' ' LEU . . . . . 0.56 ' HB3' HD21 ' A' ' 72' ' ' LEU . 9.4 mp -77.49 -27.03 51.78 Favored 'General case' 0 CA--C 1.556 1.187 0 O-C-N 123.586 0.554 . . . . 62.55 111.55 -176.203 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 24.9 t-20 -70.1 -41.35 74.12 Favored 'General case' 0 N--CA 1.49 1.574 0 C-N-CA 122.64 0.376 . . . . 74.12 111.119 173.946 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 3.8 m-20 -68.89 -41.22 78.59 Favored 'General case' 0 N--CA 1.476 0.871 0 C-N-CA 123.536 0.734 . . . . 71.3 109.194 178.035 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -60.08 -40.11 88.42 Favored 'General case' 0 C--N 1.352 0.694 0 O-C-N 124.07 0.856 . . . . 40.4 110.478 176.284 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 106' ' ' TYR . . . . . 0.511 ' HE2' ' HB2' ' A' ' 69' ' ' LYS . 4.6 t80 -64.2 -49.5 71.76 Favored 'General case' 0 N--CA 1.475 0.784 0 C-N-CA 123.695 0.798 . . . . 73.24 110.596 178.278 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -63.96 -40.49 98.31 Favored Glycine 0 C--N 1.353 1.513 0 O-C-N 123.431 0.457 . . . . 31.44 113.019 -175.65 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 93.8 mtt180 -74.49 -30.22 61.74 Favored 'General case' 0 N--CA 1.469 0.49 0 C-N-CA 123.446 0.698 . . . . 72.4 110.603 178.239 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 52.4 tp -64.17 -45.06 90.09 Favored 'General case' 0 N--CA 1.484 1.238 0 C-N-CA 123.368 0.667 . . . . 75.21 110.272 173.895 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 39.8 t -63.0 -48.75 77.47 Favored 'General case' 0 CA--C 1.538 0.484 0 O-C-N 124.558 1.161 . . . . 63.35 110.149 -179.521 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . -81.22 -61.45 2.1 Favored Glycine 0 C--N 1.349 1.295 0 C-N-CA 121.243 -0.503 . . . . 62.03 113.515 -176.565 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 112' ' ' MET . . . . . . . . . . . . . 64.6 mmm -93.44 -65.72 0.97 Allowed 'General case' 0 N--CA 1.484 1.271 0 N-CA-C 114.127 1.158 . . . . 72.04 114.127 -173.351 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 113' ' ' LEU . . . . . 0.485 HD11 ' HA ' ' A' ' 54' ' ' PRO . 5.8 tt 179.94 -36.29 0.01 OUTLIER 'General case' 0 N--CA 1.474 0.771 0 C-N-CA 124.099 0.96 . . . . 74.11 108.517 -168.947 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 114' ' ' LEU . . . . . 0.442 ' HB2' ' O ' ' A' ' 113' ' ' LEU . 3.5 tt . . . . . 0 N--CA 1.498 1.936 0 C-N-CA 129.263 3.025 . . . . 63.12 106.367 178.284 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 22.1 ttt . . . . . 0 N--CA 1.485 1.313 0 CA-C-O 119.628 -0.225 . . . . 65.42 110.777 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 36.8 p -52.36 -45.84 65.91 Favored 'General case' 0 N--CA 1.487 1.378 0 C-N-CA 123.736 0.815 . . . . 75.34 112.394 -175.221 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 17.4 m -67.81 -33.47 74.87 Favored 'General case' 0 CA--C 1.552 1.051 0 C-N-CA 123.46 0.704 . . . . 73.1 111.497 -178.547 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 4' ' ' THR . . . . . 0.545 HG21 HD13 ' A' ' 60' ' ' ILE . 60.2 m -70.94 -41.18 71.49 Favored 'General case' 0 N--CA 1.475 0.793 0 C-N-CA 123.705 0.802 . . . . 23.31 110.739 177.536 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 95.5 t -66.67 -37.56 79.78 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.835 0 C-N-CA 123.353 0.661 . . . . 70.21 109.62 -179.168 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 6' ' ' GLU . . . . . 0.401 ' O ' ' HG3' ' A' ' 10' ' ' ARG . 57.2 mt-10 -62.49 -48.69 78.46 Favored 'General case' 0 C--N 1.356 0.861 0 O-C-N 123.727 0.642 . . . . 43.41 110.242 171.344 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 30.4 t80 -61.34 -46.17 91.36 Favored 'General case' 0 N--CA 1.481 1.102 0 C-N-CA 124.268 1.027 . . . . 63.21 111.249 -174.086 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 82.9 mt -65.57 -41.31 90.49 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.785 0 C-N-CA 123.789 0.835 . . . . 70.41 109.741 176.208 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 3.7 t-20 -65.6 -28.17 68.94 Favored 'General case' 0 N--CA 1.484 1.26 0 C-N-CA 123.02 0.528 . . . . 61.41 111.426 179.452 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 10' ' ' ARG . . . . . 0.425 ' HD3' HG22 ' A' ' 47' ' ' VAL . 62.4 mtt85 -70.11 -46.9 63.84 Favored 'General case' 0 C--O 1.224 -0.244 0 N-CA-C 109.168 -0.679 . . . . 74.0 109.168 174.504 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 11' ' ' TRP . . . . . 0.432 ' CD1' HG13 ' A' ' 64' ' ' VAL . 91.1 m95 -68.86 -20.96 64.29 Favored 'General case' 0 N--CA 1.478 0.935 0 O-C-N 123.385 0.428 . . . . 62.0 111.818 175.731 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 53.9 mt-30 -65.97 -52.19 51.72 Favored 'General case' 0 N--CA 1.477 0.921 0 N-CA-C 108.016 -1.105 . . . . 73.41 108.016 169.323 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 14.8 tpt180 -55.61 -44.86 77.44 Favored 'General case' 0 CA--C 1.547 0.856 0 O-C-N 124.267 0.98 . . . . 73.13 111.224 -179.368 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 14' ' ' ILE . . . . . 0.634 HD11 HG21 ' A' ' 47' ' ' VAL . 77.8 mt -70.41 -50.25 47.3 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.81 0 C-N-CA 123.775 0.83 . . . . 72.45 111.096 -177.011 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -58.54 -44.57 89.66 Favored 'General case' 0 N--CA 1.485 1.275 0 C-N-CA 123.688 0.795 . . . . 73.14 111.263 -178.8 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 95.1 mt -71.92 -43.58 65.09 Favored 'General case' 0 N--CA 1.475 0.821 0 CA-C-N 114.514 -1.221 . . . . 63.14 110.918 -177.879 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.427 ' O ' ' HG ' ' A' ' 21' ' ' LEU . 17.7 mt -63.1 -44.59 95.26 Favored 'General case' 0 N--CA 1.487 1.396 0 CA-C-O 119.227 -0.416 . . . . 64.45 110.992 178.772 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 81.0 p -65.08 -39.58 93.41 Favored 'General case' 0 N--CA 1.474 0.773 0 C-N-CA 123.006 0.522 . . . . 54.03 110.667 -178.961 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 24.7 tp60 -59.66 -47.98 83.46 Favored 'General case' 0 C--N 1.359 1.014 0 O-C-N 123.894 0.746 . . . . 73.21 110.33 174.47 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 68.1 m -58.37 -52.94 63.51 Favored 'General case' 0 C--O 1.208 -1.116 0 CA-C-N 115.456 -0.793 . . . . 61.2 110.481 177.701 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 21' ' ' LEU . . . . . 0.566 HD22 ' HA ' ' A' ' 33' ' ' LEU . 89.1 mt -65.92 -24.71 66.88 Favored 'General case' 0 N--CA 1.474 0.736 0 C-N-CA 124.197 0.999 . . . . 60.11 111.486 -175.145 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 22' ' ' LEU . . . . . 0.691 ' HA ' HD21 ' A' ' 78' ' ' LEU . 57.4 tp -69.88 -53.81 16.34 Favored 'General case' 0 C--N 1.356 0.873 0 N-CA-C 109.814 -0.439 . . . . 75.43 109.814 174.357 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 23' ' ' GLU . . . . . 0.408 ' O ' ' HG3' ' A' ' 27' ' ' ARG . 40.8 mt-10 -57.27 -49.94 74.47 Favored 'General case' 0 N--CA 1.48 1.067 0 O-C-N 123.968 0.792 . . . . 74.11 110.161 178.628 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 24' ' ' LEU . . . . . 0.53 ' HB3' ' HB2' ' A' ' 29' ' ' GLU . 95.0 mt -59.4 -42.23 91.27 Favored 'General case' 0 CA--C 1.536 0.438 0 C-N-CA 125.244 1.418 . . . . 71.22 110.878 -178.218 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 25' ' ' ALA . . . . . 0.64 ' HB2' HD21 ' A' ' 33' ' ' LEU . . . -58.73 -48.62 80.52 Favored 'General case' 0 N--CA 1.48 1.032 0 C-N-CA 122.613 0.365 . . . . 64.11 110.753 175.78 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 96.1 mt-30 -63.04 -30.25 71.45 Favored 'General case' 0 CA--C 1.55 0.945 0 O-C-N 124.063 0.852 . . . . 61.23 111.407 -179.591 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 27' ' ' ARG . . . . . 0.408 ' HG3' ' O ' ' A' ' 23' ' ' GLU . 90.4 mtt180 -78.83 -28.05 44.36 Favored 'General case' 0 N--CA 1.483 1.207 0 C-N-CA 123.688 0.795 . . . . 74.22 111.082 178.216 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 98.73 22.53 13.66 Favored Glycine 0 C--N 1.352 1.436 0 C-N-CA 123.117 0.389 . . . . 44.11 113.603 -176.493 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 29' ' ' GLU . . . . . 0.53 ' HB2' ' HB3' ' A' ' 24' ' ' LEU . 14.8 mm-40 -86.52 54.27 3.1 Favored 'General case' 0 CA--C 1.552 1.044 0 C-N-CA 125.04 1.336 . . . . 74.44 110.396 177.72 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 30' ' ' TRP . . . . . 0.517 ' HH2' HD21 ' A' ' 81' ' ' LEU . 57.2 m95 -59.49 -33.84 71.84 Favored 'General case' 0 N--CA 1.486 1.34 0 C-N-CA 124.257 1.023 . . . . 71.22 112.009 -171.952 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 3.7 m-20 -58.62 -41.42 85.88 Favored 'General case' 0 N--CA 1.474 0.736 0 C-N-CA 124.462 1.105 . . . . 75.24 110.697 -178.407 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 86.0 mt -69.78 -31.83 69.99 Favored 'General case' 0 N--CA 1.472 0.647 0 CA-C-N 115.141 -0.936 . . . . 63.13 110.955 -177.369 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 33' ' ' LEU . . . . . 0.64 HD21 ' HB2' ' A' ' 25' ' ' ALA . 10.1 mp -67.71 -43.94 78.85 Favored 'General case' 0 N--CA 1.482 1.146 0 C-N-CA 122.934 0.494 . . . . 75.24 110.466 174.35 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.421 ' HG ' ' O ' ' A' ' 30' ' ' TRP . 73.1 mt -67.07 -37.58 84.25 Favored 'General case' 0 N--CA 1.484 1.238 0 O-C-N 123.606 0.566 . . . . 61.32 111.767 -177.53 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 98.5 mt-30 -70.91 -54.1 12.64 Favored 'General case' 0 N--CA 1.477 0.889 0 C-N-CA 123.025 0.53 . . . . 53.51 110.172 177.969 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 83.6 mm-40 -68.34 -16.45 63.94 Favored 'General case' 0 N--CA 1.474 0.741 0 CA-C-O 118.484 -0.769 . . . . 74.13 112.382 -178.622 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 33.3 tt0 -50.39 -46.3 56.01 Favored 'General case' 0 N--CA 1.48 1.068 0 C-N-CA 123.306 0.642 . . . . 74.51 111.348 176.947 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 60.5 t -62.32 -55.67 22.51 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.752 0 C-N-CA 123.336 0.655 . . . . 55.2 111.403 -176.022 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 29.4 p -68.52 -39.62 81.11 Favored 'General case' 0 N--CA 1.478 0.95 0 C-N-CA 123.614 0.766 . . . . 63.01 111.675 -175.957 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 45.6 t80 -64.83 -49.31 71.12 Favored 'General case' 0 N--CA 1.477 0.92 0 C-N-CA 124.189 0.996 . . . . 72.34 111.063 -177.412 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 41' ' ' LEU . . . . . 0.562 ' HA ' HG22 ' A' ' 44' ' ' ILE . 86.8 mt -72.77 -34.09 66.73 Favored 'General case' 0 C--O 1.243 0.76 0 O-C-N 123.721 0.638 . . . . 71.33 111.066 -178.566 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 53.2 tt0 -57.36 -51.85 67.72 Favored 'General case' 0 C--N 1.353 0.736 0 O-C-N 123.666 0.604 . . . . 73.34 109.513 173.625 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 43' ' ' SER . . . . . 0.594 ' O ' HG23 ' A' ' 47' ' ' VAL . 69.0 m -56.94 -56.39 22.31 Favored 'General case' 0 C--N 1.351 0.664 0 O-C-N 124.479 1.112 . . . . 63.15 110.423 179.865 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 44' ' ' ILE . . . . . 0.607 HG13 HD13 ' A' ' 14' ' ' ILE . 14.3 tt -62.61 -38.54 81.78 Favored 'Isoleucine or valine' 0 C--O 1.252 1.236 0 C-N-CA 123.553 0.741 . . . . 54.03 112.205 -168.687 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 31.9 mm-40 -69.62 -37.78 76.97 Favored 'General case' 0 C--N 1.359 0.993 0 O-C-N 123.114 0.258 . . . . 62.24 110.508 174.819 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 87.6 m -65.46 -28.4 69.19 Favored 'General case' 0 CA--C 1.557 1.214 0 C-N-CA 123.44 0.696 . . . . 61.42 111.762 176.166 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 47' ' ' VAL . . . . . 0.634 HG21 HD11 ' A' ' 14' ' ' ILE . 12.9 t -77.23 -42.45 31.09 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.396 0 O-C-N 122.086 -0.384 . . . . 75.05 110.074 179.123 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 48' ' ' MET . . . . . . . . . . . . . 74.3 mtm -74.43 -13.63 60.74 Favored 'General case' 0 N--CA 1.482 1.135 0 CA-C-N 116.294 -0.412 . . . . 73.53 110.936 173.927 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 15.8 tp10 -80.47 -35.21 35.18 Favored 'General case' 0 N--CA 1.477 0.877 0 C-N-CA 123.457 0.703 . . . . 53.25 109.649 169.171 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 13.9 mptt -70.52 123.58 22.15 Favored 'General case' 0 N--CA 1.472 0.649 0 N-CA-C 109.156 -0.683 . . . . 64.2 109.156 175.611 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 8.8 tt0 -62.71 150.46 41.07 Favored 'General case' 0 C--O 1.242 0.672 0 CA-C-N 115.049 -0.978 . . . . 72.31 110.289 178.316 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 52' ' ' THR . . . . . 0.424 HG21 ' HG ' ' A' ' 113' ' ' LEU . 11.3 m -58.56 116.23 14.45 Favored Pre-proline 0 CA--C 1.552 1.037 0 N-CA-C 109.737 -0.468 . . . . 64.33 109.737 174.452 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 46.5 Cg_endo -64.93 156.08 64.34 Favored 'Trans proline' 0 C--N 1.373 1.848 0 C-N-CA 122.378 2.052 . . . . 75.51 112.414 -177.196 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 46.8 Cg_exo -57.49 -46.4 27.73 Favored 'Trans proline' 0 C--N 1.378 2.102 0 C-N-CA 123.249 2.632 . . . . 54.55 112.875 179.167 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . -77.47 71.13 2.34 Favored Glycine 0 C--N 1.348 1.206 0 CA-C-N 115.597 -0.728 . . . . 34.2 114.343 -175.511 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 19.8 mm -103.56 108.39 24.39 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.6 0 N-CA-C 107.93 -1.137 . . . . 52.44 107.93 170.595 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 57' ' ' THR . . . . . 0.443 ' H ' HD12 ' A' ' 60' ' ' ILE . 64.5 p -89.67 176.31 6.91 Favored 'General case' 0 C--O 1.247 0.946 0 N-CA-C 108.349 -0.982 . . . . 43.33 108.349 167.725 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 34.2 tpt85 -61.5 -50.67 71.8 Favored 'General case' 0 CA--C 1.543 0.702 0 N-CA-C 109.747 -0.464 . . . . 72.23 109.747 179.813 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 37.4 m -58.02 -39.94 79.6 Favored 'General case' 0 CA--C 1.543 0.71 0 O-C-N 124.083 0.865 . . . . 51.43 111.64 179.207 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 60' ' ' ILE . . . . . 0.545 HD13 HG21 ' A' ' 4' ' ' THR . 81.2 mt -63.02 -46.48 96.16 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.094 0 C-N-CA 123.664 0.786 . . . . 62.22 110.784 178.387 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 56.6 tt0 -57.18 -42.71 81.66 Favored 'General case' 0 N--CA 1.478 0.947 0 C-N-CA 123.541 0.736 . . . . 61.13 110.918 177.573 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 44.3 m-20 -70.61 -38.99 74.03 Favored 'General case' 0 N--CA 1.48 1.033 0 CA-C-N 116.025 -0.534 . . . . 63.23 112.151 179.571 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 63' ' ' MET . . . . . . . . . . . . . 72.6 mtm -69.67 -42.37 74.25 Favored 'General case' 0 N--CA 1.485 1.318 0 C-N-CA 122.509 0.324 . . . . 62.22 110.774 -177.816 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 64' ' ' VAL . . . . . 0.522 ' O ' HG13 ' A' ' 68' ' ' ILE . 79.4 t -64.07 -56.7 15.08 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.519 0 O-C-N 123.994 0.809 . . . . 64.42 109.421 177.499 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 65' ' ' ALA . . . . . 0.407 ' HB2' HD23 ' A' ' 109' ' ' LEU . . . -63.33 -29.58 70.87 Favored 'General case' 0 N--CA 1.486 1.339 0 C-N-CA 122.871 0.468 . . . . 73.32 112.012 -179.158 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -67.16 -40.85 92.64 Favored Glycine 0 C--N 1.347 1.168 0 N-CA-C 111.659 -0.576 . . . . 74.24 111.659 175.84 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 67' ' ' TYR . . . . . 0.478 ' O ' HG22 ' A' ' 71' ' ' THR . 15.4 m-30 -69.21 -39.85 78.34 Favored 'General case' 0 C--O 1.241 0.639 0 C-N-CA 123.425 0.69 . . . . 61.31 110.999 175.943 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 68' ' ' ILE . . . . . 0.542 ' O ' ' HG ' ' A' ' 72' ' ' LEU . 36.9 mt -60.11 -44.71 95.67 Favored 'Isoleucine or valine' 0 C--N 1.365 1.256 0 N-CA-C 108.286 -1.005 . . . . 73.21 108.286 176.152 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 69' ' ' LYS . . . . . 0.477 ' HB2' ' HE2' ' A' ' 106' ' ' TYR . 51.5 tptt -58.07 -45.26 87.38 Favored 'General case' 0 N--CA 1.476 0.856 0 C-N-CA 123.82 0.848 . . . . 73.24 110.683 179.166 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 70' ' ' GLN . . . . . 0.428 ' HG2' ' ND2' ' A' ' 74' ' ' ASN . 60.5 tt0 -60.02 -45.97 91.02 Favored 'General case' 0 C--N 1.352 0.688 0 O-C-N 123.798 0.687 . . . . 74.11 110.413 -179.676 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 71' ' ' THR . . . . . 0.478 HG22 ' O ' ' A' ' 67' ' ' TYR . 1.8 t -75.57 -22.74 56.71 Favored 'General case' 0 C--N 1.355 0.814 0 CA-C-O 119.196 -0.431 . . . . 71.33 111.259 -178.584 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 72' ' ' LEU . . . . . 0.542 ' HG ' ' O ' ' A' ' 68' ' ' ILE . 34.2 mt -64.03 -53.33 51.69 Favored 'General case' 0 C--N 1.361 1.101 0 N-CA-C 108.794 -0.817 . . . . 75.12 108.794 173.871 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 66.9 m-20 -64.39 -52.92 55.83 Favored 'General case' 0 N--CA 1.475 0.779 0 O-C-N 123.906 0.754 . . . . 74.35 111.24 -177.077 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 74' ' ' ASN . . . . . 0.428 ' ND2' ' HG2' ' A' ' 70' ' ' GLN . 90.3 m-20 -55.58 -54.0 49.44 Favored 'General case' 0 N--CA 1.482 1.17 0 O-C-N 124.164 0.915 . . . . 75.5 111.188 -177.964 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 75' ' ' GLU . . . . . 0.444 ' HG2' ' HE2' ' A' ' 79' ' ' LYS . 13.8 tt0 -73.31 -30.09 63.14 Favored 'General case' 0 CA--C 1.553 1.077 0 CA-C-N 115.723 -0.672 . . . . 72.42 110.857 -173.225 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 10.1 tt0 -69.1 -39.08 79.19 Favored 'General case' 0 N--CA 1.488 1.472 0 C-N-CA 123.458 0.703 . . . . 75.2 110.568 177.284 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 90.4 mt -63.37 -40.08 96.28 Favored 'General case' 0 C--N 1.351 0.671 0 CA-C-N 115.516 -0.766 . . . . 63.12 109.251 172.478 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 78' ' ' LEU . . . . . 0.691 HD21 ' HA ' ' A' ' 22' ' ' LEU . 50.2 mt -60.56 -37.07 80.08 Favored 'General case' 0 N--CA 1.478 0.958 0 O-C-N 123.904 0.752 . . . . 75.44 112.12 175.112 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 79' ' ' LYS . . . . . 0.444 ' HE2' ' HG2' ' A' ' 75' ' ' GLU . 66.4 mmtt -63.99 -54.79 28.82 Favored 'General case' 0 N--CA 1.476 0.853 0 N-CA-C 108.747 -0.835 . . . . 74.35 108.747 176.493 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -59.87 -26.95 63.67 Favored Glycine 0 C--N 1.358 1.764 0 O-C-N 124.214 0.946 . . . . 53.41 113.72 -179.767 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 81' ' ' LEU . . . . . 0.517 HD21 ' HH2' ' A' ' 30' ' ' TRP . 8.5 tt -77.91 -40.71 38.94 Favored 'General case' 0 CA--C 1.545 0.76 0 C-N-CA 124.258 1.023 . . . . 25.44 109.755 179.711 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 58.1 mt . . . . . 0 N--CA 1.478 0.968 0 C-N-CA 122.447 0.299 . . . . 61.11 111.435 -178.624 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 92' ' ' LEU . . . . . 0.549 HD11 ' HE ' ' A' ' 98' ' ' ARG . 11.2 mt . . . . . 0 N--CA 1.483 1.191 0 CA-C-O 121.505 0.669 . . . . 72.03 110.437 . . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 93' ' ' ILE . . . . . 0.413 ' H ' ' HB2' ' A' ' 92' ' ' LEU . 65.5 mt -148.87 -51.46 0.08 OUTLIER 'Isoleucine or valine' 0 N--CA 1.476 0.839 0 N-CA-C 106.179 -1.785 . . . . 54.12 106.179 -164.93 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -131.63 -175.74 14.12 Favored Glycine 0 C--N 1.352 1.426 0 CA-C-N 114.032 -1.44 . . . . 63.04 112.568 -178.627 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 34.9 tt0 -74.15 -71.25 0.34 Allowed 'General case' 0 N--CA 1.473 0.719 0 C-N-CA 125.145 1.378 . . . . 72.51 111.708 -170.829 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 33.4 p -94.66 10.78 33.58 Favored 'General case' 0 C--O 1.241 0.609 0 C-N-CA 123.428 0.691 . . . . 70.43 111.63 -173.869 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 88.4 m -52.59 -39.51 61.67 Favored 'General case' 0 C--N 1.361 1.071 0 C-N-CA 124.544 1.138 . . . . 51.3 111.976 177.833 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 98' ' ' ARG . . . . . 0.924 HH12 HD22 ' A' ' 102' ' ' LEU . 4.0 tpm_? -56.89 -61.68 2.27 Favored 'General case' 0 N--CA 1.469 0.515 0 C-N-CA 123.275 0.63 . . . . 70.04 112.039 -168.145 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 49.5 tt0 -83.66 -42.57 16.52 Favored 'General case' 0 CA--C 1.534 0.362 0 CA-C-N 115.063 -0.972 . . . . 71.52 110.28 -169.526 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 8.0 tmtm? -62.81 -55.61 24.8 Favored 'General case' 0 N--CA 1.476 0.835 0 O-C-N 124.106 0.879 . . . . 73.43 109.529 -177.332 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 46.6 t -72.79 -35.37 67.38 Favored 'General case' 0 N--CA 1.478 0.931 0 CA-C-O 118.622 -0.704 . . . . 74.34 111.916 -174.896 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 102' ' ' LEU . . . . . 0.924 HD22 HH12 ' A' ' 98' ' ' ARG . 21.6 tp -67.96 -47.35 68.87 Favored 'General case' 0 C--N 1.368 1.402 0 CA-C-N 118.93 0.786 . . . . 75.34 111.212 179.748 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 59.7 t30 -74.08 -24.35 59.48 Favored 'General case' 0 N--CA 1.478 0.93 0 CA-C-N 115.796 -0.638 . . . . 74.12 110.792 -178.754 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 104' ' ' ASN . . . . . 0.421 ' O ' ' HG2' ' A' ' 108' ' ' ARG . 7.7 t30 -71.13 -39.16 72.16 Favored 'General case' 0 N--CA 1.479 1.016 0 C-N-CA 122.531 0.332 . . . . 75.21 110.223 170.781 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -63.09 -37.92 89.13 Favored 'General case' 0 N--CA 1.483 1.2 0 C-N-CA 123.047 0.539 . . . . 54.52 110.306 178.204 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 106' ' ' TYR . . . . . 0.477 ' HE2' ' HB2' ' A' ' 69' ' ' LYS . 3.5 t80 -57.93 -52.07 67.01 Favored 'General case' 0 C--N 1.356 0.876 0 CA-C-N 114.941 -1.027 . . . . 64.35 108.973 168.85 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -60.51 -31.95 76.29 Favored Glycine 0 C--N 1.352 1.423 0 O-C-N 124.056 0.848 . . . . 62.34 113.673 -176.235 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 108' ' ' ARG . . . . . 0.421 ' HG2' ' O ' ' A' ' 104' ' ' ASN . 5.1 mmp_? -76.69 -36.42 57.26 Favored 'General case' 0 C--N 1.344 0.344 0 N-CA-C 109.259 -0.645 . . . . 73.31 109.259 177.871 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 109' ' ' LEU . . . . . 0.41 HD13 ' HB2' ' A' ' 114' ' ' LEU . 42.1 tp -68.75 -30.69 69.35 Favored 'General case' 0 N--CA 1.489 1.489 0 C-N-CA 123.015 0.526 . . . . 44.42 111.152 177.235 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 38.5 t -77.66 -39.04 46.34 Favored 'General case' 0 CA--C 1.543 0.699 0 CA-C-N 115.014 -0.994 . . . . 71.1 109.584 178.105 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . -90.07 -64.03 1.25 Allowed Glycine 0 C--N 1.36 1.904 0 CA-C-O 119.571 -0.572 . . . . 72.11 114.272 -177.36 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 112' ' ' MET . . . . . . . . . . . . . 11.2 tpt -96.79 -70.56 0.71 Allowed 'General case' 0 N--CA 1.489 1.501 0 CA-C-N 118.104 0.952 . . . . 74.51 113.272 -178.548 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 113' ' ' LEU . . . . . 0.424 ' HG ' HG21 ' A' ' 52' ' ' THR . 22.0 tp 170.11 41.69 0.0 OUTLIER 'General case' 0 N--CA 1.495 1.822 0 C-N-CA 124.195 0.998 . . . . 75.44 109.389 -177.125 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 114' ' ' LEU . . . . . 0.41 ' HB2' HD13 ' A' ' 109' ' ' LEU . 5.3 tt . . . . . 0 N--CA 1.504 2.248 0 C-N-CA 126.36 1.864 . . . . 73.1 111.575 179.668 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 25.5 ptm . . . . . 0 N--CA 1.482 1.167 0 N-CA-C 110.621 -0.14 . . . . 72.33 110.621 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 40.3 p -57.06 -46.32 82.54 Favored 'General case' 0 N--CA 1.479 0.996 0 C-N-CA 123.802 0.841 . . . . 71.1 112.356 -175.784 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 23.5 m -70.79 -25.42 62.87 Favored 'General case' 0 N--CA 1.473 0.724 0 C-N-CA 123.265 0.626 . . . . 60.42 111.331 -179.518 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 4' ' ' THR . . . . . 0.411 ' HA ' ' HG3' ' A' ' 53' ' ' PRO . 25.5 m -75.56 -40.63 56.48 Favored 'General case' 0 C--N 1.35 0.602 0 C-N-CA 123.426 0.691 . . . . 53.2 110.839 178.1 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 92.8 t -67.85 -34.9 70.15 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.849 0 C-N-CA 123.543 0.737 . . . . 72.11 109.538 175.285 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 6' ' ' GLU . . . . . 0.521 ' O ' ' HG3' ' A' ' 10' ' ' ARG . 10.5 tm-20 -71.91 -32.32 67.27 Favored 'General case' 0 N--CA 1.472 0.668 0 C-N-CA 124.179 0.992 . . . . 72.11 110.226 176.504 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 7' ' ' PHE . . . . . 0.413 ' O ' ' HB2' ' A' ' 10' ' ' ARG . 62.3 t80 -70.68 -43.48 69.0 Favored 'General case' 0 N--CA 1.48 1.03 0 C-N-CA 123.871 0.868 . . . . 64.5 110.72 177.47 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 8' ' ' ILE . . . . . 0.539 HD11 HG23 ' A' ' 60' ' ' ILE . 84.5 mt -62.34 -39.21 83.38 Favored 'Isoleucine or valine' 0 C--O 1.212 -0.898 0 N-CA-C 109.178 -0.675 . . . . 75.14 109.178 173.326 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 3.3 t-20 -61.09 -38.03 84.81 Favored 'General case' 0 N--CA 1.483 1.177 0 C-N-CA 124.043 0.937 . . . . 73.21 111.086 175.866 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 10' ' ' ARG . . . . . 0.531 ' HB3' HG22 ' A' ' 47' ' ' VAL . 73.4 mtt180 -56.77 -53.77 53.94 Favored 'General case' 0 N--CA 1.475 0.811 0 O-C-N 123.82 0.7 . . . . 72.32 109.925 174.625 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 11' ' ' TRP . . . . . 0.424 ' CD1' HG13 ' A' ' 64' ' ' VAL . 99.7 m95 -75.59 -23.27 56.45 Favored 'General case' 0 N--CA 1.471 0.58 0 CA-C-N 114.918 -1.037 . . . . 75.54 113.107 -176.062 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 51.4 mt-30 -62.88 -46.7 86.6 Favored 'General case' 0 N--CA 1.47 0.556 0 N-CA-C 108.134 -1.061 . . . . 75.53 108.134 169.841 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 10.9 tpt180 -63.99 -48.39 76.58 Favored 'General case' 0 CA--C 1.54 0.59 0 CA-C-N 114.695 -1.139 . . . . 73.25 111.226 -175.721 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 14' ' ' ILE . . . . . 0.55 HD13 HG13 ' A' ' 44' ' ' ILE . 48.2 mt -64.62 -48.91 82.83 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.316 0 O-C-N 123.194 0.309 . . . . 61.44 110.287 -179.978 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 15' ' ' ALA . . . . . 0.567 ' HA ' ' HB ' ' A' ' 71' ' ' THR . . . -54.41 -45.56 72.97 Favored 'General case' 0 C--N 1.36 1.046 0 O-C-N 123.983 0.802 . . . . 74.3 111.163 -178.969 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 84.4 mt -78.73 -36.52 43.11 Favored 'General case' 0 N--CA 1.476 0.858 0 CA-C-N 114.989 -1.005 . . . . 55.34 112.124 -174.311 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.451 ' O ' ' HG ' ' A' ' 21' ' ' LEU . 64.3 mt -67.54 -45.36 75.91 Favored 'General case' 0 N--CA 1.487 1.375 0 CA-C-N 118.057 0.39 . . . . 64.04 110.395 179.813 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 77.8 p -67.49 -37.25 82.58 Favored 'General case' 0 N--CA 1.477 0.901 0 C-N-CA 123.211 0.604 . . . . 71.13 110.79 176.794 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 30.7 tp60 -61.13 -42.29 98.27 Favored 'General case' 0 C--N 1.357 0.906 0 O-C-N 123.701 0.626 . . . . 70.32 110.612 175.407 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 69.2 m -60.31 -49.5 77.36 Favored 'General case' 0 C--N 1.347 0.461 0 O-C-N 124.069 0.856 . . . . 73.42 109.686 176.37 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 21' ' ' LEU . . . . . 0.719 HD22 ' HA ' ' A' ' 33' ' ' LEU . 26.2 mt -61.36 -33.36 73.5 Favored 'General case' 0 CA--C 1.547 0.85 0 O-C-N 124.014 0.821 . . . . 60.33 110.917 -178.919 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 22' ' ' LEU . . . . . 0.741 ' HA ' HD21 ' A' ' 78' ' ' LEU . 56.0 tp -67.29 -54.01 24.62 Favored 'General case' 0 N--CA 1.482 1.139 0 C-N-CA 123.271 0.629 . . . . 73.41 110.692 179.74 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 42.5 mt-10 -56.53 -49.6 74.32 Favored 'General case' 0 N--CA 1.474 0.752 0 C-N-CA 124.335 1.054 . . . . 72.13 110.735 178.95 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 24' ' ' LEU . . . . . 0.407 HD22 HD12 ' A' ' 32' ' ' LEU . 91.5 mt -67.24 -33.74 75.98 Favored 'General case' 0 C--O 1.217 -0.62 0 CA-C-N 114.987 -1.006 . . . . 75.31 111.21 -176.133 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 25' ' ' ALA . . . . . 0.542 ' HB2' HD21 ' A' ' 33' ' ' LEU . . . -67.65 -42.62 81.92 Favored 'General case' 0 N--CA 1.483 1.208 0 C-N-CA 122.867 0.467 . . . . 74.42 111.594 177.699 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 97.1 mt-30 -70.97 -23.86 62.3 Favored 'General case' 0 N--CA 1.475 0.812 0 CA-C-N 115.532 -0.758 . . . . 73.3 111.069 176.678 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 79.0 mtt180 -78.68 -21.13 48.67 Favored 'General case' 0 N--CA 1.479 0.999 0 C-N-CA 123.562 0.745 . . . . 73.13 110.588 170.71 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 91.77 9.55 62.52 Favored Glycine 0 C--N 1.348 1.216 0 C-N-CA 123.05 0.357 . . . . 72.34 113.332 179.485 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 18.6 mm-40 -82.81 61.27 5.78 Favored 'General case' 0 CA--C 1.547 0.828 0 C-N-CA 124.622 1.169 . . . . 72.32 110.687 177.775 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 30' ' ' TRP . . . . . 0.41 ' O ' ' HG ' ' A' ' 34' ' ' LEU . 59.6 m95 -63.91 -29.71 70.86 Favored 'General case' 0 N--CA 1.484 1.25 0 C-N-CA 123.863 0.865 . . . . 74.21 110.999 -176.788 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 -56.21 -47.31 78.65 Favored 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 124.265 1.026 . . . . 64.31 110.287 175.718 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 0.407 HD12 HD22 ' A' ' 24' ' ' LEU . 35.5 mt -64.59 -31.03 72.07 Favored 'General case' 0 N--CA 1.474 0.733 0 CA-C-N 115.16 -0.927 . . . . 72.0 110.927 -179.0 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 33' ' ' LEU . . . . . 0.719 ' HA ' HD22 ' A' ' 21' ' ' LEU . 10.5 mp -62.42 -49.01 77.19 Favored 'General case' 0 N--CA 1.477 0.884 0 N-CA-C 109.76 -0.459 . . . . 71.33 109.76 171.554 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.41 ' HG ' ' O ' ' A' ' 30' ' ' TRP . 80.5 mt -58.01 -41.47 83.19 Favored 'General case' 0 N--CA 1.484 1.257 0 O-C-N 123.856 0.722 . . . . 65.31 112.397 -177.195 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 1.4 mp0 -73.81 -56.55 4.84 Favored 'General case' 0 N--CA 1.488 1.438 0 C-N-CA 122.859 0.464 . . . . 73.31 111.778 178.572 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 84.7 mm-40 -66.04 -19.71 65.94 Favored 'General case' 0 N--CA 1.488 1.46 0 C-N-CA 122.965 0.506 . . . . 74.55 111.793 -175.205 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 37' ' ' GLU . . . . . 0.473 ' O ' ' HG ' ' A' ' 41' ' ' LEU . 22.7 tt0 -60.02 -36.98 78.43 Favored 'General case' 0 C--N 1.358 0.969 0 C-N-CA 123.291 0.636 . . . . 73.1 111.277 179.578 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 62.2 t -53.1 -48.95 52.62 Favored 'Isoleucine or valine' 0 CA--C 1.556 1.182 0 C-N-CA 123.341 0.656 . . . . 71.11 110.764 -179.24 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 70.9 m -72.65 -33.2 66.43 Favored 'General case' 0 CA--C 1.537 0.444 0 CA-C-N 115.129 -0.941 . . . . 64.54 111.617 177.618 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 33.2 t80 -62.12 -40.75 96.97 Favored 'General case' 0 N--CA 1.481 1.08 0 C-N-CA 122.786 0.434 . . . . 73.15 110.984 176.24 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 41' ' ' LEU . . . . . 0.473 ' HG ' ' O ' ' A' ' 37' ' ' GLU . 56.0 mt -69.74 -52.78 22.43 Favored 'General case' 0 C--O 1.245 0.857 0 C-N-CA 123.953 0.901 . . . . 63.15 109.859 -178.28 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 53.2 tt0 -55.81 -49.97 71.8 Favored 'General case' 0 C--N 1.358 0.954 0 CA-C-N 114.882 -1.054 . . . . 72.24 110.832 -179.112 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 43' ' ' SER . . . . . 0.535 ' O ' HG23 ' A' ' 47' ' ' VAL . 66.1 m -60.94 -56.28 22.93 Favored 'General case' 0 C--N 1.348 0.541 0 O-C-N 123.991 0.807 . . . . 53.2 111.055 -178.78 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 44' ' ' ILE . . . . . 0.55 HG13 HD13 ' A' ' 14' ' ' ILE . 11.9 tt -58.97 -42.77 87.09 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.192 0 O-C-N 123.692 0.62 . . . . 74.34 111.558 -171.806 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 45' ' ' GLU . . . . . 0.484 ' HG2' HD22 ' A' ' 92' ' ' LEU . 54.9 mm-40 -63.65 -44.96 92.3 Favored 'General case' 0 C--N 1.359 0.99 0 C-N-CA 122.705 0.402 . . . . 75.11 111.039 177.263 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 99.2 m -55.93 -42.58 76.33 Favored 'General case' 0 N--CA 1.479 1.003 0 O-C-N 123.638 0.586 . . . . 75.53 111.248 177.55 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 47' ' ' VAL . . . . . 0.535 HG23 ' O ' ' A' ' 43' ' ' SER . 96.2 t -63.67 -46.45 94.69 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.701 0 C-N-CA 124.018 0.927 . . . . 73.43 111.074 -179.579 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 48' ' ' MET . . . . . 0.565 ' SD ' HD13 ' A' ' 102' ' ' LEU . 77.2 mtm -71.52 -25.89 62.43 Favored 'General case' 0 N--CA 1.478 0.939 0 CA-C-N 115.432 -0.804 . . . . 72.12 112.469 -176.55 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 54.9 mt-10 -94.3 -18.79 21.28 Favored 'General case' 0 N--CA 1.485 1.284 0 N-CA-C 112.544 0.572 . . . . 72.31 112.544 179.605 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 1.3 mptm? -91.38 146.33 23.9 Favored 'General case' 0 N--CA 1.483 1.213 0 C-N-CA 122.981 0.512 . . . . 75.14 109.861 179.387 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 4.9 pt20 -70.75 143.54 51.21 Favored 'General case' 0 CA--C 1.537 0.479 0 C-N-CA 123.503 0.721 . . . . 74.24 112.806 -167.888 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 95.2 m -80.16 118.26 71.58 Favored Pre-proline 0 CA--C 1.55 0.949 0 C-N-CA 124.413 1.085 . . . . 64.2 108.735 172.007 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 53' ' ' PRO . . . . . 0.411 ' HG3' ' HA ' ' A' ' 4' ' ' THR . 31.8 Cg_endo -61.99 153.37 69.18 Favored 'Trans proline' 0 C--N 1.374 1.884 0 C-N-CA 122.28 1.987 . . . . 74.32 112.14 -179.266 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 45.6 Cg_endo -68.27 -46.86 1.88 Allowed 'Trans proline' 0 C--N 1.371 1.757 0 C-N-CA 122.612 2.208 . . . . 52.22 112.216 179.236 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . -74.24 79.4 0.91 Allowed Glycine 0 C--N 1.349 1.28 0 O-C-N 123.591 0.557 . . . . 63.21 113.23 -176.571 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 56' ' ' ILE . . . . . 0.455 ' HB ' HD21 ' A' ' 113' ' ' LEU . 66.9 mt -128.49 107.84 16.56 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.79 0 C-N-CA 124.858 1.263 . . . . 74.24 107.704 175.554 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 57' ' ' THR . . . . . 0.408 ' H ' HD12 ' A' ' 60' ' ' ILE . 38.4 p -82.4 -178.44 7.05 Favored 'General case' 0 CA--C 1.542 0.662 0 C-N-CA 123.506 0.722 . . . . 64.42 110.989 -179.678 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 25.1 tpt180 -53.71 -55.61 24.6 Favored 'General case' 0 N--CA 1.475 0.802 0 C-N-CA 124.892 1.277 . . . . 72.44 111.884 -177.329 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 17.5 m -59.6 -40.31 87.06 Favored 'General case' 0 N--CA 1.478 0.954 0 O-C-N 123.782 0.676 . . . . 74.43 112.107 -177.542 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 60' ' ' ILE . . . . . 0.539 HG23 HD11 ' A' ' 8' ' ' ILE . 66.4 mt -66.42 -40.8 87.52 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.75 0 O-C-N 123.941 0.775 . . . . 74.44 110.61 178.625 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 61.1 tt0 -64.17 -38.62 91.73 Favored 'General case' 0 CA--C 1.543 0.711 0 C-N-CA 124.288 1.035 . . . . 75.12 110.524 -179.049 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 43.4 m-20 -72.8 -38.14 67.32 Favored 'General case' 0 N--CA 1.476 0.868 0 CA-C-N 115.661 -0.699 . . . . 71.44 111.731 177.815 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 63' ' ' MET . . . . . . . . . . . . . 74.1 mtm -65.23 -48.23 74.04 Favored 'General case' 0 N--CA 1.486 1.327 0 C-N-CA 122.291 0.236 . . . . 72.44 110.963 177.841 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 64' ' ' VAL . . . . . 0.51 ' O ' HG13 ' A' ' 68' ' ' ILE . 75.7 t -61.87 -55.93 21.06 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.589 0 C-N-CA 123.554 0.742 . . . . 65.01 110.729 179.188 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -63.59 -27.36 69.19 Favored 'General case' 0 N--CA 1.485 1.32 0 C-N-CA 122.416 0.286 . . . . 74.54 111.368 -179.396 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -67.23 -40.11 92.28 Favored Glycine 0 C--N 1.349 1.271 0 O-C-N 123.66 0.6 . . . . 51.42 112.063 174.677 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 18.6 m-30 -71.39 -35.44 71.04 Favored 'General case' 0 N--CA 1.472 0.656 0 C-N-CA 123.499 0.72 . . . . 73.23 111.624 176.866 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 68' ' ' ILE . . . . . 0.528 ' O ' ' HG ' ' A' ' 72' ' ' LEU . 20.3 mt -63.55 -48.92 84.72 Favored 'Isoleucine or valine' 0 C--N 1.358 0.947 0 N-CA-C 108.162 -1.051 . . . . 74.02 108.162 176.541 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 69' ' ' LYS . . . . . 0.554 ' HB2' ' HE2' ' A' ' 106' ' ' TYR . 46.6 tptt -53.74 -47.71 70.36 Favored 'General case' 0 N--CA 1.481 1.079 0 C-N-CA 124.239 1.016 . . . . 71.45 110.879 176.76 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 62.4 tt0 -60.99 -46.04 92.37 Favored 'General case' 0 CA--C 1.535 0.39 0 O-C-N 124.094 0.871 . . . . 73.12 110.97 -177.638 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 71' ' ' THR . . . . . 0.567 ' HB ' ' HA ' ' A' ' 15' ' ' ALA . 13.1 t -79.16 -21.29 46.66 Favored 'General case' 0 C--N 1.352 0.683 0 CA-C-O 118.904 -0.57 . . . . 62.13 111.45 -176.017 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 72' ' ' LEU . . . . . 0.528 ' HG ' ' O ' ' A' ' 68' ' ' ILE . 25.2 mt -75.98 -31.72 59.13 Favored 'General case' 0 N--CA 1.486 1.354 0 N-CA-C 109.802 -0.444 . . . . 64.25 109.802 173.385 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 97.8 m-20 -70.33 -51.12 32.44 Favored 'General case' 0 N--CA 1.469 0.491 0 O-C-N 123.744 0.652 . . . . 73.42 109.842 174.723 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 67.4 m-20 -57.35 -42.96 83.0 Favored 'General case' 0 N--CA 1.479 0.997 0 O-C-N 123.96 0.788 . . . . 73.33 109.912 178.314 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 53.5 tp10 -58.54 -56.37 23.03 Favored 'General case' 0 N--CA 1.473 0.68 0 C-N-CA 124.494 1.117 . . . . 53.23 110.712 177.202 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 10.1 tt0 -65.67 -39.05 90.91 Favored 'General case' 0 N--CA 1.477 0.897 0 C-N-CA 122.724 0.41 . . . . 72.51 111.786 -174.441 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 92.9 mt -64.58 -47.74 77.55 Favored 'General case' 0 N--CA 1.478 0.934 0 C-N-CA 123.349 0.66 . . . . 75.22 110.524 179.881 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 78' ' ' LEU . . . . . 0.741 HD21 ' HA ' ' A' ' 22' ' ' LEU . 42.5 mt -61.01 -61.86 2.27 Favored 'General case' 0 N--CA 1.482 1.128 0 C-N-CA 123.968 0.907 . . . . 73.21 111.985 178.68 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 43.9 mmtm -67.17 -38.04 84.75 Favored 'General case' 0 CA--C 1.543 0.679 0 CA-C-N 113.872 -1.513 . . . . 74.4 110.356 -171.563 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -68.94 -29.69 72.44 Favored Glycine 0 C--N 1.343 0.939 0 CA-C-N 115.822 -0.626 . . . . 60.45 113.037 175.957 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 8.5 tt -63.14 -44.79 94.56 Favored 'General case' 0 N--CA 1.475 0.81 0 N-CA-C 109.044 -0.725 . . . . 63.3 109.044 171.016 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 82' ' ' LEU . . . . . 0.437 ' HG ' ' O ' ' A' ' 78' ' ' LEU . 67.4 mt . . . . . 0 N--CA 1.477 0.875 0 O-C-N 123.663 0.602 . . . . 72.1 110.497 -178.411 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 92' ' ' LEU . . . . . 0.484 HD22 ' HG2' ' A' ' 45' ' ' GLU . 40.5 mt . . . . . 0 N--CA 1.478 0.944 0 N-CA-C 109.598 -0.519 . . . . 71.33 109.598 . . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 93' ' ' ILE . . . . . 0.47 ' HB ' ' HA ' ' A' ' 97' ' ' THR . 35.2 mt -120.44 146.39 25.38 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.06 0 C-N-CA 124.093 0.957 . . . . 70.11 109.072 -177.755 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -64.46 126.7 33.46 Favored Glycine 0 C--N 1.344 0.988 0 O-C-N 123.316 0.385 . . . . 23.33 112.585 177.09 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 87.7 mt-30 66.18 -85.76 0.03 OUTLIER 'General case' 0 N--CA 1.477 0.905 0 C-N-CA 125.038 1.335 . . . . 71.44 111.584 179.247 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 22.7 m -92.39 102.94 15.42 Favored 'General case' 0 N--CA 1.467 0.384 0 C-N-CA 123.547 0.739 . . . . 61.02 109.624 -177.908 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 97' ' ' THR . . . . . 0.624 HG22 ' H ' ' A' ' 99' ' ' GLN . 97.1 m -93.16 155.64 17.34 Favored 'General case' 0 CA--C 1.55 0.949 0 C-N-CA 123.869 0.868 . . . . 75.13 109.916 173.036 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 30.7 mmt180 -58.16 -13.26 4.56 Favored 'General case' 0 CA--C 1.556 1.181 0 C-N-CA 125.291 1.436 . . . . 72.21 113.016 175.554 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 99' ' ' GLN . . . . . 0.624 ' H ' HG22 ' A' ' 97' ' ' THR . 12.5 pt20 -57.89 -29.8 65.34 Favored 'General case' 0 N--CA 1.491 1.601 0 C-N-CA 124.34 1.056 . . . . 71.15 112.069 176.444 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 27.5 ttpp -68.3 -46.47 70.21 Favored 'General case' 0 N--CA 1.478 0.944 0 N-CA-C 109.061 -0.718 . . . . 71.53 109.061 173.65 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 101' ' ' SER . . . . . 0.406 ' HA ' ' HB3' ' A' ' 104' ' ' ASN . 48.7 m -72.1 -12.68 61.31 Favored 'General case' 0 N--CA 1.479 1.011 0 C-N-CA 124.307 1.043 . . . . 70.3 111.941 174.897 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 102' ' ' LEU . . . . . 0.565 HD13 ' SD ' ' A' ' 48' ' ' MET . 24.7 tp -76.49 -48.26 20.11 Favored 'General case' 0 N--CA 1.483 1.188 0 C-N-CA 124.751 1.22 . . . . 52.34 109.19 177.098 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 9.2 t30 -65.53 -37.87 87.99 Favored 'General case' 0 CA--C 1.553 1.087 0 CA-C-N 114.672 -1.149 . . . . 72.25 110.536 173.433 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 104' ' ' ASN . . . . . 0.406 ' HB3' ' HA ' ' A' ' 101' ' ' SER . 24.5 t-20 -70.03 -32.54 70.74 Favored 'General case' 0 N--CA 1.478 0.947 0 CA-C-N 115.611 -0.722 . . . . 63.41 110.936 175.952 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -63.69 -40.23 96.29 Favored 'General case' 0 N--CA 1.48 1.072 0 C-N-CA 123.572 0.749 . . . . 71.42 110.165 175.853 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 106' ' ' TYR . . . . . 0.554 ' HE2' ' HB2' ' A' ' 69' ' ' LYS . 2.9 t80 -57.34 -51.97 67.24 Favored 'General case' 0 C--N 1.353 0.758 0 O-C-N 124.274 0.983 . . . . 64.34 109.443 172.016 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -53.19 -55.01 26.4 Favored Glycine 0 C--N 1.353 1.49 0 O-C-N 124.133 0.896 . . . . 42.51 114.204 -177.179 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 108' ' ' ARG . . . . . 0.638 ' HG3' ' HA ' ' A' ' 114' ' ' LEU . 17.2 ptp180 -66.6 -31.43 72.12 Favored 'General case' 0 CA--C 1.548 0.897 0 C-N-CA 123.295 0.638 . . . . 74.4 111.905 178.983 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 109' ' ' LEU . . . . . 0.543 ' HA ' ' H ' ' A' ' 114' ' ' LEU . 56.4 tp -68.05 -45.81 72.87 Favored 'General case' 0 N--CA 1.484 1.247 0 C-N-CA 122.645 0.378 . . . . 74.33 111.096 176.505 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 11.6 t -72.23 -29.54 64.04 Favored 'General case' 0 CA--C 1.54 0.595 0 CA-C-N 115.344 -0.843 . . . . 42.13 109.84 -174.659 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . -88.03 -62.96 1.4 Allowed Glycine 0 C--N 1.36 1.905 0 CA-C-O 119.364 -0.687 . . . . 72.42 113.844 -179.928 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 112' ' ' MET . . . . . . . . . . . . . 1.0 OUTLIER -98.99 -69.92 0.75 Allowed 'General case' 0 N--CA 1.485 1.31 0 CA-C-N 118.622 1.211 . . . . 71.52 112.065 177.576 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 113' ' ' LEU . . . . . 0.455 HD21 ' HB ' ' A' ' 56' ' ' ILE . 0.9 OUTLIER 163.29 51.2 0.0 OUTLIER 'General case' 0 N--CA 1.497 1.899 0 C-N-CA 125.746 1.618 . . . . 42.24 108.228 -174.322 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 114' ' ' LEU . . . . . 0.638 ' HA ' ' HG3' ' A' ' 108' ' ' ARG . 0.3 OUTLIER . . . . . 0 N--CA 1.487 1.414 0 C-N-CA 125.574 1.55 . . . . 73.13 112.934 171.221 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 23.5 ttt . . . . . 0 N--CA 1.488 1.439 0 CA-C-O 119.475 -0.298 . . . . 73.25 111.326 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 27.2 p -47.13 -39.02 12.61 Favored 'General case' 0 N--CA 1.497 1.885 0 N-CA-C 113.634 0.975 . . . . 72.24 113.634 -174.25 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 16.6 m -65.19 -45.35 85.16 Favored 'General case' 0 N--CA 1.478 0.932 0 C-N-CA 123.249 0.62 . . . . 73.11 111.464 178.384 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 4' ' ' THR . . . . . 0.53 ' HA ' ' HG3' ' A' ' 53' ' ' PRO . 5.2 m -70.96 -37.21 72.78 Favored 'General case' 0 N--CA 1.476 0.863 0 C-N-CA 123.351 0.66 . . . . 65.32 111.822 179.947 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 69.9 t -62.1 -47.58 92.48 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.84 0 C-N-CA 123.258 0.623 . . . . 74.31 109.758 178.529 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 44.9 mm-40 -57.27 -51.72 68.21 Favored 'General case' 0 N--CA 1.473 0.718 0 CA-C-N 115.778 -0.646 . . . . 53.51 110.927 172.205 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 40.7 t80 -57.32 -50.3 73.36 Favored 'General case' 0 CA--C 1.552 1.024 0 C-N-CA 124.197 0.999 . . . . 72.52 111.849 -173.853 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 8' ' ' ILE . . . . . 0.432 HD11 HG23 ' A' ' 60' ' ' ILE . 83.6 mt -62.38 -46.25 96.87 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.065 0 C-N-CA 123.977 0.911 . . . . 71.35 110.237 177.337 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 25.1 t-20 -67.09 -27.69 67.57 Favored 'General case' 0 N--CA 1.486 1.351 0 C-N-CA 123.781 0.833 . . . . 73.12 112.032 -176.441 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 10' ' ' ARG . . . . . 0.465 ' O ' HG13 ' A' ' 14' ' ' ILE . 96.5 mtt180 -76.23 -38.41 56.39 Favored 'General case' 0 N--CA 1.469 0.484 0 N-CA-C 109.041 -0.726 . . . . 64.32 109.041 175.325 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 11' ' ' TRP . . . . . 0.514 ' HH2' ' HG ' ' A' ' 102' ' ' LEU . 57.0 m95 -67.42 -29.65 69.19 Favored 'General case' 0 N--CA 1.484 1.274 0 C-N-CA 123.055 0.542 . . . . 75.12 111.696 172.152 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 12' ' ' GLN . . . . . 0.413 ' HG3' ' O ' ' A' ' 8' ' ' ILE . 52.7 mt-30 -64.08 -49.45 72.2 Favored 'General case' 0 N--CA 1.472 0.65 0 N-CA-C 107.671 -1.233 . . . . 44.25 107.671 171.773 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 53.5 ttt180 -60.85 -43.25 98.59 Favored 'General case' 0 CA--C 1.548 0.898 0 CA-C-N 114.996 -1.002 . . . . 74.01 111.382 -176.303 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 14' ' ' ILE . . . . . 0.465 HG13 ' O ' ' A' ' 10' ' ' ARG . 64.2 mt -66.52 -47.41 83.74 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.388 0 C-N-CA 122.731 0.412 . . . . 62.13 109.899 178.782 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 15' ' ' ALA . . . . . 0.572 ' HA ' ' HB ' ' A' ' 71' ' ' THR . . . -58.63 -43.71 89.8 Favored 'General case' 0 N--CA 1.486 1.343 0 C-N-CA 123.888 0.875 . . . . 60.54 111.824 -179.53 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 96.4 mt -81.83 -34.55 30.13 Favored 'General case' 0 N--CA 1.483 1.176 0 CA-C-N 114.613 -1.176 . . . . 55.42 111.112 -173.591 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.475 ' O ' ' HG ' ' A' ' 21' ' ' LEU . 25.3 mt -65.18 -51.76 59.06 Favored 'General case' 0 N--CA 1.486 1.352 0 N-CA-C 109.589 -0.523 . . . . 75.23 109.589 176.0 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 80.9 p -63.6 -37.32 86.9 Favored 'General case' 0 N--CA 1.48 1.028 0 C-N-CA 123.389 0.675 . . . . 70.33 111.557 -179.484 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 6.4 tp-100 -58.58 -50.14 74.91 Favored 'General case' 0 N--CA 1.476 0.866 0 O-C-N 123.613 0.57 . . . . 75.42 110.582 173.685 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 70.9 m -58.0 -49.91 75.21 Favored 'General case' 0 C--O 1.207 -1.161 0 CA-C-N 115.167 -0.924 . . . . 63.33 110.18 176.923 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 21' ' ' LEU . . . . . 0.595 HD22 ' HA ' ' A' ' 33' ' ' LEU . 92.4 mt -63.21 -29.88 71.14 Favored 'General case' 0 N--CA 1.474 0.772 0 C-N-CA 123.783 0.833 . . . . 73.05 111.393 -175.627 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 22' ' ' LEU . . . . . 0.575 ' HA ' HD21 ' A' ' 78' ' ' LEU . 58.9 tp -68.56 -53.95 19.69 Favored 'General case' 0 C--O 1.252 1.19 0 C-N-CA 123.063 0.545 . . . . 62.03 110.221 176.903 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 23' ' ' GLU . . . . . 0.585 ' HB3' ' HE ' ' A' ' 27' ' ' ARG . 46.1 mt-10 -55.37 -51.2 67.58 Favored 'General case' 0 N--CA 1.475 0.798 0 CA-C-N 114.775 -1.102 . . . . 75.33 110.024 177.749 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 24' ' ' LEU . . . . . 0.425 HD22 HD12 ' A' ' 32' ' ' LEU . 95.4 mt -60.6 -39.73 89.21 Favored 'General case' 0 N--CA 1.476 0.873 0 C-N-CA 125.382 1.473 . . . . 72.1 111.589 -176.683 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 25' ' ' ALA . . . . . 0.58 ' HB2' HD21 ' A' ' 33' ' ' LEU . . . -59.76 -48.87 79.95 Favored 'General case' 0 N--CA 1.481 1.106 0 C-N-CA 123.097 0.559 . . . . 43.54 110.823 176.168 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 95.6 mt-30 -66.63 -30.38 70.64 Favored 'General case' 0 CA--C 1.552 1.049 0 CA-C-N 114.901 -1.045 . . . . 65.4 111.633 178.919 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 27' ' ' ARG . . . . . 0.585 ' HE ' ' HB3' ' A' ' 23' ' ' GLU . 44.5 mtt-85 -76.28 -25.45 54.92 Favored 'General case' 0 N--CA 1.488 1.448 0 C-N-CA 123.473 0.709 . . . . 74.22 110.846 176.856 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 98.18 9.54 53.49 Favored Glycine 0 C--N 1.348 1.221 0 CA-C-N 116.364 -0.38 . . . . 54.42 113.244 -177.825 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 29' ' ' GLU . . . . . 0.415 ' HB2' ' HB3' ' A' ' 24' ' ' LEU . 12.8 mm-40 -80.13 57.41 2.69 Favored 'General case' 0 CA--C 1.55 0.976 0 C-N-CA 124.508 1.123 . . . . 72.42 110.482 174.985 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 30' ' ' TRP . . . . . 0.447 ' O ' ' HG ' ' A' ' 34' ' ' LEU . 89.2 m95 -62.0 -35.29 78.08 Favored 'General case' 0 N--CA 1.482 1.169 0 C-N-CA 124.218 1.007 . . . . 73.25 111.51 -175.892 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 6.2 m-20 -54.23 -40.01 67.28 Favored 'General case' 0 N--CA 1.476 0.871 0 C-N-CA 124.766 1.226 . . . . 71.43 111.51 179.619 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 0.425 HD12 HD22 ' A' ' 24' ' ' LEU . 87.9 mt -69.1 -31.23 69.8 Favored 'General case' 0 CA--C 1.543 0.685 0 CA-C-N 115.096 -0.956 . . . . 51.34 110.981 179.112 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 33' ' ' LEU . . . . . 0.595 ' HA ' HD22 ' A' ' 21' ' ' LEU . 8.5 mp -70.48 -40.3 73.72 Favored 'General case' 0 N--CA 1.491 1.604 0 C-N-CA 122.252 0.221 . . . . 64.53 110.57 173.051 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.447 ' HG ' ' O ' ' A' ' 30' ' ' TRP . 82.6 mt -65.1 -40.65 94.87 Favored 'General case' 0 N--CA 1.479 0.986 0 C-N-CA 123.648 0.779 . . . . 52.4 111.364 -176.916 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 1.6 mp0 -80.32 -55.76 4.67 Favored 'General case' 0 N--CA 1.473 0.72 0 C-N-CA 123.429 0.692 . . . . 70.31 111.197 178.541 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 36' ' ' GLN . . . . . 0.435 ' HB2' HD21 ' A' ' 21' ' ' LEU . 84.1 mm-40 -64.44 -13.08 49.55 Favored 'General case' 0 N--CA 1.494 1.768 0 N-CA-C 113.088 0.773 . . . . 71.54 113.088 -178.935 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 37' ' ' GLU . . . . . 0.471 ' O ' ' HG ' ' A' ' 41' ' ' LEU . 43.4 tt0 -47.55 -49.43 26.42 Favored 'General case' 0 N--CA 1.478 0.952 0 C-N-CA 122.914 0.486 . . . . 73.02 110.454 169.296 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 40.9 t -57.1 -53.75 39.18 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.088 0 O-C-N 124.061 0.851 . . . . 74.44 111.897 -176.906 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 46.4 p -69.09 -34.17 74.67 Favored 'General case' 0 N--CA 1.483 1.179 0 C-N-CA 122.801 0.44 . . . . 71.34 111.926 -177.399 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 40.9 t80 -64.9 -42.88 94.4 Favored 'General case' 0 N--CA 1.475 0.815 0 C-N-CA 123.513 0.725 . . . . 73.34 110.064 176.836 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 41' ' ' LEU . . . . . 0.471 ' HG ' ' O ' ' A' ' 37' ' ' GLU . 96.6 mt -60.81 -44.35 96.97 Favored 'General case' 0 C--N 1.35 0.627 0 O-C-N 124.192 0.932 . . . . 64.51 109.856 175.117 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 47.6 tt0 -63.86 -42.6 97.5 Favored 'General case' 0 N--CA 1.473 0.724 0 O-C-N 123.269 0.356 . . . . 74.02 110.761 -179.246 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 30.9 m -59.82 -53.76 54.2 Favored 'General case' 0 N--CA 1.482 1.156 0 C-N-CA 123.157 0.583 . . . . 61.45 111.355 -179.047 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 11.5 tt -66.1 -33.99 67.27 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.054 0 CA-C-N 115.072 -0.967 . . . . 63.44 111.054 -176.706 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 10.1 mm-40 -64.15 -44.93 90.64 Favored 'General case' 0 N--CA 1.484 1.251 0 C-N-CA 123.119 0.568 . . . . 73.13 111.307 172.774 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 46' ' ' THR . . . . . 0.422 ' O ' ' HB2' ' A' ' 50' ' ' LYS . 67.7 m -62.8 -34.06 76.49 Favored 'General case' 0 N--CA 1.478 0.932 0 C-N-CA 122.65 0.38 . . . . 75.42 110.969 -177.882 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 47' ' ' VAL . . . . . . . . . . . . . 58.3 t -71.46 -51.82 30.68 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.021 0 N-CA-C 111.615 0.228 . . . . 64.24 111.615 175.518 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 48' ' ' MET . . . . . . . . . . . . . 75.6 mtm -67.85 -32.84 73.64 Favored 'General case' 0 N--CA 1.488 1.473 0 N-CA-C 112.899 0.703 . . . . 72.42 112.899 -172.777 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 49.6 mt-10 -84.02 -34.42 24.29 Favored 'General case' 0 N--CA 1.483 1.198 0 C-N-CA 123.371 0.668 . . . . 64.51 111.626 -178.632 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 50' ' ' LYS . . . . . 0.422 ' HB2' ' O ' ' A' ' 46' ' ' THR . 13.8 mptt -79.86 164.08 23.86 Favored 'General case' 0 N--CA 1.483 1.186 0 CA-C-O 121.181 0.515 . . . . 75.25 110.699 -179.677 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 8.9 tt0 -82.83 138.39 33.97 Favored 'General case' 0 C--O 1.241 0.61 0 CA-C-N 115.046 -0.979 . . . . 42.32 110.65 -172.361 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 52' ' ' THR . . . . . 0.693 HG21 ' HB3' ' A' ' 114' ' ' LEU . 39.1 m -72.29 123.59 89.69 Favored Pre-proline 0 CA--C 1.556 1.187 0 N-CA-C 109.178 -0.675 . . . . 61.12 109.178 171.914 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 53' ' ' PRO . . . . . 0.53 ' HG3' ' HA ' ' A' ' 4' ' ' THR . 61.7 Cg_endo -69.3 155.46 67.39 Favored 'Trans proline' 0 C--N 1.376 2.01 0 C-N-CA 123.162 2.575 . . . . 74.53 112.675 -176.664 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 43.9 Cg_endo -67.98 -47.29 1.86 Allowed 'Trans proline' 0 C--N 1.377 2.063 0 C-N-CA 122.367 2.045 . . . . 72.4 112.258 175.004 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . -69.97 80.1 0.36 Allowed Glycine 0 C--N 1.352 1.46 0 O-C-N 123.566 0.541 . . . . 60.41 113.656 -175.796 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 77.7 mt -125.86 98.4 4.96 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.526 0 N-CA-C 107.91 -1.144 . . . . 65.04 107.91 175.085 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 57' ' ' THR . . . . . 0.401 ' H ' HD12 ' A' ' 60' ' ' ILE . 78.5 p -74.45 -179.65 4.12 Favored 'General case' 0 N--CA 1.473 0.712 0 C-N-CA 122.867 0.467 . . . . 72.4 109.917 175.373 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 21.1 tpt180 -64.99 -40.03 94.35 Favored 'General case' 0 N--CA 1.476 0.828 0 N-CA-C 110.371 -0.233 . . . . 64.14 110.371 177.79 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 51.9 m -60.25 -45.24 93.94 Favored 'General case' 0 N--CA 1.478 0.953 0 C-N-CA 123.309 0.644 . . . . 62.1 111.4 177.005 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 60' ' ' ILE . . . . . 0.432 HG23 HD11 ' A' ' 8' ' ' ILE . 80.1 mt -64.8 -39.13 84.61 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.971 0 CA-C-N 115.479 -0.782 . . . . 61.44 110.377 177.272 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 63.2 tt0 -63.18 -41.95 99.28 Favored 'General case' 0 N--CA 1.482 1.143 0 C-N-CA 124.012 0.925 . . . . 73.11 111.131 179.525 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 52.3 m-20 -69.4 -41.54 76.28 Favored 'General case' 0 N--CA 1.477 0.91 0 C-N-CA 123.163 0.585 . . . . 73.42 111.503 179.78 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 63' ' ' MET . . . . . . . . . . . . . 64.9 mtm -65.88 -52.3 51.41 Favored 'General case' 0 N--CA 1.485 1.295 0 C-N-CA 122.351 0.26 . . . . 73.54 111.311 178.477 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 64' ' ' VAL . . . . . 0.533 ' O ' HG13 ' A' ' 68' ' ' ILE . 71.4 t -60.99 -55.84 21.99 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.998 0 C-N-CA 123.456 0.702 . . . . 70.53 110.563 -178.957 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 65' ' ' ALA . . . . . 0.555 ' HB2' HD23 ' A' ' 109' ' ' LEU . . . -61.33 -37.8 84.61 Favored 'General case' 0 N--CA 1.488 1.455 0 O-C-N 123.478 0.486 . . . . 54.5 111.406 179.715 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -60.98 -37.17 93.41 Favored Glycine 0 C--N 1.346 1.109 0 CA-C-N 116.413 -0.358 . . . . 74.13 112.383 176.521 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 19.3 m-30 -75.86 -34.23 60.04 Favored 'General case' 0 N--CA 1.476 0.846 0 C-N-CA 123.137 0.575 . . . . 72.43 111.622 177.018 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 68' ' ' ILE . . . . . 0.533 HG13 ' O ' ' A' ' 64' ' ' VAL . 61.5 mt -59.69 -53.57 46.48 Favored 'Isoleucine or valine' 0 C--N 1.357 0.923 0 N-CA-C 108.808 -0.812 . . . . 63.51 108.808 175.812 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 69' ' ' LYS . . . . . 0.535 ' HB2' ' HE2' ' A' ' 106' ' ' TYR . 0.6 OUTLIER -59.77 -46.28 89.67 Favored 'General case' 0 C--N 1.348 0.507 0 CA-C-N 115.359 -0.837 . . . . 74.23 110.274 179.919 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 63.3 tt0 -57.08 -45.86 82.98 Favored 'General case' 0 C--N 1.352 0.675 0 O-C-N 124.564 1.165 . . . . 65.12 111.398 -178.589 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 71' ' ' THR . . . . . 0.572 ' HB ' ' HA ' ' A' ' 15' ' ' ALA . 15.1 t -79.66 -21.94 44.13 Favored 'General case' 0 C--O 1.216 -0.684 0 CA-C-O 119.188 -0.434 . . . . 71.44 110.559 -174.657 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 72' ' ' LEU . . . . . 0.524 ' HG ' ' O ' ' A' ' 68' ' ' ILE . 44.0 mt -74.62 -31.84 62.12 Favored 'General case' 0 N--CA 1.483 1.207 0 O-C-N 123.321 0.388 . . . . 72.21 110.521 172.122 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 73' ' ' ASP . . . . . 0.429 ' O ' ' HG ' ' A' ' 77' ' ' LEU . 48.5 m-20 -64.1 -60.17 3.55 Favored 'General case' 0 C--N 1.351 0.654 0 N-CA-C 108.627 -0.879 . . . . 74.35 108.627 172.702 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 48.4 m-20 -55.48 -41.35 72.86 Favored 'General case' 0 N--CA 1.483 1.21 0 C-N-CA 124.354 1.062 . . . . 74.5 111.335 -178.309 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 75' ' ' GLU . . . . . 0.543 ' O ' ' HG2' ' A' ' 79' ' ' LYS . 5.3 tp10 -58.88 -59.03 6.1 Favored 'General case' 0 N--CA 1.476 0.851 0 C-N-CA 124.348 1.059 . . . . 71.3 109.879 178.447 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 9.4 tt0 -72.45 -26.1 61.7 Favored 'General case' 0 CA--C 1.548 0.891 0 O-C-N 124.128 0.892 . . . . 75.21 111.851 -171.999 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 77' ' ' LEU . . . . . 0.429 ' HG ' ' O ' ' A' ' 73' ' ' ASP . 97.4 mt -67.61 -43.25 80.9 Favored 'General case' 0 N--CA 1.481 1.08 0 N-CA-C 109.246 -0.65 . . . . 72.03 109.246 174.165 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 78' ' ' LEU . . . . . 0.575 HD21 ' HA ' ' A' ' 22' ' ' LEU . 28.9 mt -57.3 -46.05 83.54 Favored 'General case' 0 N--CA 1.48 1.032 0 O-C-N 123.726 0.641 . . . . 74.21 111.196 169.55 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 79' ' ' LYS . . . . . 0.543 ' HG2' ' O ' ' A' ' 75' ' ' GLU . 36.2 mmtm -64.67 -38.13 89.93 Favored 'General case' 0 N--CA 1.478 0.955 0 C-N-CA 123.408 0.683 . . . . 61.31 112.316 -175.764 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -71.25 -30.6 67.05 Favored Glycine 0 C--N 1.342 0.906 0 CA-C-N 115.936 -0.574 . . . . 63.31 112.002 174.534 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 4.8 tt -68.8 -43.83 74.8 Favored 'General case' 0 CA--C 1.557 1.225 0 C-N-CA 123.488 0.715 . . . . 70.41 109.728 173.302 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 82' ' ' LEU . . . . . 0.415 ' HG ' ' O ' ' A' ' 78' ' ' LEU . 57.7 mt . . . . . 0 N--CA 1.478 0.947 0 C-N-CA 123.413 0.685 . . . . 74.24 110.201 -170.652 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 64.4 mt . . . . . 0 N--CA 1.481 1.121 0 CA-C-O 119.696 -0.193 . . . . 73.25 110.93 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 76.4 mt -41.31 -41.05 0.68 Allowed 'Isoleucine or valine' 0 N--CA 1.488 1.467 0 C-N-CA 125.224 1.41 . . . . 72.23 111.018 167.967 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -163.31 -151.67 6.53 Favored Glycine 0 C--O 1.242 0.641 0 N-CA-C 110.497 -1.041 . . . . 64.5 110.497 169.049 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 3.9 pt20 -73.92 167.32 21.71 Favored 'General case' 0 CA--C 1.547 0.828 0 N-CA-C 109.128 -0.693 . . . . 73.15 109.128 168.825 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 78.1 p 49.98 -88.21 0.01 OUTLIER 'General case' 0 CA--C 1.555 1.142 0 C-N-CA 125.051 1.34 . . . . 73.03 111.842 -170.469 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 28.2 m 55.64 -78.38 0.01 OUTLIER 'General case' 0 CA--C 1.559 1.303 0 C-N-CA 125.379 1.472 . . . . 73.45 113.27 176.652 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 4.9 ptm180 -45.98 -48.63 16.48 Favored 'General case' 0 N--CA 1.485 1.293 0 C-N-CA 125.699 1.599 . . . . 71.32 114.665 -169.274 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 60.2 tp60 -67.99 -52.02 40.58 Favored 'General case' 0 N--CA 1.471 0.602 0 N-CA-C 109.842 -0.429 . . . . 64.52 109.842 -176.976 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 87.3 tttt -60.68 -45.41 94.28 Favored 'General case' 0 N--CA 1.475 0.791 0 CA-C-N 115.797 -0.638 . . . . 74.34 111.3 -179.231 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 23.0 t -73.63 -46.83 44.5 Favored 'General case' 0 N--CA 1.468 0.432 0 C-N-CA 124.058 0.943 . . . . 73.04 110.983 -168.835 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 102' ' ' LEU . . . . . 0.514 ' HG ' ' HH2' ' A' ' 11' ' ' TRP . 9.4 mp -78.29 -35.51 47.86 Favored 'General case' 0 N--CA 1.473 0.718 0 O-C-N 123.347 0.404 . . . . 63.35 111.427 -176.538 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 60.6 t30 -70.85 -35.73 72.54 Favored 'General case' 0 N--CA 1.488 1.466 0 N-CA-C 109.732 -0.47 . . . . 72.14 109.732 177.874 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 104' ' ' ASN . . . . . 0.441 ' O ' ' HG2' ' A' ' 108' ' ' ARG . 24.4 t-20 -67.0 -43.68 82.29 Favored 'General case' 0 N--CA 1.479 0.998 0 N-CA-C 109.423 -0.584 . . . . 74.43 109.423 172.57 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -60.49 -34.88 74.69 Favored 'General case' 0 N--CA 1.484 1.236 0 C-N-CA 123.407 0.683 . . . . 73.3 111.698 178.703 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 106' ' ' TYR . . . . . 0.535 ' HE2' ' HB2' ' A' ' 69' ' ' LYS . 13.6 t80 -65.56 -52.89 48.97 Favored 'General case' 0 CA--C 1.539 0.536 0 N-CA-C 109.03 -0.729 . . . . 73.41 109.03 175.699 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -62.3 -35.69 91.99 Favored Glycine 0 C--N 1.353 1.508 0 O-C-N 124.095 0.872 . . . . 73.03 112.673 -177.78 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 108' ' ' ARG . . . . . 0.441 ' HG2' ' O ' ' A' ' 104' ' ' ASN . 21.4 mmt180 -75.21 -34.59 61.5 Favored 'General case' 0 N--CA 1.468 0.446 0 C-N-CA 122.879 0.471 . . . . 72.44 110.544 179.16 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 109' ' ' LEU . . . . . 0.555 HD23 ' HB2' ' A' ' 65' ' ' ALA . 41.9 tp -67.13 -41.71 85.67 Favored 'General case' 0 N--CA 1.487 1.412 0 CA-C-O 121.311 0.577 . . . . 70.34 109.857 177.447 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 33.2 t -68.12 -38.76 82.58 Favored 'General case' 0 CA--C 1.545 0.774 0 CA-C-N 114.17 -1.377 . . . . 75.11 109.81 -179.775 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . -89.8 -64.8 1.25 Allowed Glycine 0 C--N 1.355 1.608 0 C-N-CA 121.153 -0.546 . . . . 73.33 113.674 -178.165 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 112' ' ' MET . . . . . 0.578 ' SD ' ' HB2' ' A' ' 113' ' ' LEU . 0.2 OUTLIER -93.8 -71.43 0.66 Allowed 'General case' 0 N--CA 1.481 1.093 0 CA-C-N 117.853 0.826 . . . . 73.12 111.389 -175.793 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 113' ' ' LEU . . . . . 0.578 ' HB2' ' SD ' ' A' ' 112' ' ' MET . 6.1 mt 170.12 35.57 0.0 OUTLIER 'General case' 0 N--CA 1.507 2.409 0 C-N-CA 125.649 1.579 . . . . 63.21 110.342 -178.47 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 114' ' ' LEU . . . . . 0.693 ' HB3' HG21 ' A' ' 52' ' ' THR . 1.9 tt . . . . . 0 N--CA 1.506 2.357 0 C-N-CA 127.03 2.132 . . . . 75.3 111.722 176.843 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 25.2 ttt . . . . . 0 N--CA 1.487 1.375 0 CA-C-O 119.672 -0.204 . . . . 72.43 110.856 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 2' ' ' THR . . . . . 0.421 ' O ' ' HG2' ' A' ' 6' ' ' GLU . 41.6 m -49.47 -49.4 45.61 Favored 'General case' 0 N--CA 1.487 1.398 0 C-N-CA 123.65 0.78 . . . . 73.1 112.798 -173.547 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 68.8 p -60.72 -41.16 94.73 Favored 'General case' 0 N--CA 1.482 1.173 0 C-N-CA 123.609 0.764 . . . . 71.42 112.033 -178.392 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 30.4 m -69.1 -40.69 78.23 Favored 'General case' 0 N--CA 1.48 1.045 0 C-N-CA 123.261 0.625 . . . . 72.44 111.347 179.748 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 99.4 t -65.04 -46.08 92.5 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.922 0 C-N-CA 123.029 0.532 . . . . 73.13 109.885 178.942 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 6' ' ' GLU . . . . . 0.421 ' HG2' ' O ' ' A' ' 2' ' ' THR . 63.0 mm-40 -59.02 -44.69 91.75 Favored 'General case' 0 N--CA 1.476 0.844 0 C-N-CA 123.367 0.667 . . . . 64.44 110.328 174.854 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 39.2 t80 -57.49 -55.62 32.4 Favored 'General case' 0 N--CA 1.479 0.979 0 C-N-CA 124.451 1.1 . . . . 70.52 110.542 -176.036 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 45.3 mt -66.18 -37.36 79.57 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.986 0 C-N-CA 123.518 0.727 . . . . 64.54 110.322 -178.452 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 2.7 t-20 -72.28 -26.7 62.08 Favored 'General case' 0 N--CA 1.488 1.469 0 C-N-CA 123.298 0.639 . . . . 62.15 111.147 -177.442 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 10' ' ' ARG . . . . . 0.667 ' HB3' HG22 ' A' ' 47' ' ' VAL . 82.0 mtt180 -78.03 -35.47 49.77 Favored 'General case' 0 CA--C 1.536 0.421 0 C-N-CA 123.437 0.695 . . . . 74.4 109.648 174.688 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 11' ' ' TRP . . . . . 0.419 ' CZ3' HG12 ' A' ' 68' ' ' ILE . 73.4 m95 -67.67 -34.16 76.37 Favored 'General case' 0 N--CA 1.479 1.02 0 O-C-N 123.096 0.248 . . . . 74.45 110.381 172.028 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 54.4 mt-30 -60.0 -48.42 81.8 Favored 'General case' 0 C--N 1.359 0.993 0 N-CA-C 108.248 -1.019 . . . . 75.54 108.248 171.1 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 32.2 tpt180 -58.8 -46.81 86.75 Favored 'General case' 0 CA--C 1.552 1.045 0 CA-C-N 115.158 -0.928 . . . . 75.2 111.503 -175.754 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 14' ' ' ILE . . . . . 0.713 HD11 HG21 ' A' ' 47' ' ' VAL . 31.7 mt -67.05 -45.36 87.06 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.439 0 C-N-CA 122.665 0.386 . . . . 75.31 110.163 -179.652 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 15' ' ' ALA . . . . . 0.419 ' HB1' ' OE1' ' A' ' 70' ' ' GLN . . . -62.15 -42.79 99.6 Favored 'General case' 0 N--CA 1.483 1.193 0 C-N-CA 124.339 1.055 . . . . 73.31 111.792 -177.894 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 95.2 mt -75.51 -39.35 58.59 Favored 'General case' 0 N--CA 1.484 1.249 0 CA-C-N 114.593 -1.185 . . . . 74.31 110.247 -175.694 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.533 ' O ' ' HG ' ' A' ' 21' ' ' LEU . 44.2 mt -63.9 -49.14 73.84 Favored 'General case' 0 C--O 1.211 -0.948 0 O-C-N 123.565 0.54 . . . . 74.51 109.99 176.48 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 83.3 p -65.42 -30.55 71.37 Favored 'General case' 0 N--CA 1.484 1.265 0 C-N-CA 122.821 0.448 . . . . 64.1 111.515 -179.54 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 19' ' ' GLN . . . . . 0.578 ' HA ' HD22 ' A' ' 74' ' ' ASN . 16.4 tp60 -63.42 -47.69 80.91 Favored 'General case' 0 N--CA 1.481 1.115 0 CA-C-O 121.546 0.688 . . . . 72.03 110.124 173.037 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 55.0 m -61.39 -48.12 82.68 Favored 'General case' 0 CA--C 1.538 0.502 0 CA-C-N 114.321 -1.309 . . . . 42.33 110.394 178.488 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 21' ' ' LEU . . . . . 0.533 ' HG ' ' O ' ' A' ' 17' ' ' LEU . 95.6 mt -60.46 -38.42 84.15 Favored 'General case' 0 N--CA 1.473 0.679 0 C-N-CA 124.218 1.007 . . . . 75.12 110.136 -178.117 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 22' ' ' LEU . . . . . 0.824 ' HA ' HD21 ' A' ' 78' ' ' LEU . 35.9 tp -61.09 -55.72 29.24 Favored 'General case' 0 C--O 1.253 1.276 0 C-N-CA 123.539 0.736 . . . . 71.1 110.733 178.812 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 23' ' ' GLU . . . . . 0.506 ' O ' ' HG3' ' A' ' 27' ' ' ARG . 56.0 mt-10 -59.19 -55.48 34.46 Favored 'General case' 0 CA--C 1.543 0.699 0 CA-C-N 114.917 -1.038 . . . . 71.32 111.678 -178.743 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 24' ' ' LEU . . . . . 0.482 HD22 HD12 ' A' ' 32' ' ' LEU . 78.5 mt -58.42 -38.68 77.9 Favored 'General case' 0 N--CA 1.478 0.973 0 C-N-CA 124.714 1.206 . . . . 74.0 111.776 -175.952 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 25' ' ' ALA . . . . . 0.514 ' HB2' HD21 ' A' ' 33' ' ' LEU . . . -62.13 -45.16 94.67 Favored 'General case' 0 N--CA 1.478 0.934 0 C-N-CA 123.247 0.619 . . . . 74.01 111.727 176.033 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 92.6 mt-30 -73.17 -14.82 61.43 Favored 'General case' 0 CA--C 1.557 1.217 0 CA-C-N 115.42 -0.809 . . . . 74.3 111.564 177.48 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 27' ' ' ARG . . . . . 0.506 ' HG3' ' O ' ' A' ' 23' ' ' GLU . 72.7 mtt-85 -87.84 -2.15 58.43 Favored 'General case' 0 N--CA 1.491 1.616 0 C-N-CA 123.58 0.752 . . . . 72.5 111.489 170.979 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 85.45 0.02 88.32 Favored Glycine 0 N--CA 1.48 1.591 0 N-CA-C 113.9 0.32 . . . . 53.13 113.9 -179.311 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 24.2 mm-40 -85.2 68.2 10.43 Favored 'General case' 0 N--CA 1.473 0.695 0 C-N-CA 124.696 1.199 . . . . 74.32 111.287 -176.692 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 30' ' ' TRP . . . . . 0.44 ' O ' ' HG ' ' A' ' 34' ' ' LEU . 69.2 m95 -67.84 -28.7 67.78 Favored 'General case' 0 N--CA 1.48 1.046 0 CA-C-N 115.712 -0.677 . . . . 75.31 110.386 178.292 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 10.4 m-20 -53.13 -46.67 68.88 Favored 'General case' 0 N--CA 1.479 1.017 0 C-N-CA 124.738 1.215 . . . . 72.33 111.576 176.022 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 0.482 HD12 HD22 ' A' ' 24' ' ' LEU . 70.7 mt -70.44 -26.53 63.7 Favored 'General case' 0 CA--C 1.544 0.749 0 CA-C-N 114.856 -1.065 . . . . 64.55 110.758 -175.82 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 33' ' ' LEU . . . . . 0.514 HD21 ' HB2' ' A' ' 25' ' ' ALA . 11.0 mp -70.04 -42.86 72.34 Favored 'General case' 0 N--CA 1.485 1.325 0 C-N-CA 122.937 0.495 . . . . 74.43 110.418 172.45 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.44 ' HG ' ' O ' ' A' ' 30' ' ' TRP . 77.0 mt -65.02 -33.97 77.32 Favored 'General case' 0 N--CA 1.484 1.263 0 C-N-CA 123.495 0.718 . . . . 73.01 111.292 -179.776 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 96.5 mt-30 -71.47 -52.16 19.93 Favored 'General case' 0 N--CA 1.477 0.915 0 C-N-CA 123.446 0.698 . . . . 73.4 110.658 176.716 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 84.8 mm-40 -74.5 -12.74 60.56 Favored 'General case' 0 N--CA 1.481 1.081 0 C-N-CA 123.743 0.817 . . . . 71.32 112.594 -177.571 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 37' ' ' GLU . . . . . 0.43 ' O ' ' HG ' ' A' ' 41' ' ' LEU . 38.4 tt0 -52.86 -53.84 43.08 Favored 'General case' 0 N--CA 1.48 1.051 0 C-N-CA 124.066 0.947 . . . . 75.23 111.577 178.456 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 83.8 t -60.42 -39.53 81.34 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.258 0 C-N-CA 123.241 0.616 . . . . 71.43 110.901 -178.239 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 36.4 m -63.72 -43.63 95.98 Favored 'General case' 0 CA--C 1.551 0.987 0 CA-C-N 115.458 -0.792 . . . . 72.55 111.03 177.246 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 59.5 t80 -65.04 -52.66 54.61 Favored 'General case' 0 N--CA 1.479 0.977 0 C-N-CA 124.778 1.231 . . . . 70.41 110.242 -175.888 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 41' ' ' LEU . . . . . 0.43 ' HG ' ' O ' ' A' ' 37' ' ' GLU . 69.6 mt -63.01 -44.74 95.13 Favored 'General case' 0 C--N 1.35 0.609 0 CA-C-N 114.729 -1.123 . . . . 63.31 110.95 -177.64 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 50.9 tt0 -61.04 -47.9 84.24 Favored 'General case' 0 N--CA 1.481 1.08 0 C-N-CA 122.797 0.439 . . . . 74.1 111.009 179.709 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 43' ' ' SER . . . . . 0.503 ' O ' HG23 ' A' ' 47' ' ' VAL . 63.2 m -57.76 -53.76 54.52 Favored 'General case' 0 N--CA 1.481 1.124 0 C-N-CA 123.381 0.672 . . . . 72.51 111.407 -178.968 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 20.8 tt -69.37 -28.67 39.23 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.864 0 CA-C-N 115.54 -0.754 . . . . 73.2 112.045 -174.037 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 14.0 mm-40 -62.52 -47.42 84.0 Favored 'General case' 0 N--CA 1.479 0.982 0 C-N-CA 122.709 0.404 . . . . 50.32 110.151 169.374 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 19.2 m -61.96 -27.67 69.01 Favored 'General case' 0 N--CA 1.481 1.082 0 O-C-N 123.906 0.754 . . . . 72.03 111.139 179.987 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 47' ' ' VAL . . . . . 0.713 HG21 HD11 ' A' ' 14' ' ' ILE . 21.1 t -75.4 -50.98 22.27 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.213 0 O-C-N 122.26 -0.275 . . . . 74.23 111.602 175.086 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 48' ' ' MET . . . . . . . . . . . . . 73.9 mtm -73.4 -20.87 60.64 Favored 'General case' 0 N--CA 1.492 1.648 0 N-CA-C 112.818 0.673 . . . . 52.14 112.818 -172.35 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 16.1 pt-20 -85.05 -11.51 55.16 Favored 'General case' 0 N--CA 1.48 1.045 0 C-N-CA 122.598 0.359 . . . . 74.21 111.134 175.047 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 11.9 mptt -94.62 155.88 16.68 Favored 'General case' 0 N--CA 1.485 1.294 0 C-N-CA 124.213 1.005 . . . . 54.0 110.852 -178.567 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 8.8 tt0 -87.07 142.23 28.08 Favored 'General case' 0 CA--C 1.545 0.773 0 CA-C-N 114.901 -1.045 . . . . 75.42 110.218 -179.396 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 95.7 m -68.74 131.59 91.17 Favored Pre-proline 0 CA--C 1.555 1.173 0 C-N-CA 123.868 0.867 . . . . 53.02 110.128 174.48 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 26.9 Cg_exo -66.79 151.91 81.52 Favored 'Trans proline' 0 C--N 1.381 2.285 0 C-N-CA 122.388 2.059 . . . . 72.13 112.475 172.891 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 17.0 Cg_exo -71.4 -46.88 0.57 Allowed 'Trans proline' 0 C--N 1.373 1.824 0 C-N-CA 122.898 2.398 . . . . 75.02 112.339 174.916 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . -81.98 48.92 4.0 Favored Glycine 0 C--N 1.351 1.383 0 CA-C-N 115.792 -0.64 . . . . 73.2 114.636 -172.742 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 56' ' ' ILE . . . . . 0.507 ' HB ' HD21 ' A' ' 113' ' ' LEU . 44.2 mt -81.71 109.1 15.52 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.598 0 N-CA-C 108.331 -0.988 . . . . 62.22 108.331 170.89 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 57' ' ' THR . . . . . 0.417 ' H ' HD12 ' A' ' 60' ' ' ILE . 67.6 p -75.76 -178.36 4.2 Favored 'General case' 0 N--CA 1.476 0.84 0 C-N-CA 123.434 0.694 . . . . 72.52 110.729 -179.687 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 47.4 tpt85 -60.1 -48.44 81.72 Favored 'General case' 0 CA--C 1.546 0.811 0 C-N-CA 123.331 0.653 . . . . 63.13 109.638 174.48 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 14.9 m -59.33 -44.59 92.59 Favored 'General case' 0 C--O 1.248 0.982 0 C-N-CA 124.502 1.121 . . . . 51.43 111.625 179.754 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 60' ' ' ILE . . . . . 0.417 HD12 ' H ' ' A' ' 57' ' ' THR . 87.5 mt -66.07 -38.35 81.82 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.652 0 CA-C-N 114.87 -1.059 . . . . 74.32 110.38 179.812 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 51.9 tt0 -64.27 -40.28 95.67 Favored 'General case' 0 N--CA 1.48 1.071 0 C-N-CA 123.028 0.531 . . . . 71.23 110.655 177.642 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 40.2 m-20 -60.92 -50.34 73.81 Favored 'General case' 0 N--CA 1.479 0.993 0 C-N-CA 123.11 0.564 . . . . 64.02 110.811 178.259 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 63' ' ' MET . . . . . . . . . . . . . 71.4 mtm -63.41 -57.83 9.02 Favored 'General case' 0 N--CA 1.478 0.971 0 CA-C-N 115.856 -0.611 . . . . 75.14 110.787 -178.902 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 64' ' ' VAL . . . . . 0.493 ' O ' HG13 ' A' ' 68' ' ' ILE . 55.7 t -54.72 -57.89 5.42 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.146 0 C-N-CA 124.04 0.936 . . . . 70.31 111.412 -177.495 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 65' ' ' ALA . . . . . 0.48 ' HB2' HD23 ' A' ' 109' ' ' LEU . . . -63.76 -41.91 97.92 Favored 'General case' 0 N--CA 1.488 1.427 0 C-N-CA 122.393 0.277 . . . . 74.13 111.5 -178.072 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -58.26 -37.35 86.69 Favored Glycine 0 C--N 1.351 1.375 0 O-C-N 123.192 0.307 . . . . 42.24 112.446 177.813 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 67' ' ' TYR . . . . . 0.514 ' O ' HG22 ' A' ' 71' ' ' THR . 18.1 m-30 -71.67 -38.73 70.62 Favored 'General case' 0 N--CA 1.472 0.671 0 C-N-CA 123.422 0.689 . . . . 73.45 111.48 177.028 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 68' ' ' ILE . . . . . 0.507 ' O ' ' HG ' ' A' ' 72' ' ' LEU . 69.8 mt -57.93 -53.39 45.93 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.05 0 O-C-N 123.904 0.752 . . . . 61.13 109.232 177.363 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 69' ' ' LYS . . . . . 0.496 ' HB2' ' CE2' ' A' ' 106' ' ' TYR . 23.0 tptm -61.02 -38.24 85.4 Favored 'General case' 0 N--CA 1.474 0.767 0 C-N-CA 123.262 0.625 . . . . 65.32 110.93 179.109 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 70' ' ' GLN . . . . . 0.419 ' OE1' ' HB1' ' A' ' 15' ' ' ALA . 64.3 tt0 -59.67 -47.04 87.19 Favored 'General case' 0 C--N 1.349 0.586 0 O-C-N 123.746 0.654 . . . . 70.12 110.715 179.737 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 71' ' ' THR . . . . . 0.514 HG22 ' O ' ' A' ' 67' ' ' TYR . 2.2 t -77.51 -26.97 51.6 Favored 'General case' 0 C--N 1.354 0.78 0 O-C-N 122.341 -0.224 . . . . 71.44 111.601 -177.169 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 72' ' ' LEU . . . . . 0.513 HD21 ' HB2' ' A' ' 102' ' ' LEU . 41.7 mt -69.97 -41.36 74.58 Favored 'General case' 0 N--CA 1.483 1.183 0 C-N-CA 122.153 0.181 . . . . 62.23 110.892 175.853 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 73' ' ' ASP . . . . . 0.424 ' O ' ' HG ' ' A' ' 77' ' ' LEU . 18.8 t70 -78.08 -42.12 33.19 Favored 'General case' 0 N--CA 1.477 0.9 0 O-C-N 123.952 0.782 . . . . 60.13 110.517 -175.717 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 74' ' ' ASN . . . . . 0.578 HD22 ' HA ' ' A' ' 19' ' ' GLN . 3.7 m-20 -63.43 -45.15 92.25 Favored 'General case' 0 N--CA 1.482 1.151 0 C-N-CA 122.986 0.514 . . . . 62.52 110.448 176.976 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 27.2 tt0 -66.07 -36.69 83.87 Favored 'General case' 0 C--O 1.206 -1.192 0 O-C-N 123.427 0.454 . . . . 64.12 110.093 175.934 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 55.3 tt0 -56.98 -44.34 82.6 Favored 'General case' 0 N--CA 1.494 1.734 0 C-N-CA 123.818 0.847 . . . . 73.45 110.83 178.518 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 77' ' ' LEU . . . . . 0.424 ' HG ' ' O ' ' A' ' 73' ' ' ASP . 94.8 mt -67.67 -46.41 72.44 Favored 'General case' 0 N--CA 1.478 0.958 0 CA-C-N 114.829 -1.078 . . . . 75.23 110.983 179.59 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 78' ' ' LEU . . . . . 0.824 HD21 ' HA ' ' A' ' 22' ' ' LEU . 71.3 mt -61.0 -52.85 63.24 Favored 'General case' 0 N--CA 1.488 1.427 0 C-N-CA 124.219 1.008 . . . . 74.41 112.802 178.43 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 36.6 ttmt -68.19 -30.31 69.38 Favored 'General case' 0 C--N 1.315 -0.894 0 C-N-CA 125.409 1.484 . . . . 72.45 110.395 -175.328 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -71.11 -37.67 63.79 Favored Glycine 0 CA--C 1.536 1.364 0 CA-C-N 115.798 -0.637 . . . . 51.34 112.571 170.062 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 4.2 tt -63.88 -53.79 44.99 Favored 'General case' 0 N--CA 1.491 1.597 0 C-N-CA 124.043 0.937 . . . . 62.51 108.979 179.951 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 76.3 mt . . . . . 0 CA--C 1.54 0.559 0 C-N-CA 124.705 1.202 . . . . 65.34 110.048 178.788 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 76.3 mt . . . . . 0 N--CA 1.48 1.055 0 N-CA-C 112.574 0.583 . . . . 62.51 112.574 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 36.7 mt -82.28 75.03 0.93 Allowed 'Isoleucine or valine' 0 N--CA 1.475 0.811 0 N-CA-C 108.144 -1.058 . . . . 44.22 108.144 -177.193 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 75.32 -77.04 1.23 Allowed Glycine 0 C--N 1.347 1.146 0 CA-C-N 114.61 -1.177 . . . . 52.25 111.098 -169.092 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 84.4 mt-30 -104.59 -159.96 0.74 Allowed 'General case' 0 CA--C 1.549 0.922 0 C-N-CA 124.187 0.995 . . . . 71.13 110.593 -178.259 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 20.4 p -76.87 44.83 0.4 Allowed 'General case' 0 N--CA 1.478 0.97 0 C-N-CA 125.142 1.377 . . . . 70.23 113.159 176.334 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 28.5 m -62.21 -18.56 61.44 Favored 'General case' 0 CA--C 1.555 1.17 0 C-N-CA 124.785 1.234 . . . . 73.25 111.915 177.782 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 12.7 ttp85 -52.48 -55.38 22.34 Favored 'General case' 0 C--N 1.363 1.182 0 C-N-CA 124.435 1.094 . . . . 63.3 113.511 -172.278 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 7.3 tp60 -60.36 -44.41 95.61 Favored 'General case' 0 N--CA 1.478 0.935 0 O-C-N 123.916 0.76 . . . . 52.01 109.71 -173.824 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 27.0 mtpp -64.59 -40.75 96.09 Favored 'General case' 0 N--CA 1.477 0.879 0 CA-C-N 114.716 -1.129 . . . . 75.12 111.682 178.136 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 45.0 t -67.77 -47.73 68.35 Favored 'General case' 0 N--CA 1.478 0.941 0 C-N-CA 124.245 1.018 . . . . 73.4 110.752 -172.4 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 102' ' ' LEU . . . . . 0.513 ' HB2' HD21 ' A' ' 72' ' ' LEU . 10.2 mp -77.52 -30.26 52.79 Favored 'General case' 0 N--CA 1.472 0.652 0 CA-C-N 115.856 -0.611 . . . . 61.05 111.16 -179.236 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 26.0 t-20 -64.28 -46.14 84.97 Favored 'General case' 0 N--CA 1.484 1.267 0 N-CA-C 109.064 -0.717 . . . . 63.34 109.064 176.492 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 104' ' ' ASN . . . . . 0.419 ' O ' ' HG2' ' A' ' 108' ' ' ARG . 40.1 t30 -63.7 -46.27 86.26 Favored 'General case' 0 CA--C 1.539 0.525 0 CA-C-N 115.248 -0.887 . . . . 73.42 109.895 176.35 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -58.03 -37.49 74.45 Favored 'General case' 0 N--CA 1.482 1.146 0 C-N-CA 124.03 0.932 . . . . 73.35 111.438 179.348 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 106' ' ' TYR . . . . . 0.496 ' CE2' ' HB2' ' A' ' 69' ' ' LYS . 12.0 t80 -65.23 -50.37 66.1 Favored 'General case' 0 N--CA 1.475 0.793 0 C-N-CA 123.707 0.803 . . . . 72.52 109.394 177.324 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -60.95 -40.01 97.8 Favored Glycine 0 C--N 1.351 1.362 0 O-C-N 124.01 0.819 . . . . 74.3 112.966 -177.513 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 108' ' ' ARG . . . . . 0.419 ' HG2' ' O ' ' A' ' 104' ' ' ASN . 26.7 mmt180 -75.08 -29.38 60.65 Favored 'General case' 0 CA--C 1.548 0.881 0 C-N-CA 122.764 0.425 . . . . 54.31 110.244 179.307 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 109' ' ' LEU . . . . . 0.498 ' HA ' ' H ' ' A' ' 114' ' ' LEU . 45.6 tp -71.05 -36.63 72.39 Favored 'General case' 0 N--CA 1.492 1.657 0 C-N-CA 123.221 0.608 . . . . 64.42 110.475 176.361 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 45.3 t -69.85 -41.23 75.16 Favored 'General case' 0 CA--C 1.54 0.587 0 CA-C-N 115.019 -0.991 . . . . 63.0 109.604 177.758 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . -89.58 -63.68 1.28 Allowed Glycine 0 C--N 1.359 1.819 0 CA-C-O 119.42 -0.656 . . . . 53.32 114.438 -175.075 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 112' ' ' MET . . . . . . . . . . . . . 1.1 tmm? -96.26 -67.53 0.84 Allowed 'General case' 0 N--CA 1.493 1.721 0 CA-C-N 118.38 1.09 . . . . 73.11 112.366 -175.125 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 113' ' ' LEU . . . . . 0.507 HD21 ' HB ' ' A' ' 56' ' ' ILE . 1.4 tt 165.77 48.72 0.0 OUTLIER 'General case' 0 N--CA 1.508 2.458 0 C-N-CA 125.704 1.602 . . . . 73.21 107.878 179.755 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 114' ' ' LEU . . . . . 0.498 ' H ' ' HA ' ' A' ' 109' ' ' LEU . 1.3 tt . . . . . 0 N--CA 1.496 1.837 0 C-N-CA 126.76 2.024 . . . . 74.53 111.281 177.171 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 1' ' ' MET . . . . . 0.501 ' HG2' ' HB ' ' A' ' 4' ' ' THR . 38.6 ttp . . . . . 0 N--CA 1.483 1.219 0 N-CA-C 109.253 -0.647 . . . . 52.24 109.253 . . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 42.5 m -50.25 -50.55 49.65 Favored 'General case' 0 N--CA 1.478 0.958 0 C-N-CA 124.85 1.26 . . . . 75.31 113.405 -170.118 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 37.0 m -56.25 -47.99 77.41 Favored 'General case' 0 N--CA 1.48 1.042 0 C-N-CA 123.249 0.619 . . . . 74.13 111.628 -176.688 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 4' ' ' THR . . . . . 0.508 HG21 HD13 ' A' ' 60' ' ' ILE . 40.9 m -68.66 -44.71 73.53 Favored 'General case' 0 C--N 1.35 0.625 0 CA-C-N 115.614 -0.721 . . . . 63.42 110.979 -179.29 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 83.9 t -62.33 -40.12 86.71 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.939 0 C-N-CA 123.115 0.566 . . . . 73.23 110.88 -177.789 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 6' ' ' GLU . . . . . 0.412 ' O ' ' HG3' ' A' ' 10' ' ' ARG . 34.2 mm-40 -69.21 -39.97 78.29 Favored 'General case' 0 N--CA 1.47 0.561 0 O-C-N 123.554 0.534 . . . . 62.11 110.591 177.226 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 30.4 t80 -65.38 -40.01 92.97 Favored 'General case' 0 CA--C 1.554 1.13 0 C-N-CA 122.67 0.388 . . . . 74.34 110.568 -179.545 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 8' ' ' ILE . . . . . 0.586 HD11 HG23 ' A' ' 60' ' ' ILE . 81.0 mt -68.06 -37.03 77.59 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.161 0 C-N-CA 123.876 0.87 . . . . 54.32 109.723 173.984 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 26.6 t-20 -64.45 -28.7 69.85 Favored 'General case' 0 N--CA 1.483 1.207 0 C-N-CA 124.001 0.92 . . . . 74.31 110.896 176.384 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 10' ' ' ARG . . . . . 0.636 ' HB3' HG22 ' A' ' 47' ' ' VAL . 91.5 mtt180 -82.11 -28.8 32.08 Favored 'General case' 0 CA--C 1.539 0.552 0 C-N-CA 123.474 0.71 . . . . 73.34 110.407 177.135 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 11' ' ' TRP . . . . . . . . . . . . . 53.4 m95 -70.92 -33.54 70.63 Favored 'General case' 0 N--CA 1.48 1.034 0 CA-C-O 119.745 -0.169 . . . . 72.11 110.632 167.608 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 12' ' ' GLN . . . . . 0.44 ' HG2' ' CE2' ' A' ' 67' ' ' TYR . 53.0 mt-30 -60.65 -49.19 78.52 Favored 'General case' 0 C--N 1.361 1.092 0 N-CA-C 107.874 -1.158 . . . . 55.23 107.874 171.838 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 28.5 tpt180 -53.19 -54.16 39.96 Favored 'General case' 0 CA--C 1.551 1.001 0 CA-C-N 114.267 -1.333 . . . . 73.25 111.345 -177.834 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 14' ' ' ILE . . . . . 0.406 HG13 ' O ' ' A' ' 10' ' ' ARG . 52.7 mt -62.38 -49.14 85.14 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.263 0 C-N-CA 122.501 0.321 . . . . 62.42 110.304 179.704 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 15' ' ' ALA . . . . . 0.527 ' HA ' ' HB ' ' A' ' 71' ' ' THR . . . -58.94 -44.15 91.34 Favored 'General case' 0 N--CA 1.485 1.288 0 C-N-CA 124.08 0.952 . . . . 62.2 112.319 -176.004 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 91.1 mt -74.47 -45.27 47.31 Favored 'General case' 0 N--CA 1.479 1.023 0 CA-C-N 114.956 -1.02 . . . . 73.43 110.632 -173.741 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.536 ' O ' ' HG ' ' A' ' 21' ' ' LEU . 90.2 mt -59.8 -51.21 70.72 Favored 'General case' 0 N--CA 1.474 0.748 0 O-C-N 123.588 0.555 . . . . 43.41 110.201 179.041 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 78.1 p -66.01 -37.1 85.06 Favored 'General case' 0 N--CA 1.479 0.993 0 O-C-N 123.698 0.623 . . . . 71.13 111.97 -177.088 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 6.8 tp-100 -63.26 -44.24 95.73 Favored 'General case' 0 C--O 1.25 1.1 0 CA-C-O 121.281 0.563 . . . . 75.43 110.753 178.022 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 35.9 m -59.48 -46.02 90.01 Favored 'General case' 0 CA--C 1.535 0.372 0 CA-C-N 114.978 -1.01 . . . . 74.02 109.823 174.255 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 21' ' ' LEU . . . . . 0.687 HD22 ' HA ' ' A' ' 33' ' ' LEU . 47.9 mt -63.95 -29.27 70.45 Favored 'General case' 0 N--CA 1.473 0.712 0 C-N-CA 123.142 0.577 . . . . 62.13 111.392 -178.836 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 22' ' ' LEU . . . . . 0.651 ' HA ' HD21 ' A' ' 78' ' ' LEU . 36.5 tp -70.48 -50.99 32.25 Favored 'General case' 0 C--O 1.245 0.818 0 O-C-N 123.332 0.395 . . . . 72.25 110.043 178.842 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 23.8 mt-10 -60.96 -43.14 99.16 Favored 'General case' 0 N--CA 1.483 1.22 0 O-C-N 123.361 0.413 . . . . 74.13 111.435 177.063 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 96.5 mt -63.46 -39.64 94.99 Favored 'General case' 0 N--CA 1.475 0.782 0 C-N-CA 123.604 0.762 . . . . 64.44 110.767 -179.658 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 25' ' ' ALA . . . . . 0.515 ' HB2' HD21 ' A' ' 33' ' ' LEU . . . -63.75 -40.53 96.95 Favored 'General case' 0 N--CA 1.481 1.117 0 C-N-CA 123.246 0.618 . . . . 74.34 111.573 178.004 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 24.0 mt-30 -59.87 -39.54 85.6 Favored 'General case' 0 N--CA 1.484 1.256 0 C-N-CA 123.527 0.731 . . . . 75.55 110.785 173.209 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 47.8 mtt180 -81.61 -5.42 58.02 Favored 'General case' 0 N--CA 1.484 1.254 0 C-N-CA 123.63 0.772 . . . . 73.12 112.155 -179.613 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 79.12 15.97 79.46 Favored Glycine 0 C--N 1.35 1.313 0 O-C-N 123.126 0.266 . . . . 40.22 113.671 177.852 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 18.7 mm-40 -83.41 51.31 1.96 Allowed 'General case' 0 N--CA 1.476 0.859 0 C-N-CA 124.805 1.242 . . . . 53.13 111.248 177.273 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 30' ' ' TRP . . . . . 0.489 ' O ' ' HG ' ' A' ' 34' ' ' LEU . 88.5 m95 -62.33 -27.0 68.75 Favored 'General case' 0 N--CA 1.475 0.808 0 C-N-CA 123.457 0.703 . . . . 72.32 111.369 -177.309 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 11.2 m-20 -51.89 -54.74 25.8 Favored 'General case' 0 N--CA 1.478 0.928 0 O-C-N 123.933 0.771 . . . . 74.04 109.816 171.242 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 93.6 mt -63.18 -28.79 70.29 Favored 'General case' 0 N--CA 1.471 0.586 0 CA-C-N 114.862 -1.063 . . . . 70.34 111.417 -177.335 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 33' ' ' LEU . . . . . 0.687 ' HA ' HD22 ' A' ' 21' ' ' LEU . 8.4 mp -66.62 -42.8 86.24 Favored 'General case' 0 N--CA 1.479 0.977 0 O-C-N 123.151 0.282 . . . . 75.22 110.849 172.206 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.489 ' HG ' ' O ' ' A' ' 30' ' ' TRP . 77.0 mt -68.81 -35.87 77.52 Favored 'General case' 0 N--CA 1.483 1.178 0 O-C-N 123.621 0.575 . . . . 64.34 111.792 -176.826 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 1.3 mp0 -73.51 -55.33 6.47 Favored 'General case' 0 N--CA 1.483 1.21 0 N-CA-C 110.134 -0.321 . . . . 74.11 110.134 176.636 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 36' ' ' GLN . . . . . 0.483 ' HB2' HD21 ' A' ' 21' ' ' LEU . 82.6 mm-40 -65.63 -14.87 62.06 Favored 'General case' 0 N--CA 1.487 1.381 0 C-N-CA 123.516 0.726 . . . . 74.45 112.524 179.775 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 37' ' ' GLU . . . . . 0.522 ' O ' ' HG ' ' A' ' 41' ' ' LEU . 29.8 tt0 -50.36 -53.62 27.76 Favored 'General case' 0 C--O 1.217 -0.657 0 O-C-N 124.228 0.955 . . . . 74.35 110.591 173.386 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 60.7 t -55.58 -43.9 74.52 Favored 'Isoleucine or valine' 0 C--O 1.249 1.052 0 C-N-CA 123.981 0.913 . . . . 55.14 111.361 -175.632 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 19.6 m -61.34 -49.15 78.13 Favored 'General case' 0 N--CA 1.476 0.86 0 CA-C-N 115.517 -0.765 . . . . 53.03 110.398 175.324 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 40.2 t80 -60.38 -40.43 90.81 Favored 'General case' 0 N--CA 1.474 0.745 0 C-N-CA 124.434 1.094 . . . . 74.2 111.448 -176.932 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 41' ' ' LEU . . . . . 0.522 ' HG ' ' O ' ' A' ' 37' ' ' GLU . 71.7 mt -70.69 -46.56 62.93 Favored 'General case' 0 C--N 1.349 0.57 0 C-N-CA 123.62 0.768 . . . . 73.13 110.26 -176.62 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 53.3 tt0 -58.2 -42.39 86.03 Favored 'General case' 0 N--CA 1.474 0.748 0 O-C-N 123.503 0.502 . . . . 75.21 110.638 177.304 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 43' ' ' SER . . . . . 0.468 ' O ' HG23 ' A' ' 47' ' ' VAL . 49.6 m -63.71 -57.01 11.34 Favored 'General case' 0 CA--C 1.542 0.641 0 CA-C-N 115.514 -0.766 . . . . 74.22 112.007 -177.973 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 15.9 tt -63.06 -34.15 64.93 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.88 0 C-N-CA 123.391 0.676 . . . . 72.2 111.115 -174.959 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 45' ' ' GLU . . . . . 0.591 ' HG2' HD22 ' A' ' 92' ' ' LEU . 23.7 mm-40 -61.02 -53.6 55.22 Favored 'General case' 0 C--N 1.359 0.992 0 O-C-N 123.252 0.345 . . . . 70.21 110.594 169.819 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 46' ' ' THR . . . . . 0.43 ' O ' ' HB2' ' A' ' 50' ' ' LYS . 96.0 m -53.26 -34.43 57.21 Favored 'General case' 0 N--CA 1.482 1.155 0 C-N-CA 123.532 0.733 . . . . 73.34 111.664 -176.976 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 47' ' ' VAL . . . . . 0.636 HG22 ' HB3' ' A' ' 10' ' ' ARG . 41.2 t -75.64 -48.57 29.64 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.938 0 C-N-CA 123.189 0.595 . . . . 73.25 111.782 179.019 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 48' ' ' MET . . . . . . . . . . . . . 76.2 mtm -68.78 -30.53 69.15 Favored 'General case' 0 N--CA 1.489 1.485 0 C-N-CA 122.611 0.365 . . . . 74.34 111.736 -177.736 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 51.2 mt-10 -75.64 -18.48 59.66 Favored 'General case' 0 N--CA 1.48 1.063 0 C-N-CA 124.121 0.968 . . . . 71.43 110.867 175.845 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 50' ' ' LYS . . . . . 0.447 ' HE2' HH12 ' A' ' 10' ' ' ARG . 0.1 OUTLIER -93.36 142.52 27.23 Favored 'General case' 0 C--O 1.237 0.409 0 C-N-CA 122.936 0.494 . . . . 71.4 110.056 -175.738 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 36.8 tt0 -79.46 141.41 36.8 Favored 'General case' 0 C--O 1.244 0.814 0 N-CA-C 108.954 -0.758 . . . . 71.54 108.954 173.628 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 52' ' ' THR . . . . . 0.685 HG21 ' HB3' ' A' ' 114' ' ' LEU . 32.1 m -73.78 131.29 82.04 Favored Pre-proline 0 CA--C 1.552 1.033 0 O-C-N 123.624 0.578 . . . . 73.05 110.263 177.255 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 53' ' ' PRO . . . . . 0.413 ' HG2' ' HA ' ' A' ' 4' ' ' THR . 25.5 Cg_exo -65.29 155.12 70.3 Favored 'Trans proline' 0 C--N 1.371 1.743 0 C-N-CA 122.94 2.427 . . . . 74.53 112.814 174.784 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 32.8 Cg_exo -61.49 -47.7 11.05 Favored 'Trans proline' 0 C--N 1.376 1.999 0 C-N-CA 123.603 2.869 . . . . 53.34 112.812 179.268 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . -65.52 84.85 0.08 OUTLIER Glycine 0 C--N 1.347 1.148 0 CA-C-N 115.156 -0.929 . . . . 72.13 113.932 -173.553 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 62.6 mt -121.15 103.99 14.53 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.467 0 N-CA-C 107.932 -1.136 . . . . 73.21 107.932 173.75 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 57' ' ' THR . . . . . 0.444 ' H ' HD12 ' A' ' 60' ' ' ILE . 58.0 p -91.97 -174.36 3.77 Favored 'General case' 0 CA--C 1.544 0.743 0 C-N-CA 123.476 0.711 . . . . 75.01 109.668 175.175 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 3.6 tmt_? -60.52 -52.31 65.72 Favored 'General case' 0 CA--C 1.545 0.774 0 C-N-CA 123.949 0.9 . . . . 73.42 110.905 178.727 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 57.6 p -62.7 -39.11 92.96 Favored 'General case' 0 N--CA 1.481 1.085 0 C-N-CA 123.373 0.669 . . . . 71.44 111.635 -179.563 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 60' ' ' ILE . . . . . 0.586 HG23 HD11 ' A' ' 8' ' ' ILE . 87.0 mt -63.13 -47.98 89.91 Favored 'Isoleucine or valine' 0 C--N 1.349 0.55 0 CA-C-N 115.108 -0.951 . . . . 71.21 110.795 179.065 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 2.9 pt20 -70.97 -25.13 62.58 Favored 'General case' 0 N--CA 1.481 1.104 0 CA-C-N 117.491 0.132 . . . . 74.34 110.997 -177.885 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 53.8 m-20 -65.58 -48.56 71.93 Favored 'General case' 0 N--CA 1.482 1.132 0 C-N-CA 122.268 0.227 . . . . 71.53 111.256 172.647 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 63' ' ' MET . . . . . . . . . . . . . 73.4 mtm -65.87 -45.03 83.59 Favored 'General case' 0 N--CA 1.478 0.953 0 O-C-N 123.448 0.467 . . . . 64.54 111.061 178.29 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 64' ' ' VAL . . . . . 0.45 ' O ' HG13 ' A' ' 68' ' ' ILE . 55.6 t -64.49 -64.59 0.66 Allowed 'Isoleucine or valine' 0 N--CA 1.475 0.796 0 C-N-CA 123.337 0.655 . . . . 62.34 110.389 -178.921 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -63.48 -29.81 71.03 Favored 'General case' 0 N--CA 1.482 1.134 0 C-N-CA 123.053 0.541 . . . . 54.11 111.534 -177.149 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -60.24 -54.01 40.89 Favored Glycine 0 C--N 1.35 1.333 0 O-C-N 123.871 0.732 . . . . 74.21 111.378 174.71 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 67' ' ' TYR . . . . . 0.44 ' CE2' ' HG2' ' A' ' 12' ' ' GLN . 12.1 m-85 -66.44 -33.9 76.73 Favored 'General case' 0 N--CA 1.469 0.513 0 C-N-CA 122.999 0.52 . . . . 73.01 112.109 179.99 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 68' ' ' ILE . . . . . 0.521 ' O ' ' HG ' ' A' ' 72' ' ' LEU . 70.0 mt -59.97 -56.13 19.49 Favored 'Isoleucine or valine' 0 C--N 1.357 0.924 0 N-CA-C 108.982 -0.747 . . . . 71.24 108.982 175.958 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 54.7 tptt -54.42 -48.31 71.8 Favored 'General case' 0 N--CA 1.475 0.777 0 O-C-N 123.994 0.809 . . . . 62.35 110.927 -179.366 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 56.6 mt-30 -57.76 -46.41 84.58 Favored 'General case' 0 N--CA 1.474 0.767 0 O-C-N 124.021 0.825 . . . . 70.13 111.272 179.836 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 71' ' ' THR . . . . . 0.527 ' HB ' ' HA ' ' A' ' 15' ' ' ALA . 14.0 t -79.29 -18.96 51.63 Favored 'General case' 0 C--N 1.353 0.745 0 CA-C-O 118.981 -0.533 . . . . 64.51 111.233 -175.749 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 72' ' ' LEU . . . . . 0.521 ' HG ' ' O ' ' A' ' 68' ' ' ILE . 39.8 mt -70.67 -41.31 72.25 Favored 'General case' 0 N--CA 1.485 1.278 0 N-CA-C 109.627 -0.508 . . . . 64.51 109.627 171.918 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 6.2 m-20 -62.22 -50.17 72.83 Favored 'General case' 0 N--CA 1.474 0.762 0 O-C-N 123.676 0.61 . . . . 73.43 110.187 174.007 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 71.5 m-20 -59.47 -52.0 67.45 Favored 'General case' 0 N--CA 1.481 1.109 0 C-N-CA 122.975 0.51 . . . . 63.31 110.557 -178.712 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 75' ' ' GLU . . . . . 0.416 ' O ' ' HG2' ' A' ' 79' ' ' LYS . 40.1 tp10 -52.75 -56.21 17.28 Favored 'General case' 0 N--CA 1.485 1.286 0 C-N-CA 125.109 1.364 . . . . 74.5 111.455 178.547 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 62.0 tt0 -70.56 -42.14 71.52 Favored 'General case' 0 N--CA 1.473 0.724 0 C-N-CA 123.088 0.555 . . . . 73.41 111.51 -171.336 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 84.4 mt -62.11 -38.4 88.76 Favored 'General case' 0 N--CA 1.483 1.217 0 O-C-N 123.397 0.436 . . . . 44.4 110.677 178.207 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 78' ' ' LEU . . . . . 0.651 HD21 ' HA ' ' A' ' 22' ' ' LEU . 46.0 mt -63.35 -49.1 75.22 Favored 'General case' 0 N--CA 1.476 0.845 0 O-C-N 123.452 0.47 . . . . 54.32 111.396 174.525 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 79' ' ' LYS . . . . . 0.416 ' HG2' ' O ' ' A' ' 75' ' ' GLU . 46.6 mmtm -62.87 -34.03 76.52 Favored 'General case' 0 N--CA 1.485 1.291 0 C-N-CA 122.978 0.511 . . . . 74.54 111.635 -177.766 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -75.28 -35.78 47.23 Favored Glycine 0 C--N 1.346 1.113 0 CA-C-N 115.197 -0.911 . . . . 54.43 112.408 177.125 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 1.5 tt -67.28 -37.37 83.32 Favored 'General case' 0 N--CA 1.477 0.877 0 C-N-CA 123.786 0.834 . . . . 71.3 109.03 178.172 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 82' ' ' LEU . . . . . 0.483 ' HG ' ' O ' ' A' ' 78' ' ' LEU . 60.1 mt . . . . . 0 C--N 1.352 0.697 0 C-N-CA 123.768 0.827 . . . . 74.52 111.565 179.683 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 92' ' ' LEU . . . . . 0.591 HD22 ' HG2' ' A' ' 45' ' ' GLU . 43.7 mt . . . . . 0 N--CA 1.492 1.647 0 N-CA-C 112.629 0.603 . . . . 71.24 112.629 . . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 49.4 mt -53.41 111.12 0.26 Allowed 'Isoleucine or valine' 0 CA--C 1.558 1.26 0 C-N-CA 123.892 0.877 . . . . 74.13 110.182 167.203 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -76.86 0.61 65.44 Favored Glycine 0 C--N 1.35 1.314 0 CA-C-N 115.82 -0.627 . . . . 71.43 114.114 -175.561 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 9.9 tt0 -69.69 -11.58 60.96 Favored 'General case' 0 N--CA 1.48 1.071 0 C-N-CA 123.858 0.863 . . . . 64.13 110.67 169.254 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 19.6 t 73.25 17.49 3.97 Favored 'General case' 0 C--N 1.358 0.973 0 C-N-CA 124.944 1.298 . . . . 71.41 111.453 176.856 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 13.5 t -86.57 16.7 4.41 Favored 'General case' 0 CA--C 1.553 1.067 0 C-N-CA 123.732 0.813 . . . . 45.53 111.571 -179.346 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 14.3 mtm-85 -65.59 -58.13 6.49 Favored 'General case' 0 N--CA 1.489 1.515 0 C-N-CA 123.839 0.855 . . . . 74.34 112.554 -167.441 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 8.1 tt0 -63.4 -37.81 88.73 Favored 'General case' 0 CA--C 1.542 0.65 0 CA-C-N 115.296 -0.865 . . . . 72.14 109.675 178.344 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 51.5 tttm -68.17 -26.45 65.75 Favored 'General case' 0 CA--C 1.546 0.816 0 CA-C-N 114.794 -1.094 . . . . 72.22 111.357 177.766 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 47.2 t -73.23 -48.39 35.4 Favored 'General case' 0 N--CA 1.471 0.608 0 C-N-CA 123.502 0.721 . . . . 32.42 109.159 -178.509 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 9.5 mp -69.3 -30.1 68.1 Favored 'General case' 0 N--CA 1.484 1.266 0 O-C-N 123.498 0.499 . . . . 51.14 111.418 176.225 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 6.8 t30 -71.01 -50.33 35.37 Favored 'General case' 0 N--CA 1.478 0.964 0 CA-C-O 121.055 0.455 . . . . 71.31 110.499 179.642 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 10.8 m120 -71.09 -18.9 62.52 Favored 'General case' 0 N--CA 1.479 1.016 0 C-N-CA 123.072 0.549 . . . . 50.1 111.091 176.449 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -64.91 -47.43 77.77 Favored 'General case' 0 C--N 1.349 0.572 0 O-C-N 123.626 0.579 . . . . 75.03 109.795 169.18 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 106' ' ' TYR . . . . . . . . . . . . . 1.1 t80 -58.11 -45.02 87.97 Favored 'General case' 0 N--CA 1.482 1.161 0 N-CA-C 109.482 -0.562 . . . . 73.53 109.482 174.225 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -58.79 -44.85 95.62 Favored Glycine 0 C--N 1.35 1.361 0 CA-C-N 115.778 -0.646 . . . . 54.31 113.345 -179.777 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 31.4 ptt180 -81.7 -14.53 56.44 Favored 'General case' 0 N--CA 1.476 0.828 0 C-N-CA 122.746 0.418 . . . . 73.22 111.051 -179.979 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 109' ' ' LEU . . . . . 0.567 HD13 ' HB2' ' A' ' 114' ' ' LEU . 36.4 tp -70.83 -43.37 68.7 Favored 'General case' 0 N--CA 1.486 1.373 0 N-CA-C 109.218 -0.66 . . . . 73.45 109.218 171.012 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 19.1 m -71.83 -36.44 70.2 Favored 'General case' 0 CA--C 1.547 0.837 0 CA-C-N 114.984 -1.007 . . . . 70.41 110.376 177.762 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . -91.02 -61.61 1.26 Allowed Glycine 0 C--N 1.358 1.789 0 N-CA-C 114.585 0.594 . . . . 65.22 114.585 -177.568 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 112' ' ' MET . . . . . . . . . . . . . 12.5 tpt -91.83 -69.72 0.73 Allowed 'General case' 0 N--CA 1.488 1.431 0 N-CA-C 112.961 0.726 . . . . 42.4 112.961 -172.377 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 18.8 tp 170.75 21.92 0.0 OUTLIER 'General case' 0 N--CA 1.493 1.721 0 C-N-CA 124.54 1.136 . . . . 70.34 110.593 -178.543 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 114' ' ' LEU . . . . . 0.685 ' HB3' HG21 ' A' ' 52' ' ' THR . 39.0 tp . . . . . 0 N--CA 1.499 1.999 0 C-N-CA 124.788 1.235 . . . . 74.05 111.698 -175.922 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 25.3 ttt . . . . . 0 CA--C 1.558 1.257 0 N-CA-C 110.369 -0.234 . . . . 54.1 110.369 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 74.1 p -55.63 -56.48 19.85 Favored 'General case' 0 N--CA 1.489 1.523 0 C-N-CA 123.957 0.903 . . . . 42.31 112.546 -171.971 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 34.1 t -65.23 -30.63 71.54 Favored 'General case' 0 N--CA 1.478 0.94 0 C-N-CA 123.208 0.603 . . . . 61.14 111.474 -177.178 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 4' ' ' THR . . . . . 0.468 ' HA ' ' HG3' ' A' ' 53' ' ' PRO . 28.0 m -72.27 -43.03 64.88 Favored 'General case' 0 N--CA 1.471 0.624 0 C-N-CA 123.162 0.585 . . . . 70.31 111.214 179.078 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 76.6 t -63.59 -45.77 96.72 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.759 0 N-CA-C 109.2 -0.667 . . . . 62.14 109.2 179.29 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 24.1 mm-40 -56.66 -51.63 68.01 Favored 'General case' 0 N--CA 1.475 0.783 0 O-C-N 124.058 0.849 . . . . 74.51 110.627 174.226 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 34.0 t80 -58.11 -53.65 55.84 Favored 'General case' 0 N--CA 1.481 1.122 0 C-N-CA 124.195 0.998 . . . . 73.34 111.496 -173.577 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 8' ' ' ILE . . . . . 0.408 ' O ' ' HG3' ' A' ' 12' ' ' GLN . 72.1 mt -61.77 -45.32 98.94 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.967 0 C-N-CA 123.54 0.736 . . . . 61.15 110.151 178.776 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 26.2 t-20 -62.01 -32.86 73.38 Favored 'General case' 0 N--CA 1.488 1.436 0 C-N-CA 123.894 0.878 . . . . 74.24 111.954 -177.897 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 10' ' ' ARG . . . . . 0.412 ' O ' HG13 ' A' ' 14' ' ' ILE . 96.6 mtt180 -78.13 -34.75 49.75 Favored 'General case' 0 C--O 1.214 -0.773 0 CA-C-N 115.954 -0.566 . . . . 74.31 110.042 178.694 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 11' ' ' TRP . . . . . . . . . . . . . 53.0 m95 -67.28 -33.76 75.98 Favored 'General case' 0 N--CA 1.482 1.163 0 O-C-N 122.916 0.135 . . . . 74.22 111.131 172.037 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 12' ' ' GLN . . . . . 0.444 ' HG2' ' CE2' ' A' ' 67' ' ' TYR . 51.4 mt-30 -61.42 -48.41 81.31 Favored 'General case' 0 C--O 1.218 -0.562 0 N-CA-C 108.327 -0.99 . . . . 73.41 108.327 171.939 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 79.2 ttt180 -62.56 -48.59 78.83 Favored 'General case' 0 C--O 1.216 -0.687 0 O-C-N 124.638 1.211 . . . . 74.33 111.373 -175.799 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 14' ' ' ILE . . . . . 0.412 HG13 ' O ' ' A' ' 10' ' ' ARG . 90.9 mt -62.44 -43.12 97.93 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.002 0 C-N-CA 123.615 0.766 . . . . 61.41 109.69 -179.312 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 15' ' ' ALA . . . . . 0.619 ' HA ' ' HB ' ' A' ' 71' ' ' THR . . . -60.79 -44.3 97.0 Favored 'General case' 0 N--CA 1.482 1.139 0 C-N-CA 123.373 0.669 . . . . 73.32 111.799 176.645 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 87.8 mt -74.76 -35.58 62.58 Favored 'General case' 0 N--CA 1.485 1.301 0 CA-C-N 115.143 -0.935 . . . . 73.4 111.038 -175.027 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.508 ' O ' ' HG ' ' A' ' 21' ' ' LEU . 72.4 mt -72.05 -47.31 52.57 Favored 'General case' 0 N--CA 1.475 0.798 0 C-N-CA 122.912 0.485 . . . . 74.21 109.742 -177.721 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 79.3 p -65.1 -36.0 82.9 Favored 'General case' 0 N--CA 1.48 1.048 0 C-N-CA 123.04 0.536 . . . . 72.31 111.091 176.951 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 26.9 tp60 -61.88 -45.57 93.16 Favored 'General case' 0 N--CA 1.475 0.79 0 C-N-CA 123.391 0.676 . . . . 74.12 110.189 174.971 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 20' ' ' SER . . . . . 0.404 ' O ' ' HG ' ' A' ' 24' ' ' LEU . 66.5 m -58.79 -52.93 63.63 Favored 'General case' 0 C--O 1.202 -1.442 0 CA-C-N 114.929 -1.032 . . . . 75.24 109.584 174.7 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 21' ' ' LEU . . . . . 0.643 HD22 ' HA ' ' A' ' 33' ' ' LEU . 52.6 mt -62.22 -27.69 69.16 Favored 'General case' 0 N--CA 1.473 0.699 0 C-N-CA 123.676 0.79 . . . . 74.43 111.323 -175.963 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 22' ' ' LEU . . . . . 0.673 ' HA ' HD21 ' A' ' 78' ' ' LEU . 56.8 tp -70.51 -54.09 13.59 Favored 'General case' 0 N--CA 1.472 0.651 0 C-N-CA 122.953 0.501 . . . . 74.12 109.894 176.691 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 23' ' ' GLU . . . . . 0.441 ' O ' ' HG3' ' A' ' 27' ' ' ARG . 44.6 mt-10 -59.12 -52.74 64.43 Favored 'General case' 0 CA--C 1.545 0.776 0 O-C-N 123.929 0.768 . . . . 74.44 110.246 179.506 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 24' ' ' LEU . . . . . 0.461 ' HB3' ' HB2' ' A' ' 29' ' ' GLU . 92.2 mt -53.56 -42.56 67.65 Favored 'General case' 0 N--CA 1.479 1.007 0 C-N-CA 125.441 1.496 . . . . 75.11 112.174 176.578 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 25' ' ' ALA . . . . . 0.512 ' HB2' HD21 ' A' ' 33' ' ' LEU . . . -58.28 -47.68 82.87 Favored 'General case' 0 N--CA 1.484 1.237 0 C-N-CA 122.944 0.498 . . . . 74.02 110.901 176.918 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 90.8 mt-30 -66.59 -30.34 70.61 Favored 'General case' 0 CA--C 1.555 1.157 0 CA-C-N 114.99 -1.005 . . . . 73.33 111.141 178.721 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 27' ' ' ARG . . . . . 0.441 ' HG3' ' O ' ' A' ' 23' ' ' GLU . 94.9 mtt180 -78.38 -17.81 55.94 Favored 'General case' 0 N--CA 1.483 1.202 0 C-N-CA 123.857 0.863 . . . . 75.45 111.326 178.253 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 92.43 9.27 61.83 Favored Glycine 0 N--CA 1.475 1.283 0 C-N-CA 122.922 0.296 . . . . 51.13 113.564 -178.231 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 29' ' ' GLU . . . . . 0.461 ' HB2' ' HB3' ' A' ' 24' ' ' LEU . 5.4 mm-40 -82.58 53.72 2.42 Favored 'General case' 0 CA--C 1.55 0.973 0 C-N-CA 124.387 1.075 . . . . 72.21 111.014 178.09 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 30' ' ' TRP . . . . . . . . . . . . . 86.4 m95 -63.56 -28.89 70.25 Favored 'General case' 0 N--CA 1.483 1.187 0 C-N-CA 123.902 0.881 . . . . 73.11 111.717 -176.404 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 31' ' ' ASP . . . . . 0.485 ' O ' ' HG3' ' A' ' 35' ' ' GLN . 3.4 m-20 -53.23 -46.37 69.1 Favored 'General case' 0 N--CA 1.475 0.823 0 C-N-CA 123.603 0.761 . . . . 53.42 110.548 174.789 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 0.438 HD12 HD22 ' A' ' 24' ' ' LEU . 64.9 mt -67.14 -28.25 67.98 Favored 'General case' 0 CA--C 1.549 0.94 0 CA-C-N 115.501 -0.772 . . . . 74.22 111.34 -176.527 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 33' ' ' LEU . . . . . 0.643 ' HA ' HD22 ' A' ' 21' ' ' LEU . 9.6 mp -68.61 -43.81 75.6 Favored 'General case' 0 N--CA 1.486 1.36 0 C-N-CA 123.122 0.569 . . . . 72.42 110.116 173.365 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 79.3 mt -64.36 -36.97 85.86 Favored 'General case' 0 CA--C 1.551 0.986 0 CA-C-N 115.324 -0.853 . . . . 73.02 111.348 178.844 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 35' ' ' GLN . . . . . 0.485 ' HG3' ' O ' ' A' ' 31' ' ' ASP . 90.4 mt-30 -69.74 -51.55 33.23 Favored 'General case' 0 N--CA 1.481 1.119 0 C-N-CA 123.292 0.637 . . . . 72.12 110.312 177.608 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 36' ' ' GLN . . . . . 0.443 ' HB2' HD21 ' A' ' 21' ' ' LEU . 77.2 mm-40 -70.87 -14.25 62.33 Favored 'General case' 0 N--CA 1.477 0.888 0 CA-C-N 115.248 -0.887 . . . . 73.42 112.993 -177.73 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 38.3 tt0 -45.31 -51.38 11.07 Favored 'General case' 0 N--CA 1.487 1.377 0 CA-C-N 118.287 0.494 . . . . 73.12 111.373 174.241 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 81.4 t -61.12 -54.57 33.52 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.793 0 O-C-N 123.877 0.736 . . . . 72.51 110.74 -179.027 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 21.9 m -65.51 -52.09 55.21 Favored 'General case' 0 CA--C 1.551 1.006 0 C-N-CA 123.525 0.73 . . . . 71.44 112.507 -173.441 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 44.4 t80 -60.58 -51.53 69.01 Favored 'General case' 0 N--CA 1.478 0.951 0 C-N-CA 124.792 1.237 . . . . 71.34 111.904 -179.077 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 41' ' ' LEU . . . . . 0.54 ' HA ' HG22 ' A' ' 44' ' ' ILE . 64.4 mt -77.81 -23.35 49.1 Favored 'General case' 0 CA--C 1.546 0.793 0 CA-C-N 116.317 -0.401 . . . . 75.32 111.604 -174.688 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 51.8 tt0 -66.54 -44.49 82.24 Favored 'General case' 0 N--CA 1.484 1.255 0 N-CA-C 109.435 -0.579 . . . . 65.45 109.435 168.7 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 43' ' ' SER . . . . . 0.432 ' O ' HG23 ' A' ' 47' ' ' VAL . 74.3 m -60.79 -43.51 98.0 Favored 'General case' 0 N--CA 1.476 0.859 0 C-N-CA 123.251 0.62 . . . . 71.33 111.582 179.465 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 44' ' ' ILE . . . . . 0.54 HG22 ' HA ' ' A' ' 41' ' ' LEU . 12.5 tt -69.02 -40.45 80.86 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.972 0 O-C-N 123.121 0.263 . . . . 54.44 110.464 -178.145 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 14.3 mm-40 -58.81 -42.51 89.34 Favored 'General case' 0 N--CA 1.484 1.251 0 C-N-CA 122.895 0.478 . . . . 62.05 110.767 172.747 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 99.4 m -62.0 -43.37 98.97 Favored 'General case' 0 N--CA 1.48 1.059 0 C-N-CA 123.919 0.888 . . . . 51.53 111.578 -179.437 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 47' ' ' VAL . . . . . 0.432 HG23 ' O ' ' A' ' 43' ' ' SER . 58.0 t -67.95 -41.89 85.07 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.012 0 C-N-CA 122.269 0.228 . . . . 63.03 110.938 178.889 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 48' ' ' MET . . . . . . . . . . . . . 78.4 mtm -68.91 -34.45 75.41 Favored 'General case' 0 N--CA 1.484 1.244 0 N-CA-C 112.479 0.548 . . . . 42.54 112.479 -177.468 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 13.1 pt-20 -82.33 -24.22 34.7 Favored 'General case' 0 N--CA 1.487 1.407 0 C-N-CA 122.355 0.262 . . . . 72.21 111.359 179.574 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 13.4 mptt -83.72 143.66 29.87 Favored 'General case' 0 N--CA 1.479 1.021 0 C-N-CA 122.914 0.486 . . . . 75.51 110.228 177.808 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 51.1 tt0 -74.55 137.48 42.44 Favored 'General case' 0 CA--C 1.542 0.645 0 CA-C-N 114.975 -1.011 . . . . 72.32 110.581 -178.869 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 17.4 m -62.95 132.76 95.09 Favored Pre-proline 0 CA--C 1.561 1.397 0 O-C-N 123.799 0.687 . . . . 62.24 110.381 175.637 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 53' ' ' PRO . . . . . 0.468 ' HG3' ' HA ' ' A' ' 4' ' ' THR . 61.0 Cg_endo -70.05 156.26 63.0 Favored 'Trans proline' 0 C--N 1.377 2.072 0 C-N-CA 122.645 2.23 . . . . 63.11 112.424 177.376 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 35.6 Cg_endo -64.5 -47.57 5.51 Favored 'Trans proline' 0 C--N 1.374 1.891 0 C-N-CA 122.803 2.335 . . . . 71.22 113.284 175.61 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . -67.14 83.34 0.12 Allowed Glycine 0 C--N 1.347 1.154 0 O-C-N 123.866 0.729 . . . . 71.32 113.613 -174.115 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 60.5 mt -124.86 103.02 11.71 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.455 0 C-N-CA 124.203 1.001 . . . . 72.34 108.455 175.164 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 57' ' ' THR . . . . . 0.423 ' H ' HD12 ' A' ' 60' ' ' ILE . 81.9 p -83.67 -178.9 7.17 Favored 'General case' 0 N--CA 1.473 0.712 0 N-CA-C 109.244 -0.65 . . . . 62.34 109.244 170.547 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 27.1 tpt180 -69.04 -35.53 76.69 Favored 'General case' 0 N--CA 1.472 0.626 0 N-CA-C 110.016 -0.364 . . . . 74.31 110.016 177.261 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 35.9 m -60.49 -47.9 84.1 Favored 'General case' 0 CA--C 1.546 0.799 0 C-N-CA 123.212 0.605 . . . . 71.34 110.716 176.508 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 60' ' ' ILE . . . . . 0.423 HD12 ' H ' ' A' ' 57' ' ' THR . 86.1 mt -61.75 -42.73 95.52 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.814 0 CA-C-N 115.097 -0.956 . . . . 74.31 110.405 176.347 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 64.5 tt0 -65.26 -36.3 83.7 Favored 'General case' 0 N--CA 1.476 0.864 0 C-N-CA 123.754 0.822 . . . . 52.15 111.597 -178.129 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 37.2 m-20 -75.68 -38.1 59.01 Favored 'General case' 0 N--CA 1.481 1.079 0 C-N-CA 122.831 0.452 . . . . 62.24 111.786 179.924 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 63' ' ' MET . . . . . . . . . . . . . 72.3 mtm -66.8 -51.55 54.43 Favored 'General case' 0 N--CA 1.482 1.125 0 C-N-CA 122.4 0.28 . . . . 75.45 110.446 176.649 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 64' ' ' VAL . . . . . 0.488 ' O ' HG13 ' A' ' 68' ' ' ILE . 55.5 t -59.58 -58.97 4.7 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.765 0 C-N-CA 123.524 0.73 . . . . 73.35 110.768 179.128 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 65' ' ' ALA . . . . . 0.485 ' HB2' HD23 ' A' ' 109' ' ' LEU . . . -62.26 -35.94 80.53 Favored 'General case' 0 N--CA 1.488 1.475 0 C-N-CA 122.567 0.347 . . . . 51.14 111.876 -178.405 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -59.27 -41.68 96.93 Favored Glycine 0 C--N 1.347 1.172 0 N-CA-C 111.776 -0.529 . . . . 72.42 111.776 175.138 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 67' ' ' TYR . . . . . 0.444 ' CE2' ' HG2' ' A' ' 12' ' ' GLN . 10.7 m-30 -78.86 -29.81 44.75 Favored 'General case' 0 N--CA 1.467 0.422 0 N-CA-C 113.198 0.814 . . . . 74.42 113.198 -179.902 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 68' ' ' ILE . . . . . 0.488 HG13 ' O ' ' A' ' 64' ' ' VAL . 59.4 mt -64.85 -51.64 64.35 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.095 0 N-CA-C 108.414 -0.958 . . . . 74.11 108.414 174.702 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 20.2 tptm -55.21 -45.17 75.89 Favored 'General case' 0 N--CA 1.474 0.767 0 O-C-N 123.913 0.758 . . . . 73.21 110.57 175.119 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 55.4 tt0 -61.38 -45.39 94.55 Favored 'General case' 0 C--N 1.352 0.717 0 O-C-N 123.818 0.699 . . . . 75.35 110.848 -176.3 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 71' ' ' THR . . . . . 0.619 ' HB ' ' HA ' ' A' ' 15' ' ' ALA . 11.1 t -78.3 -28.1 47.4 Favored 'General case' 0 C--N 1.353 0.752 0 O-C-N 122.999 0.187 . . . . 75.54 110.999 -173.864 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 72' ' ' LEU . . . . . 0.433 ' O ' ' HB2' ' A' ' 76' ' ' GLN . 36.0 mt -73.64 -29.54 62.4 Favored 'General case' 0 N--CA 1.474 0.748 0 O-C-N 123.407 0.442 . . . . 74.41 110.658 174.966 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 33.3 t70 -77.22 -43.49 33.4 Favored 'General case' 0 N--CA 1.48 1.055 0 O-C-N 123.907 0.754 . . . . 75.32 110.678 178.927 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 74' ' ' ASN . . . . . 0.431 ' HA ' HD22 ' A' ' 22' ' ' LEU . 82.7 m-20 -59.66 -49.57 77.25 Favored 'General case' 0 N--CA 1.472 0.638 0 CA-C-N 115.613 -0.721 . . . . 65.5 109.676 176.499 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 75' ' ' GLU . . . . . 0.43 ' HA ' ' HB2' ' A' ' 78' ' ' LEU . 25.5 tt0 -74.7 -23.1 58.55 Favored 'General case' 0 CA--C 1.552 1.027 0 CA-C-N 115.082 -0.963 . . . . 64.42 111.494 179.609 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 76' ' ' GLN . . . . . 0.433 ' HB2' ' O ' ' A' ' 72' ' ' LEU . 60.7 tt0 -58.88 -48.31 81.84 Favored 'General case' 0 N--CA 1.488 1.426 0 N-CA-C 109.085 -0.709 . . . . 72.42 109.085 172.283 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 82.6 mt -67.56 -43.72 79.97 Favored 'General case' 0 CA--C 1.548 0.869 0 CA-C-N 115.169 -0.923 . . . . 72.22 111.183 177.451 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 78' ' ' LEU . . . . . 0.673 HD21 ' HA ' ' A' ' 22' ' ' LEU . 61.1 mt -62.18 -58.75 6.61 Favored 'General case' 0 N--CA 1.486 1.343 0 C-N-CA 123.35 0.66 . . . . 74.32 112.474 -178.421 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 46.3 mmtm -64.49 -34.47 78.29 Favored 'General case' 0 CA--C 1.553 1.08 0 C-N-CA 123.159 0.584 . . . . 72.24 110.611 176.794 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -62.5 -28.3 71.01 Favored Glycine 0 C--N 1.346 1.137 0 CA-C-N 116.695 -0.23 . . . . 72.2 112.928 175.396 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 8.6 tt -86.16 -47.13 9.76 Favored 'General case' 0 CA--C 1.545 0.769 0 C-N-CA 123.871 0.868 . . . . 72.45 109.728 175.281 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 50.4 mt . . . . . 0 N--CA 1.478 0.938 0 C-N-CA 123.682 0.793 . . . . 53.4 110.667 -166.415 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 97.7 mt . . . . . 0 N--CA 1.491 1.576 0 N-CA-C 110.863 -0.051 . . . . 71.22 110.863 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 60.4 mt -59.04 -71.61 0.1 Allowed 'Isoleucine or valine' 0 N--CA 1.482 1.146 0 C-N-CA 124.023 0.929 . . . . 75.41 111.768 -178.608 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -139.53 -123.26 2.05 Favored Glycine 0 C--N 1.346 1.135 0 N-CA-C 112.099 -0.401 . . . . 44.01 112.099 -173.949 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -88.46 148.2 24.29 Favored 'General case' 0 N--CA 1.477 0.91 0 C-N-CA 122.896 0.478 . . . . 73.33 109.881 176.099 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 70.2 p 52.26 -79.88 0.01 OUTLIER 'General case' 0 CA--C 1.559 1.289 0 C-N-CA 125.79 1.636 . . . . 63.13 111.972 -175.705 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 28.1 m 66.74 -80.35 0.03 OUTLIER 'General case' 0 CA--C 1.555 1.145 0 C-N-CA 125.188 1.395 . . . . 54.1 111.905 175.779 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 98' ' ' ARG . . . . . 0.47 ' HB2' HD13 ' A' ' 44' ' ' ILE . 0.0 OUTLIER -62.64 -43.9 97.64 Favored 'General case' 0 N--CA 1.488 1.446 0 N-CA-C 112.581 0.586 . . . . 71.13 112.581 -170.243 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 3.8 pt20 -70.5 -40.06 73.78 Favored 'General case' 0 N--CA 1.477 0.885 0 C-N-CA 122.61 0.364 . . . . 74.32 110.331 -174.768 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 23.6 tptm -66.9 -46.12 75.85 Favored 'General case' 0 CA--C 1.55 0.96 0 C-N-CA 124.144 0.978 . . . . 73.04 110.579 -179.498 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 31.4 t -72.68 -39.56 66.97 Favored 'General case' 0 N--CA 1.476 0.835 0 CA-C-N 115.155 -0.93 . . . . 70.45 111.546 -174.437 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 11.2 mp -78.39 -29.69 47.41 Favored 'General case' 0 N--CA 1.485 1.281 0 C-N-CA 122.684 0.394 . . . . 73.13 111.54 -179.838 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 50.1 t-20 -64.97 -45.85 83.96 Favored 'General case' 0 N--CA 1.482 1.13 0 N-CA-C 108.563 -0.903 . . . . 65.31 108.563 172.239 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 104' ' ' ASN . . . . . 0.404 ' O ' ' HD3' ' A' ' 108' ' ' ARG . 40.3 t-20 -59.71 -47.0 87.39 Favored 'General case' 0 N--CA 1.478 0.945 0 CA-C-N 115.269 -0.878 . . . . 71.34 109.557 176.017 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -63.87 -33.63 76.13 Favored 'General case' 0 CA--C 1.538 0.503 0 CA-C-N 115.112 -0.949 . . . . 73.53 111.627 -178.488 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 106' ' ' TYR . . . . . . . . . . . . . 3.9 t80 -70.54 -54.23 12.98 Favored 'General case' 0 N--CA 1.476 0.838 0 C-N-CA 122.897 0.479 . . . . 74.31 110.071 -179.063 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -62.64 -32.03 82.02 Favored Glycine 0 C--N 1.345 1.064 0 CA-C-N 115.512 -0.767 . . . . 74.43 112.573 -178.781 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 108' ' ' ARG . . . . . 0.404 ' HD3' ' O ' ' A' ' 104' ' ' ASN . 9.7 mpt_? -83.28 -21.5 33.27 Favored 'General case' 0 C--O 1.217 -0.641 0 C-N-CA 122.935 0.494 . . . . 74.24 110.62 176.463 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 109' ' ' LEU . . . . . 0.525 HD13 ' HB2' ' A' ' 114' ' ' LEU . 43.9 tp -68.79 -31.18 70.0 Favored 'General case' 0 N--CA 1.494 1.728 0 CA-C-N 118.841 0.746 . . . . 55.03 109.603 170.633 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 25.7 t -72.81 -46.57 52.44 Favored 'General case' 0 CA--C 1.551 1.002 0 CA-C-N 115.382 -0.826 . . . . 60.5 110.205 170.592 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . -89.97 -63.0 1.27 Allowed Glycine 0 C--N 1.358 1.793 0 N-CA-C 115.67 1.028 . . . . 45.2 115.67 -172.201 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 112' ' ' MET . . . . . . . . . . . . . 54.8 mmm -92.67 -69.51 0.74 Allowed 'General case' 0 N--CA 1.49 1.542 0 CA-C-N 118.277 1.038 . . . . 72.12 113.683 -175.472 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 15.2 tp 173.27 28.76 0.0 OUTLIER 'General case' 0 N--CA 1.492 1.629 0 C-N-CA 123.34 0.656 . . . . 62.42 109.673 -169.769 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 114' ' ' LEU . . . . . 0.525 ' HB2' HD13 ' A' ' 109' ' ' LEU . 6.3 tt . . . . . 0 N--CA 1.501 2.115 0 C-N-CA 125.454 1.502 . . . . 73.31 111.267 -172.394 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 1' ' ' MET . . . . . 0.49 ' SD ' ' HB ' ' A' ' 4' ' ' THR . 13.7 tpt . . . . . 0 N--CA 1.482 1.138 0 CA-C-O 119.272 -0.394 . . . . 65.11 111.217 . . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 62.5 m -53.94 -47.4 71.29 Favored 'General case' 0 N--CA 1.489 1.498 0 C-N-CA 124.205 1.002 . . . . 71.25 112.572 -175.388 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 46.9 t -62.69 -38.25 89.68 Favored 'General case' 0 N--CA 1.481 1.124 0 C-N-CA 123.025 0.53 . . . . 50.32 110.656 177.347 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 4' ' ' THR . . . . . 0.49 ' HB ' ' SD ' ' A' ' 1' ' ' MET . 11.9 m -69.35 -33.39 73.02 Favored 'General case' 0 CA--C 1.547 0.853 0 C-N-CA 123.508 0.723 . . . . 73.41 111.059 179.552 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 62.9 t -64.58 -48.56 84.39 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.175 0 C-N-CA 123.504 0.722 . . . . 70.13 109.837 177.376 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 26.7 mm-40 -62.29 -41.03 98.16 Favored 'General case' 0 N--CA 1.477 0.923 0 O-C-N 123.904 0.752 . . . . 74.0 110.896 175.753 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 65.2 t80 -60.99 -46.4 90.9 Favored 'General case' 0 CA--C 1.547 0.855 0 C-N-CA 124.487 1.115 . . . . 63.11 110.937 -176.608 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 8' ' ' ILE . . . . . 0.429 HG13 ' O ' ' A' ' 4' ' ' THR . 85.0 mt -62.14 -52.62 58.09 Favored 'Isoleucine or valine' 0 C--N 1.356 0.882 0 O-C-N 123.778 0.674 . . . . 74.31 109.559 175.906 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 28.4 t-20 -58.67 -34.29 71.08 Favored 'General case' 0 N--CA 1.481 1.118 0 O-C-N 124.177 0.923 . . . . 65.21 111.781 -174.762 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 99.2 mtt180 -78.19 -37.07 46.48 Favored 'General case' 0 N--CA 1.471 0.616 0 C-N-CA 123.039 0.535 . . . . 72.44 111.021 -179.8 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 11' ' ' TRP . . . . . . . . . . . . . 51.3 m95 -71.59 -25.8 62.33 Favored 'General case' 0 N--CA 1.484 1.226 0 N-CA-C 111.549 0.203 . . . . 74.35 111.549 172.518 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 12' ' ' GLN . . . . . 0.506 ' HG2' ' CE2' ' A' ' 67' ' ' TYR . 53.0 mt-30 -67.25 -44.81 78.49 Favored 'General case' 0 C--O 1.208 -1.101 0 N-CA-C 108.163 -1.051 . . . . 73.45 108.163 170.399 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 15.0 tpt180 -60.48 -44.17 96.19 Favored 'General case' 0 CA--C 1.545 0.762 0 O-C-N 124.152 0.908 . . . . 71.33 110.816 -177.042 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 14' ' ' ILE . . . . . 0.431 HD11 HG21 ' A' ' 47' ' ' VAL . 58.3 mt -68.32 -45.84 81.89 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.997 0 C-N-CA 122.601 0.36 . . . . 74.3 110.035 177.916 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 15' ' ' ALA . . . . . 0.579 ' HA ' ' HB ' ' A' ' 71' ' ' THR . . . -56.87 -49.0 76.81 Favored 'General case' 0 N--CA 1.484 1.251 0 C-N-CA 123.76 0.824 . . . . 64.02 111.551 -179.976 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 96.8 mt -73.33 -43.71 60.3 Favored 'General case' 0 N--CA 1.475 0.802 0 CA-C-N 114.422 -1.263 . . . . 71.45 110.675 -173.154 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.493 ' O ' ' HG ' ' A' ' 21' ' ' LEU . 40.7 mt -61.05 -53.53 56.03 Favored 'General case' 0 N--CA 1.481 1.077 0 O-C-N 123.606 0.566 . . . . 74.11 110.566 178.68 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 87.2 p -65.69 -33.55 76.14 Favored 'General case' 0 N--CA 1.478 0.953 0 O-C-N 123.682 0.614 . . . . 45.2 111.231 -176.04 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 6.7 tp-100 -69.11 -37.32 78.32 Favored 'General case' 0 N--CA 1.479 0.975 0 C-N-CA 122.845 0.458 . . . . 53.24 110.836 175.601 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 68.9 m -70.05 -33.24 71.7 Favored 'General case' 0 CA--C 1.539 0.542 0 CA-C-N 115.826 -0.624 . . . . 63.03 110.66 174.423 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 21' ' ' LEU . . . . . 0.622 HD22 ' HA ' ' A' ' 33' ' ' LEU . 50.5 mt -73.91 -29.2 61.93 Favored 'General case' 0 N--CA 1.474 0.755 0 C-N-CA 123.146 0.578 . . . . 65.14 110.044 178.294 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 22' ' ' LEU . . . . . 0.709 ' HA ' HD21 ' A' ' 78' ' ' LEU . 50.3 tp -67.29 -48.46 67.58 Favored 'General case' 0 N--CA 1.47 0.545 0 C-N-CA 123.366 0.666 . . . . 71.41 109.357 174.425 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 38.3 mm-40 -51.06 -59.4 4.21 Favored 'General case' 0 N--CA 1.47 0.555 0 C-N-CA 124.169 0.988 . . . . 74.21 111.374 173.263 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 93.6 mt -59.09 -46.54 88.02 Favored 'General case' 0 CA--C 1.539 0.548 0 O-C-N 124.233 0.958 . . . . 55.4 111.358 -175.585 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 25' ' ' ALA . . . . . 0.525 ' HB2' HD21 ' A' ' 33' ' ' LEU . . . -60.06 -45.24 93.53 Favored 'General case' 0 N--CA 1.48 1.038 0 C-N-CA 123.413 0.685 . . . . 73.12 112.047 -177.915 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 97.1 mt-30 -67.04 -32.03 72.96 Favored 'General case' 0 N--CA 1.483 1.2 0 C-N-CA 123.169 0.587 . . . . 73.1 111.269 178.15 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 92.5 mtt-85 -83.97 -2.2 56.13 Favored 'General case' 0 N--CA 1.479 1.005 0 C-N-CA 123.591 0.757 . . . . 72.51 111.239 176.716 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 92.7 2.33 67.34 Favored Glycine 0 C--N 1.356 1.679 0 C-N-CA 123.37 0.509 . . . . 71.02 114.2 171.256 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 58.9 mm-40 -83.66 70.01 10.24 Favored 'General case' 0 CA--C 1.548 0.896 0 C-N-CA 124.123 0.969 . . . . 75.35 111.563 -179.827 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 30' ' ' TRP . . . . . . . . . . . . . 65.3 m95 -69.93 -39.31 76.19 Favored 'General case' 0 N--CA 1.482 1.173 0 C-N-CA 123.983 0.913 . . . . 72.33 111.628 -176.626 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 18.2 m-20 -62.06 -31.9 72.36 Favored 'General case' 0 N--CA 1.477 0.901 0 CA-C-N 115.517 -0.765 . . . . 74.53 111.001 -177.616 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 62.1 mt -70.69 -28.03 64.46 Favored 'General case' 0 CA--C 1.542 0.663 0 C-N-CA 122.569 0.347 . . . . 64.13 111.021 178.677 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 33' ' ' LEU . . . . . 0.622 ' HA ' HD22 ' A' ' 21' ' ' LEU . 10.1 mp -66.9 -47.55 71.43 Favored 'General case' 0 N--CA 1.493 1.69 0 C-N-CA 122.799 0.439 . . . . 70.55 109.913 169.724 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 80.2 mt -61.74 -33.62 74.37 Favored 'General case' 0 N--CA 1.481 1.118 0 O-C-N 124.282 0.989 . . . . 55.22 111.677 -178.777 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -70.8 -55.9 7.54 Favored 'General case' 0 N--CA 1.477 0.905 0 C-N-CA 123.716 0.806 . . . . 62.43 109.58 175.396 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 36' ' ' GLN . . . . . 0.435 ' HB2' HD21 ' A' ' 21' ' ' LEU . 89.6 mm-40 -66.03 -12.69 56.99 Favored 'General case' 0 N--CA 1.482 1.128 0 O-C-N 123.84 0.713 . . . . 61.23 112.742 -176.873 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 37' ' ' GLU . . . . . 0.542 ' O ' ' HG ' ' A' ' 41' ' ' LEU . 43.3 tt0 -47.87 -40.41 21.47 Favored 'General case' 0 C--O 1.211 -0.95 0 C-N-CA 123.941 0.896 . . . . 73.12 111.656 172.87 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 43.1 t -58.22 -48.89 83.53 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.521 0 C-N-CA 123.052 0.541 . . . . 64.42 110.935 178.838 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 23.3 m -66.24 -38.96 89.15 Favored 'General case' 0 N--CA 1.475 0.786 0 CA-C-N 115.139 -0.937 . . . . 62.45 111.167 178.558 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 36.3 t80 -57.28 -52.05 66.9 Favored 'General case' 0 C--N 1.352 0.69 0 C-N-CA 124.887 1.275 . . . . 72.1 109.164 178.749 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 41' ' ' LEU . . . . . 0.542 ' HG ' ' O ' ' A' ' 37' ' ' GLU . 17.2 mt -59.38 -58.29 9.26 Favored 'General case' 0 C--N 1.363 1.193 0 O-C-N 124.702 1.251 . . . . 73.31 109.629 -178.601 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 48.1 tt0 -52.21 -49.61 63.58 Favored 'General case' 0 N--CA 1.476 0.828 0 O-C-N 123.994 0.809 . . . . 70.52 111.758 -174.094 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 36.9 m -64.85 -54.36 32.23 Favored 'General case' 0 CA--C 1.549 0.917 0 CA-C-N 115.991 -0.55 . . . . 73.01 111.859 -177.584 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 44' ' ' ILE . . . . . 0.554 HD11 HD11 ' A' ' 102' ' ' LEU . 14.1 tt -65.42 -36.23 77.2 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.105 0 C-N-CA 123.162 0.585 . . . . 64.31 111.238 -173.328 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 12.5 mm-40 -64.57 -47.36 79.02 Favored 'General case' 0 C--N 1.348 0.508 0 C-N-CA 123.773 0.829 . . . . 73.22 110.058 174.898 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 87.1 m -62.87 -26.1 68.61 Favored 'General case' 0 N--CA 1.477 0.902 0 O-C-N 123.443 0.464 . . . . 64.34 111.593 -179.314 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 47' ' ' VAL . . . . . 0.431 HG21 HD11 ' A' ' 14' ' ' ILE . 63.0 t -73.64 -54.05 16.29 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.008 0 O-C-N 122.173 -0.329 . . . . 72.5 110.906 172.831 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 48' ' ' MET . . . . . . . . . . . . . 70.4 mtm -72.22 -24.17 61.35 Favored 'General case' 0 N--CA 1.487 1.389 0 C-N-CA 123.104 0.562 . . . . 70.13 112.215 -171.324 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 32.7 mm-40 -82.34 -24.5 34.52 Favored 'General case' 0 N--CA 1.48 1.043 0 C-N-CA 123.96 0.904 . . . . 63.11 111.329 176.607 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 13.7 mptt -97.22 165.27 12.12 Favored 'General case' 0 N--CA 1.479 1.004 0 CA-C-O 121.802 0.81 . . . . 63.01 111.393 -175.663 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 8.5 tt0 -90.76 133.34 35.25 Favored 'General case' 0 C--O 1.24 0.594 0 CA-C-N 113.968 -1.469 . . . . 72.35 110.529 -172.81 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 89.9 m -78.26 127.94 79.67 Favored Pre-proline 0 CA--C 1.553 1.07 0 N-CA-C 108.755 -0.831 . . . . 63.11 108.755 169.754 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 57.0 Cg_endo -68.49 156.8 64.34 Favored 'Trans proline' 0 CA--C 1.562 1.901 0 C-N-CA 122.907 2.405 . . . . 65.31 112.574 176.996 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 7.6 Cg_exo -74.43 -50.06 0.16 Allowed 'Trans proline' 0 C--N 1.374 1.902 0 C-N-CA 122.798 2.332 . . . . 64.23 112.153 173.607 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . -80.86 72.64 2.68 Favored Glycine 0 C--N 1.349 1.274 0 CA-C-N 115.447 -0.797 . . . . 75.21 112.389 -177.141 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 70.0 mt -83.66 -85.01 0.08 OUTLIER 'Isoleucine or valine' 0 CA--C 1.559 1.291 0 N-CA-C 108.574 -0.898 . . . . 72.24 108.574 178.507 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 36.8 p 138.18 163.32 0.0 OUTLIER 'General case' 0 N--CA 1.495 1.794 0 C-N-CA 131.201 3.8 . . . . 73.51 107.165 167.342 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 46.0 tpt85 -60.28 -52.28 65.97 Favored 'General case' 0 CA--C 1.549 0.934 0 C-N-CA 123.82 0.848 . . . . 53.41 111.996 -174.084 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 43.4 m -63.95 -36.61 84.52 Favored 'General case' 0 N--CA 1.476 0.85 0 C-N-CA 123.426 0.691 . . . . 41.14 112.07 -178.646 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 78.1 mt -71.15 -35.17 57.48 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.645 0 CA-C-N 116.339 -0.392 . . . . 74.42 110.06 178.038 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 57.7 tt0 -60.88 -38.77 86.78 Favored 'General case' 0 CA--C 1.543 0.693 0 C-N-CA 123.123 0.569 . . . . 73.35 109.899 175.05 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 44.4 m-20 -65.35 -42.69 92.56 Favored 'General case' 0 N--CA 1.479 0.987 0 CA-C-N 115.909 -0.587 . . . . 73.43 112.045 175.088 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 63' ' ' MET . . . . . . . . . . . . . 71.3 mtm -68.18 -49.36 61.4 Favored 'General case' 0 N--CA 1.484 1.259 0 C-N-CA 122.566 0.346 . . . . 53.42 111.6 -178.933 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 64' ' ' VAL . . . . . 0.455 ' O ' HG13 ' A' ' 68' ' ' ILE . 70.8 t -60.14 -56.91 14.37 Favored 'Isoleucine or valine' 0 C--N 1.35 0.607 0 C-N-CA 123.879 0.872 . . . . 60.54 110.675 177.518 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -62.38 -28.2 69.61 Favored 'General case' 0 N--CA 1.489 1.498 0 O-C-N 123.405 0.44 . . . . 64.33 111.282 -179.848 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -63.65 -42.73 98.64 Favored Glycine 0 C--N 1.347 1.154 0 N-CA-C 111.753 -0.539 . . . . 55.32 111.753 172.608 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 67' ' ' TYR . . . . . 0.506 ' CE2' ' HG2' ' A' ' 12' ' ' GLN . 17.1 m-30 -79.59 -27.24 41.12 Favored 'General case' 0 N--CA 1.48 1.051 0 N-CA-C 112.855 0.687 . . . . 74.03 112.855 -179.621 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 68' ' ' ILE . . . . . 0.525 ' O ' ' HG ' ' A' ' 72' ' ' LEU . 38.9 mt -66.29 -49.59 74.63 Favored 'Isoleucine or valine' 0 C--N 1.35 0.592 0 N-CA-C 107.405 -1.331 . . . . 35.42 107.405 171.581 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 69' ' ' LYS . . . . . 0.659 ' HB2' ' HE2' ' A' ' 106' ' ' TYR . 0.3 OUTLIER -54.78 -46.75 74.46 Favored 'General case' 0 C--N 1.356 0.872 0 O-C-N 123.989 0.805 . . . . 71.23 110.619 177.66 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 62.0 tt0 -57.43 -51.11 70.75 Favored 'General case' 0 C--N 1.349 0.569 0 O-C-N 124.926 1.391 . . . . 71.34 110.506 -178.843 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 71' ' ' THR . . . . . 0.579 ' HB ' ' HA ' ' A' ' 15' ' ' ALA . 12.8 t -72.57 -19.67 61.45 Favored 'General case' 0 C--O 1.215 -0.757 0 CA-C-O 118.566 -0.731 . . . . 73.11 111.607 -179.199 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 72' ' ' LEU . . . . . 0.716 HD21 ' HB3' ' A' ' 102' ' ' LEU . 17.0 mt -79.74 -28.78 40.44 Favored 'General case' 0 N--CA 1.49 1.566 0 C-N-CA 122.945 0.498 . . . . 70.32 111.499 174.559 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 29.8 m-20 -65.53 -53.24 45.07 Favored 'General case' 0 N--CA 1.473 0.719 0 N-CA-C 107.882 -1.155 . . . . 62.24 107.882 170.519 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 35.0 m-20 -61.54 -33.53 73.99 Favored 'General case' 0 N--CA 1.477 0.879 0 CA-C-N 114.666 -1.152 . . . . 64.1 110.961 179.553 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 75' ' ' GLU . . . . . 0.455 ' O ' ' HG2' ' A' ' 79' ' ' LYS . 27.2 tp10 -61.84 -60.63 3.36 Favored 'General case' 0 N--CA 1.474 0.737 0 C-N-CA 124.238 1.015 . . . . 73.01 109.455 176.876 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 10.3 tt0 -63.5 -36.34 83.45 Favored 'General case' 0 CA--C 1.545 0.787 0 CA-C-N 116.108 -0.496 . . . . 72.23 111.862 -175.715 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 77' ' ' LEU . . . . . 0.431 ' O ' ' HB2' ' A' ' 81' ' ' LEU . 93.1 mt -68.22 -54.42 17.92 Favored 'General case' 0 N--CA 1.471 0.594 0 C-N-CA 122.84 0.456 . . . . 72.24 110.537 -179.281 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 78' ' ' LEU . . . . . 0.709 HD21 ' HA ' ' A' ' 22' ' ' LEU . 51.0 mt -62.24 -52.66 62.84 Favored 'General case' 0 N--CA 1.484 1.248 0 C-N-CA 122.979 0.512 . . . . 71.4 112.08 -178.532 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 79' ' ' LYS . . . . . 0.455 ' HG2' ' O ' ' A' ' 75' ' ' GLU . 26.3 mmtp -73.87 -28.08 61.39 Favored 'General case' 0 N--CA 1.476 0.86 0 O-C-N 123.716 0.635 . . . . 73.31 110.805 -173.81 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -75.42 -24.19 71.38 Favored Glycine 0 C--N 1.344 1.019 0 CA-C-N 116.02 -0.536 . . . . 64.31 112.287 171.285 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 81' ' ' LEU . . . . . 0.431 ' HB2' ' O ' ' A' ' 77' ' ' LEU . 5.1 tt -80.51 -41.96 23.33 Favored 'General case' 0 N--CA 1.475 0.791 0 C-N-CA 123.662 0.785 . . . . 71.41 109.829 178.087 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 96.4 mt . . . . . 0 N--CA 1.475 0.799 0 N-CA-C 109.754 -0.461 . . . . 71.21 109.754 -173.131 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 80.3 mt . . . . . 0 N--CA 1.469 0.516 0 N-CA-C 107.946 -1.131 . . . . 71.32 107.946 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 93' ' ' ILE . . . . . 0.482 HG22 ' HG2' ' A' ' 95' ' ' GLN . 43.8 mt -128.24 138.02 55.82 Favored 'Isoleucine or valine' 0 C--O 1.241 0.625 0 N-CA-C 107.53 -1.285 . . . . 73.41 107.53 177.383 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -63.08 -30.59 77.94 Favored Glycine 0 C--N 1.353 1.481 0 O-C-N 124.114 0.884 . . . . 64.14 114.362 -171.671 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 95' ' ' GLN . . . . . 0.482 ' HG2' HG22 ' A' ' 93' ' ' ILE . 30.0 pt20 -73.12 -0.29 13.68 Favored 'General case' 0 N--CA 1.486 1.343 0 C-N-CA 123.338 0.655 . . . . 74.45 112.407 178.437 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 20.9 m 66.12 30.27 9.48 Favored 'General case' 0 C--N 1.358 0.96 0 C-N-CA 124.987 1.315 . . . . 75.13 111.978 171.503 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 14.9 t -74.6 14.11 0.52 Allowed 'General case' 0 N--CA 1.481 1.106 0 C-N-CA 123.679 0.792 . . . . 72.24 112.923 -176.265 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 98' ' ' ARG . . . . . 0.401 ' O ' HD13 ' A' ' 102' ' ' LEU . 60.6 ttp180 -53.57 -53.09 56.7 Favored 'General case' 0 N--CA 1.476 0.857 0 C-N-CA 124.377 1.071 . . . . 63.24 111.622 179.145 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 99' ' ' GLN . . . . . 0.409 HE22 ' HG3' ' A' ' 75' ' ' GLU . 9.7 mm100 -61.94 -47.0 86.87 Favored 'General case' 0 N--CA 1.479 0.997 0 CA-C-O 121.488 0.661 . . . . 70.13 109.63 -176.76 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 38.9 ttmt -62.36 -40.53 96.73 Favored 'General case' 0 CA--C 1.54 0.584 0 CA-C-N 113.781 -1.554 . . . . 61.34 111.729 -178.385 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 38.7 t -71.95 -44.37 63.7 Favored 'General case' 0 N--CA 1.474 0.737 0 C-N-CA 123.753 0.821 . . . . 55.52 110.942 -172.464 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 102' ' ' LEU . . . . . 0.716 ' HB3' HD21 ' A' ' 72' ' ' LEU . 8.9 mp -72.08 -37.57 69.57 Favored 'General case' 0 CA--C 1.546 0.819 0 CA-C-N 115.314 -0.857 . . . . 51.14 110.682 -179.662 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 9.8 t30 -68.82 -31.9 71.21 Favored 'General case' 0 N--CA 1.48 1.051 0 CA-C-N 115.698 -0.683 . . . . 74.52 110.503 176.176 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 49.0 t30 -74.47 -36.11 63.3 Favored 'General case' 0 N--CA 1.482 1.173 0 C-N-CA 123.596 0.759 . . . . 52.52 110.017 176.947 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -61.21 -49.59 76.52 Favored 'General case' 0 N--CA 1.475 0.794 0 C-N-CA 123.057 0.543 . . . . 53.03 110.134 177.4 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 106' ' ' TYR . . . . . 0.659 ' HE2' ' HB2' ' A' ' 69' ' ' LYS . 1.7 t80 -63.85 -48.88 74.97 Favored 'General case' 0 C--N 1.354 0.795 0 O-C-N 123.993 0.808 . . . . 72.35 109.472 175.62 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -56.93 -38.3 83.91 Favored Glycine 0 C--N 1.35 1.31 0 O-C-N 124.017 0.823 . . . . 35.42 113.772 -173.691 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 70.8 mtm180 -75.63 -42.82 50.61 Favored 'General case' 0 C--O 1.239 0.545 0 C-N-CA 123.386 0.674 . . . . 75.03 110.533 176.767 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 32.7 tp -61.82 -28.27 69.35 Favored 'General case' 0 N--CA 1.491 1.578 0 C-N-CA 123.141 0.576 . . . . 72.13 110.894 177.251 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 39.5 t -83.08 -38.62 22.26 Favored 'General case' 0 N--CA 1.452 -0.363 0 CA-C-N 114.711 -1.131 . . . . 62.21 109.449 178.144 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . -79.09 -64.99 1.85 Allowed Glycine 0 C--N 1.356 1.643 0 CA-C-O 119.214 -0.77 . . . . 50.13 113.558 -173.228 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 112' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -99.32 -66.53 0.9 Allowed 'General case' 0 N--CA 1.485 1.3 0 CA-C-N 118.793 1.297 . . . . 70.21 109.525 172.637 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER 170.43 27.31 0.0 OUTLIER 'General case' 0 CA--C 1.573 1.831 0 O-C-N 124.712 1.258 . . . . 74.02 109.626 -171.633 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 N--CA 1.501 2.109 0 C-N-CA 125.92 1.688 . . . . 72.04 111.368 -178.324 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 25.9 ttt . . . . . 0 CA--C 1.555 1.162 0 CA-C-O 119.621 -0.228 . . . . 73.5 110.906 . . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 4.6 p -53.85 -35.33 61.39 Favored 'General case' 0 N--CA 1.489 1.477 0 C-N-CA 123.501 0.72 . . . . 70.44 112.471 -178.957 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 63.5 p -62.22 -48.07 81.62 Favored 'General case' 0 N--CA 1.48 1.069 0 C-N-CA 123.701 0.8 . . . . 72.32 110.555 176.524 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 22.1 m -66.26 -37.63 85.93 Favored 'General case' 0 CA--C 1.54 0.594 0 CA-C-N 115.023 -0.99 . . . . 75.13 111.194 -179.876 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 78.1 t -65.75 -44.63 93.11 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.936 0 C-N-CA 123.192 0.597 . . . . 54.1 110.433 -179.175 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 11.7 mm-40 -61.54 -41.57 97.54 Favored 'General case' 0 C--N 1.353 0.761 0 O-C-N 123.581 0.551 . . . . 73.43 110.703 173.782 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 44.6 t80 -63.05 -47.85 81.18 Favored 'General case' 0 N--CA 1.481 1.101 0 C-N-CA 123.852 0.861 . . . . 75.44 111.439 -176.958 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 8' ' ' ILE . . . . . 0.434 HD11 HG23 ' A' ' 60' ' ' ILE . 73.1 mt -65.0 -41.54 92.37 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.033 0 C-N-CA 123.682 0.793 . . . . 74.1 109.541 177.472 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 4.0 t-20 -65.76 -29.15 69.62 Favored 'General case' 0 N--CA 1.479 1.022 0 C-N-CA 123.756 0.822 . . . . 72.51 111.104 179.23 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 10' ' ' ARG . . . . . 0.749 ' HB3' HG22 ' A' ' 47' ' ' VAL . 57.6 mtt180 -78.55 -30.64 46.99 Favored 'General case' 0 N--CA 1.469 0.477 0 C-N-CA 123.689 0.796 . . . . 74.13 110.381 177.431 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 11' ' ' TRP . . . . . 0.479 ' HH2' ' HG ' ' A' ' 102' ' ' LEU . 76.8 m95 -74.98 -27.57 60.21 Favored 'General case' 0 N--CA 1.477 0.902 0 CA-C-O 119.492 -0.29 . . . . 61.13 110.945 170.381 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 12' ' ' GLN . . . . . 0.426 ' HG3' ' O ' ' A' ' 8' ' ' ILE . 51.5 mt-30 -64.49 -44.18 91.8 Favored 'General case' 0 C--O 1.212 -0.896 0 N-CA-C 107.744 -1.206 . . . . 64.14 107.744 168.959 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 30.9 tpt180 -59.04 -50.98 72.02 Favored 'General case' 0 CA--C 1.547 0.862 0 O-C-N 124.087 0.867 . . . . 74.35 110.689 -177.222 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 56.4 mt -63.97 -49.53 81.26 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.313 0 C-N-CA 122.666 0.387 . . . . 63.52 110.335 179.187 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 15' ' ' ALA . . . . . 0.558 ' HA ' ' HB ' ' A' ' 71' ' ' THR . . . -59.06 -43.51 91.72 Favored 'General case' 0 N--CA 1.485 1.31 0 C-N-CA 123.864 0.865 . . . . 71.02 112.115 -176.373 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 95.1 mt -77.41 -39.6 46.49 Favored 'General case' 0 N--CA 1.481 1.082 0 CA-C-N 115.248 -0.887 . . . . 75.34 110.658 -174.848 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.509 ' O ' ' HG ' ' A' ' 21' ' ' LEU . 53.9 mt -64.45 -47.04 80.55 Favored 'General case' 0 N--CA 1.483 1.186 0 O-C-N 123.302 0.377 . . . . 75.23 110.511 179.718 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 18' ' ' SER . . . . . 0.424 ' HB3' ' CE1' ' A' ' 40' ' ' TYR . 71.7 p -68.65 -35.5 77.34 Favored 'General case' 0 N--CA 1.477 0.882 0 O-C-N 123.768 0.667 . . . . 71.51 111.143 178.592 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 19' ' ' GLN . . . . . 0.491 ' O ' ' HG2' ' A' ' 23' ' ' GLU . 6.3 tp-100 -62.41 -41.17 98.48 Favored 'General case' 0 C--N 1.357 0.913 0 O-C-N 123.586 0.554 . . . . 74.41 109.878 174.702 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 68.6 m -63.37 -49.19 74.81 Favored 'General case' 0 C--N 1.352 0.702 0 O-C-N 123.818 0.699 . . . . 71.34 109.288 175.564 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 21' ' ' LEU . . . . . 0.509 ' HG ' ' O ' ' A' ' 17' ' ' LEU . 83.8 mt -57.22 -31.53 65.59 Favored 'General case' 0 N--CA 1.479 1.016 0 C-N-CA 123.811 0.844 . . . . 64.33 110.665 179.995 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 22' ' ' LEU . . . . . 0.553 ' HA ' HD21 ' A' ' 78' ' ' LEU . 37.9 tp -73.33 -52.45 13.84 Favored 'General case' 0 CA--C 1.543 0.674 0 O-C-N 123.862 0.727 . . . . 64.24 110.727 178.491 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 23' ' ' GLU . . . . . 0.573 ' HB3' ' NH1' ' A' ' 27' ' ' ARG . 46.5 mm-40 -51.79 -55.2 21.21 Favored 'General case' 0 N--CA 1.491 1.586 0 CA-C-O 122.159 0.981 . . . . 72.12 110.454 177.734 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 70.4 mt -56.36 -51.36 68.59 Favored 'General case' 0 CA--C 1.545 0.77 0 CA-C-N 112.878 -1.965 . . . . 74.32 110.425 179.79 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 25' ' ' ALA . . . . . 0.504 ' HB2' HD21 ' A' ' 33' ' ' LEU . . . -60.91 -41.52 96.26 Favored 'General case' 0 N--CA 1.49 1.527 0 C-N-CA 123.396 0.679 . . . . 70.42 112.68 -175.962 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 94.6 mt-30 -64.51 -38.22 90.27 Favored 'General case' 0 N--CA 1.478 0.943 0 C-N-CA 123.537 0.735 . . . . 71.3 110.264 179.265 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 27' ' ' ARG . . . . . 0.573 ' NH1' ' HB3' ' A' ' 23' ' ' GLU . 58.0 mtt180 -81.65 -15.66 53.85 Favored 'General case' 0 N--CA 1.488 1.453 0 N-CA-C 112.306 0.484 . . . . 71.23 112.306 175.517 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 88.79 24.93 31.21 Favored Glycine 0 C--N 1.349 1.305 0 N-CA-C 114.527 0.571 . . . . 74.55 114.527 177.417 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 49.7 mm-40 -84.33 60.55 6.05 Favored 'General case' 0 N--CA 1.477 0.895 0 C-N-CA 124.239 1.016 . . . . 64.22 110.699 175.491 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 30' ' ' TRP . . . . . 0.471 ' O ' ' HG ' ' A' ' 34' ' ' LEU . 88.5 m95 -66.17 -30.57 71.07 Favored 'General case' 0 N--CA 1.477 0.88 0 C-N-CA 123.911 0.884 . . . . 74.54 112.575 -171.952 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 4.8 m-20 -61.18 -40.64 94.65 Favored 'General case' 0 N--CA 1.483 1.197 0 C-N-CA 123.332 0.653 . . . . 74.41 110.563 175.642 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 64.2 mt -71.6 -26.54 62.63 Favored 'General case' 0 CA--C 1.543 0.683 0 CA-C-N 115.211 -0.904 . . . . 61.02 110.396 179.842 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 33' ' ' LEU . . . . . 0.504 HD21 ' HB2' ' A' ' 25' ' ' ALA . 7.6 mp -66.29 -44.59 83.11 Favored 'General case' 0 N--CA 1.489 1.492 0 N-CA-C 110.476 -0.194 . . . . 62.54 110.476 169.039 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.471 ' HG ' ' O ' ' A' ' 30' ' ' TRP . 83.0 mt -63.63 -34.53 78.04 Favored 'General case' 0 N--CA 1.48 1.058 0 O-C-N 123.896 0.747 . . . . 74.44 111.124 -178.548 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 96.8 mt-30 -65.71 -58.04 6.62 Favored 'General case' 0 N--CA 1.483 1.186 0 CA-C-O 121.168 0.508 . . . . 63.41 110.033 174.687 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 36' ' ' GLN . . . . . 0.422 ' HB2' HD21 ' A' ' 21' ' ' LEU . 80.1 mm-40 -73.82 -10.39 59.62 Favored 'General case' 0 N--CA 1.477 0.896 0 CA-C-N 114.885 -1.052 . . . . 54.11 112.654 -174.207 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 37.1 tt0 -53.38 -52.31 59.7 Favored 'General case' 0 N--CA 1.475 0.79 0 C-N-CA 124.591 1.156 . . . . 73.44 110.692 175.224 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 46.8 t -58.7 -43.97 88.89 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.141 0 O-C-N 123.76 0.662 . . . . 75.23 110.179 -179.18 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 42.7 m -56.95 -53.23 60.4 Favored 'General case' 0 CA--C 1.546 0.809 0 CA-C-N 115.403 -0.817 . . . . 74.2 111.631 176.211 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 40' ' ' TYR . . . . . 0.424 ' CE1' ' HB3' ' A' ' 18' ' ' SER . 58.2 t80 -63.0 -49.62 73.94 Favored 'General case' 0 N--CA 1.474 0.758 0 C-N-CA 123.797 0.839 . . . . 71.55 111.159 -173.502 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 41' ' ' LEU . . . . . 0.763 ' HB3' HD21 ' A' ' 92' ' ' LEU . 72.2 mt -60.23 -48.34 82.15 Favored 'General case' 0 C--O 1.257 1.486 0 C-N-CA 124.48 1.112 . . . . 72.12 111.285 -178.022 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 49.8 tt0 -61.07 -44.03 98.0 Favored 'General case' 0 N--CA 1.475 0.786 0 CA-C-N 115.557 -0.747 . . . . 73.15 110.43 -179.85 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 43' ' ' SER . . . . . 0.518 ' O ' HG23 ' A' ' 47' ' ' VAL . 69.4 m -60.94 -57.7 11.56 Favored 'General case' 0 C--N 1.354 0.767 0 CA-C-N 115.378 -0.828 . . . . 73.42 111.442 -178.511 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 3.9 tt -58.38 -41.22 80.84 Favored 'Isoleucine or valine' 0 C--O 1.251 1.156 0 C-N-CA 123.266 0.626 . . . . 72.15 111.375 -174.682 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 45' ' ' GLU . . . . . 0.406 ' CG ' HD22 ' A' ' 92' ' ' LEU . 40.9 mm-40 -59.19 -49.8 76.47 Favored 'General case' 0 C--N 1.367 1.333 0 N-CA-C 111.542 0.201 . . . . 75.11 111.542 173.442 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 46' ' ' THR . . . . . 0.49 ' O ' ' HD3' ' A' ' 50' ' ' LYS . 97.3 m -55.72 -41.78 74.36 Favored 'General case' 0 N--CA 1.482 1.155 0 O-C-N 123.958 0.786 . . . . 55.45 111.617 -178.292 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 47' ' ' VAL . . . . . 0.749 HG22 ' HB3' ' A' ' 10' ' ' ARG . 26.2 t -70.05 -37.71 73.04 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.997 0 C-N-CA 122.884 0.474 . . . . 73.33 110.623 -177.94 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 48' ' ' MET . . . . . . . . . . . . . 79.1 mtm -72.22 -19.93 61.64 Favored 'General case' 0 N--CA 1.481 1.113 0 CA-C-N 116.183 -0.462 . . . . 71.21 111.76 175.375 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 48.2 mt-10 -83.02 -7.47 59.66 Favored 'General case' 0 N--CA 1.49 1.57 0 C-N-CA 123.285 0.634 . . . . 74.11 111.759 172.918 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 50' ' ' LYS . . . . . 0.49 ' HD3' ' O ' ' A' ' 46' ' ' THR . 12.7 mptt -95.44 132.0 40.98 Favored 'General case' 0 N--CA 1.482 1.169 0 C-N-CA 123.485 0.714 . . . . 72.52 110.235 177.691 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 34.2 tt0 -68.57 151.99 45.99 Favored 'General case' 0 C--O 1.247 0.923 0 C-N-CA 123.524 0.729 . . . . 74.5 109.389 172.787 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 20.0 m -59.69 118.85 35.3 Favored Pre-proline 0 CA--C 1.556 1.185 0 CA-C-O 118.744 -0.646 . . . . 73.32 109.792 173.471 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 53' ' ' PRO . . . . . 0.511 ' HD2' HD11 ' A' ' 56' ' ' ILE . 31.6 Cg_exo -62.72 153.62 71.1 Favored 'Trans proline' 0 C--N 1.377 2.075 0 C-N-CA 122.602 2.202 . . . . 55.12 112.79 177.844 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 54' ' ' PRO . . . . . 0.445 ' HD3' ' HA ' ' A' ' 53' ' ' PRO . 22.7 Cg_exo -66.98 -47.98 2.14 Favored 'Trans proline' 0 C--N 1.373 1.861 0 C-N-CA 123.199 2.599 . . . . 73.35 112.506 177.591 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . -83.94 59.86 4.91 Favored Glycine 0 C--N 1.346 1.092 0 CA-C-N 115.966 -0.561 . . . . 62.33 114.07 -173.233 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 56' ' ' ILE . . . . . 0.511 HD11 ' HD2' ' A' ' 53' ' ' PRO . 56.1 mt -100.72 116.23 43.79 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.763 0 N-CA-C 108.133 -1.062 . . . . 44.44 108.133 169.971 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 57' ' ' THR . . . . . 0.423 ' H ' HD12 ' A' ' 60' ' ' ILE . 71.6 p -101.73 -166.88 1.34 Allowed 'General case' 0 CA--C 1.545 0.763 0 C-N-CA 124.178 0.991 . . . . 62.32 109.523 177.634 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 16.6 tpt85 -61.25 -63.42 1.29 Allowed 'General case' 0 N--CA 1.474 0.773 0 C-N-CA 123.715 0.806 . . . . 75.11 111.017 -179.828 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 26.0 m -54.73 -38.0 66.6 Favored 'General case' 0 N--CA 1.482 1.142 0 C-N-CA 123.482 0.713 . . . . 62.02 111.778 -178.41 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 60' ' ' ILE . . . . . 0.434 HG23 HD11 ' A' ' 8' ' ' ILE . 80.2 mt -63.51 -46.72 94.35 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.703 0 C-N-CA 123.481 0.712 . . . . 72.14 110.655 178.079 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 61' ' ' GLN . . . . . 0.535 ' HG3' ' HG ' ' A' ' 109' ' ' LEU . 50.9 tt0 -61.77 -39.35 91.36 Favored 'General case' 0 N--CA 1.476 0.849 0 C-N-CA 123.073 0.549 . . . . 63.25 111.106 179.896 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 9.0 m-20 -69.15 -37.42 78.23 Favored 'General case' 0 N--CA 1.479 1.002 0 C-N-CA 123.175 0.59 . . . . 74.02 111.944 179.298 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 63' ' ' MET . . . . . . . . . . . . . 72.1 mtm -68.42 -49.79 57.46 Favored 'General case' 0 N--CA 1.48 1.029 0 C-N-CA 122.41 0.284 . . . . 74.05 110.564 177.477 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 64' ' ' VAL . . . . . 0.513 ' O ' HG13 ' A' ' 68' ' ' ILE . 60.6 t -60.49 -59.76 3.65 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.664 0 C-N-CA 123.873 0.869 . . . . 71.04 110.216 -179.87 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 65' ' ' ALA . . . . . 0.568 ' HB2' HD23 ' A' ' 109' ' ' LEU . . . -60.36 -38.56 84.23 Favored 'General case' 0 N--CA 1.483 1.179 0 O-C-N 123.635 0.584 . . . . 64.02 111.571 -179.24 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -58.59 -42.36 96.06 Favored Glycine 0 C--N 1.35 1.307 0 O-C-N 123.218 0.324 . . . . 70.03 112.457 175.961 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 67' ' ' TYR . . . . . 0.428 ' O ' HG22 ' A' ' 71' ' ' THR . 12.3 m-85 -70.35 -36.26 74.08 Favored 'General case' 0 N--CA 1.473 0.702 0 C-N-CA 123.083 0.553 . . . . 72.12 111.681 177.007 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 68' ' ' ILE . . . . . 0.513 HG13 ' O ' ' A' ' 64' ' ' VAL . 65.0 mt -60.02 -56.61 16.31 Favored 'Isoleucine or valine' 0 C--N 1.361 1.072 0 N-CA-C 108.852 -0.796 . . . . 75.23 108.852 177.785 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 69' ' ' LYS . . . . . 0.498 ' HB2' ' HE2' ' A' ' 106' ' ' TYR . 28.3 tptp -53.69 -47.27 70.63 Favored 'General case' 0 C--N 1.354 0.771 0 O-C-N 124.283 0.989 . . . . 75.42 110.001 179.997 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 10.3 tt0 -58.93 -48.04 82.89 Favored 'General case' 0 C--N 1.35 0.603 0 O-C-N 124.653 1.221 . . . . 75.35 111.364 -176.292 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 71' ' ' THR . . . . . 0.558 ' HB ' ' HA ' ' A' ' 15' ' ' ALA . 10.5 t -76.99 -22.68 52.79 Favored 'General case' 0 N--CA 1.475 0.805 0 O-C-N 123.433 0.458 . . . . 63.45 111.234 -175.949 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 72' ' ' LEU . . . . . 0.512 ' HG ' ' O ' ' A' ' 68' ' ' ILE . 21.1 mt -74.08 -34.81 64.12 Favored 'General case' 0 N--CA 1.476 0.845 0 O-C-N 123.261 0.351 . . . . 63.31 110.261 173.756 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 73.4 m-20 -75.39 -38.44 59.94 Favored 'General case' 0 N--CA 1.473 0.679 0 O-C-N 124.092 0.87 . . . . 73.02 110.535 176.492 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 74' ' ' ASN . . . . . 0.424 ' O ' ' HG ' ' A' ' 78' ' ' LEU . 92.4 m-20 -60.25 -51.87 67.71 Favored 'General case' 0 N--CA 1.48 1.068 0 N-CA-C 109.112 -0.699 . . . . 73.2 109.112 176.819 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 5.4 tt0 -59.95 -42.83 94.9 Favored 'General case' 0 C--N 1.356 0.872 0 CA-C-N 115.518 -0.764 . . . . 75.23 110.869 176.031 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 51.9 tt0 -57.09 -43.84 82.6 Favored 'General case' 0 N--CA 1.486 1.337 0 C-N-CA 123.985 0.914 . . . . 72.0 111.415 -179.201 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 94.5 mt -70.6 -37.32 73.88 Favored 'General case' 0 CA--C 1.536 0.412 0 CA-C-N 115.112 -0.949 . . . . 64.31 110.814 -179.473 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 78' ' ' LEU . . . . . 0.553 HD21 ' HA ' ' A' ' 22' ' ' LEU . 72.2 mt -64.84 -42.21 95.11 Favored 'General case' 0 N--CA 1.481 1.106 0 O-C-N 123.699 0.625 . . . . 75.14 111.419 174.928 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 47.3 mmtm -74.24 -34.84 63.77 Favored 'General case' 0 N--CA 1.476 0.865 0 C-N-CA 123.139 0.576 . . . . 61.14 110.674 -176.148 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -70.71 -37.11 67.08 Favored Glycine 0 C--N 1.347 1.194 0 O-C-N 123.91 0.756 . . . . 71.41 111.672 175.828 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 6.7 tt -65.57 -56.83 10.15 Favored 'General case' 0 N--CA 1.481 1.109 0 C-N-CA 123.839 0.855 . . . . 71.53 108.881 177.373 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 80.7 mt . . . . . 0 CA--C 1.543 0.696 0 C-N-CA 124.248 1.019 . . . . 61.14 111.934 -178.44 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 92' ' ' LEU . . . . . 0.763 HD21 ' HB3' ' A' ' 41' ' ' LEU . 89.7 mt . . . . . 0 N--CA 1.473 0.681 0 N-CA-C 108.493 -0.929 . . . . 73.53 108.493 . . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 38.3 mt -112.72 -20.32 6.28 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.872 0 C-N-CA 124.852 1.261 . . . . 72.03 108.449 175.434 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 102.35 -62.76 0.48 Allowed Glycine 0 C--N 1.353 1.473 0 CA-C-N 115.962 -0.563 . . . . 72.11 111.915 173.972 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 9.9 pt20 -77.25 -171.81 2.2 Favored 'General case' 0 N--CA 1.482 1.165 0 C-N-CA 123.255 0.622 . . . . 61.52 111.935 -176.942 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 71.7 p -74.81 11.67 1.01 Allowed 'General case' 0 N--CA 1.472 0.647 0 CA-C-O 117.847 -1.073 . . . . 74.1 113.797 -174.944 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 96.0 m -48.58 -42.19 33.0 Favored 'General case' 0 N--CA 1.483 1.199 0 C-N-CA 124.173 0.989 . . . . 72.35 112.397 177.528 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 98' ' ' ARG . . . . . 0.569 ' HD2' HD12 ' A' ' 92' ' ' LEU . 18.5 mtm105 -68.11 -53.65 23.81 Favored 'General case' 0 N--CA 1.475 0.815 0 C-N-CA 124.074 0.95 . . . . 73.45 109.696 -176.687 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 7.7 tp-100 -61.93 -35.16 77.57 Favored 'General case' 0 N--CA 1.477 0.913 0 C-N-CA 124.605 1.162 . . . . 70.22 110.617 -178.226 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -72.75 -39.44 66.83 Favored 'General case' 0 N--CA 1.472 0.656 0 C-N-CA 124.645 1.178 . . . . 73.44 108.966 179.734 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 42.6 t -69.65 -38.3 77.07 Favored 'General case' 0 C--N 1.352 0.678 0 C-N-CA 124.008 0.923 . . . . 75.21 111.585 -176.265 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 102' ' ' LEU . . . . . 0.479 ' HG ' ' HH2' ' A' ' 11' ' ' TRP . 10.8 mp -80.8 -32.7 35.2 Favored 'General case' 0 N--CA 1.472 0.628 0 O-C-N 123.551 0.532 . . . . 62.45 110.649 -179.838 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 25.0 t-20 -68.61 -37.34 79.7 Favored 'General case' 0 N--CA 1.486 1.325 0 CA-C-O 120.975 0.416 . . . . 62.15 109.958 172.852 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 104' ' ' ASN . . . . . 0.667 ' HA ' HH21 ' A' ' 108' ' ' ARG . 28.4 t-20 -65.92 -44.84 83.95 Favored 'General case' 0 C--N 1.356 0.89 0 N-CA-C 108.812 -0.811 . . . . 74.33 108.812 174.661 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -56.5 -41.8 77.29 Favored 'General case' 0 C--N 1.346 0.433 0 O-C-N 124.052 0.845 . . . . 75.43 110.973 178.164 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 106' ' ' TYR . . . . . 0.498 ' HE2' ' HB2' ' A' ' 69' ' ' LYS . 17.2 t80 -68.02 -58.32 4.71 Favored 'General case' 0 CA--C 1.547 0.83 0 C-N-CA 123.339 0.656 . . . . 73.23 110.973 -176.642 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -65.34 -37.04 93.45 Favored Glycine 0 C--N 1.353 1.478 0 CA-C-N 115.797 -0.638 . . . . 53.44 112.413 -173.232 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 108' ' ' ARG . . . . . 0.667 HH21 ' HA ' ' A' ' 104' ' ' ASN . 0.0 OUTLIER -80.34 -22.73 41.14 Favored 'General case' 0 CA--C 1.538 0.507 0 C-N-CA 123.514 0.726 . . . . 73.14 110.673 179.422 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 109' ' ' LEU . . . . . 0.568 HD23 ' HB2' ' A' ' 65' ' ' ALA . 41.0 tp -67.15 -37.24 83.45 Favored 'General case' 0 N--CA 1.498 1.974 0 CA-C-O 121.402 0.62 . . . . 73.55 109.543 170.55 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 30.4 t -70.7 -36.15 73.12 Favored 'General case' 0 CA--C 1.55 0.976 0 CA-C-N 114.418 -1.265 . . . . 51.44 110.295 173.529 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . -90.33 -68.25 1.2 Allowed Glycine 0 C--N 1.371 2.509 0 N-CA-C 115.759 1.064 . . . . 70.54 115.759 -176.511 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 112' ' ' MET . . . . . . . . . . . . . 5.5 tmm? -95.97 -62.99 1.2 Allowed 'General case' 0 N--CA 1.498 1.967 0 CA-C-N 118.911 1.356 . . . . 64.23 111.078 -177.49 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 113' ' ' LEU . . . . . 0.406 HD23 ' HA ' ' A' ' 113' ' ' LEU . 5.8 mt 157.47 66.38 0.0 OUTLIER 'General case' 0 N--CA 1.494 1.749 0 C-N-CA 128.141 2.576 . . . . 63.42 107.198 179.526 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 114' ' ' LEU . . . . . 0.47 ' H ' ' HA ' ' A' ' 109' ' ' LEU . 7.1 tt . . . . . 0 N--CA 1.483 1.211 0 C-N-CA 126.958 2.103 . . . . 72.31 112.698 171.12 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 18.5 ptt? . . . . . 0 N--CA 1.479 1.001 0 CA-C-O 120.923 0.392 . . . . 64.21 110.739 . . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 8.8 t -55.52 -36.22 66.49 Favored 'General case' 0 N--CA 1.487 1.412 0 C-N-CA 123.268 0.627 . . . . 73.12 111.27 -178.205 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 18.4 m -55.11 -50.07 70.16 Favored 'General case' 0 C--N 1.356 0.855 0 C-N-CA 124.382 1.073 . . . . 72.23 110.85 174.416 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 4' ' ' THR . . . . . 0.463 HG21 HD13 ' A' ' 60' ' ' ILE . 24.2 m -69.14 -39.09 79.04 Favored 'General case' 0 C--O 1.217 -0.616 0 CA-C-N 115.19 -0.914 . . . . 73.32 111.741 -177.508 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 74.6 t -61.91 -47.37 93.52 Favored 'Isoleucine or valine' 0 C--O 1.255 1.378 0 C-N-CA 122.698 0.399 . . . . 43.31 110.143 -177.276 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 27.6 mm-40 -61.43 -48.35 81.6 Favored 'General case' 0 C--N 1.351 0.639 0 CA-C-N 115.669 -0.696 . . . . 45.21 110.114 174.862 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 38.4 t80 -54.18 -49.88 68.31 Favored 'General case' 0 N--CA 1.485 1.31 0 C-N-CA 124.633 1.173 . . . . 64.32 111.472 -176.568 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 8' ' ' ILE . . . . . 0.449 HG13 ' O ' ' A' ' 4' ' ' THR . 64.0 mt -64.02 -47.33 90.87 Favored 'Isoleucine or valine' 0 C--N 1.359 0.988 0 C-N-CA 123.506 0.722 . . . . 72.02 110.123 179.624 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 2.9 t-20 -62.15 -28.94 70.0 Favored 'General case' 0 N--CA 1.484 1.251 0 O-C-N 123.559 0.537 . . . . 64.34 111.272 -176.811 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 96.9 mtt180 -72.82 -40.27 65.95 Favored 'General case' 0 CA--C 1.543 0.692 0 C-N-CA 123.803 0.841 . . . . 52.12 110.584 174.347 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 11' ' ' TRP . . . . . . . . . . . . . 84.0 m95 -65.8 -29.96 70.52 Favored 'General case' 0 N--CA 1.486 1.328 0 C-N-CA 122.801 0.441 . . . . 74.2 111.591 172.99 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 12' ' ' GLN . . . . . 0.459 ' HG2' ' CE2' ' A' ' 67' ' ' TYR . 38.2 mt-30 -65.21 -46.29 81.31 Favored 'General case' 0 C--O 1.211 -0.953 0 N-CA-C 107.796 -1.187 . . . . 72.31 107.796 173.352 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 61.6 ttt180 -59.62 -41.27 90.03 Favored 'General case' 0 CA--C 1.547 0.851 0 O-C-N 124.034 0.834 . . . . 63.3 111.71 -179.767 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 77.9 mt -64.41 -49.91 78.65 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.478 0 C-N-CA 123.098 0.559 . . . . 71.31 110.094 178.537 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 15' ' ' ALA . . . . . 0.463 ' HA ' ' HB ' ' A' ' 71' ' ' THR . . . -57.36 -46.55 83.22 Favored 'General case' 0 N--CA 1.478 0.933 0 C-N-CA 124.629 1.172 . . . . 74.3 111.656 178.869 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 89.5 mt -80.17 -34.33 37.63 Favored 'General case' 0 N--CA 1.477 0.896 0 CA-C-N 114.579 -1.191 . . . . 72.23 111.402 -171.968 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.512 ' O ' ' HG ' ' A' ' 21' ' ' LEU . 21.0 mt -67.71 -49.46 62.54 Favored 'General case' 0 N--CA 1.481 1.092 0 N-CA-C 109.642 -0.503 . . . . 73.43 109.642 177.542 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 85.0 p -62.56 -37.72 87.25 Favored 'General case' 0 N--CA 1.478 0.953 0 O-C-N 123.513 0.508 . . . . 64.42 111.052 178.588 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 23.3 tp60 -56.95 -46.92 81.78 Favored 'General case' 0 C--N 1.358 0.951 0 C-N-CA 123.497 0.719 . . . . 74.12 110.159 172.163 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 63.9 m -65.7 -42.11 91.56 Favored 'General case' 0 C--O 1.213 -0.819 0 O-C-N 123.707 0.629 . . . . 75.43 110.688 179.018 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 21' ' ' LEU . . . . . 0.512 ' HG ' ' O ' ' A' ' 17' ' ' LEU . 87.1 mt -63.43 -34.23 77.3 Favored 'General case' 0 N--CA 1.476 0.832 0 C-N-CA 123.56 0.744 . . . . 53.33 109.882 -178.032 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 22' ' ' LEU . . . . . 0.589 ' HA ' HD21 ' A' ' 78' ' ' LEU . 56.1 tp -66.97 -54.72 19.16 Favored 'General case' 0 C--N 1.352 0.682 0 C-N-CA 123.535 0.734 . . . . 73.43 110.12 176.026 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 9.5 mm-40 -50.82 -52.58 39.82 Favored 'General case' 0 N--CA 1.479 1.01 0 C-N-CA 124.341 1.056 . . . . 71.34 111.439 178.15 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 24' ' ' LEU . . . . . 0.469 HD22 HD12 ' A' ' 32' ' ' LEU . 62.4 mt -70.15 -34.54 73.15 Favored 'General case' 0 CA--C 1.539 0.557 0 C-N-CA 124.602 1.161 . . . . 74.02 111.078 -173.334 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 25' ' ' ALA . . . . . 0.45 ' HB2' HD21 ' A' ' 33' ' ' LEU . . . -60.64 -44.01 96.89 Favored 'General case' 0 N--CA 1.479 1.012 0 CA-C-O 120.902 0.382 . . . . 34.13 110.65 173.754 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 95.1 mt-30 -69.48 -31.79 70.29 Favored 'General case' 0 CA--C 1.549 0.918 0 CA-C-N 115.303 -0.862 . . . . 55.24 111.518 179.016 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 78.3 mtt180 -90.48 -2.57 57.93 Favored 'General case' 0 N--CA 1.483 1.198 0 C-N-CA 123.756 0.822 . . . . 71.24 112.315 -177.834 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 85.38 10.04 78.12 Favored Glycine 0 N--CA 1.479 1.566 0 N-CA-C 114.433 0.533 . . . . 74.11 114.433 174.891 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 29' ' ' GLU . . . . . 0.422 ' HB2' ' HB3' ' A' ' 24' ' ' LEU . 15.3 mm-40 -90.37 55.08 2.93 Favored 'General case' 0 N--CA 1.478 0.942 0 C-N-CA 124.79 1.236 . . . . 71.44 111.126 178.261 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 30' ' ' TRP . . . . . 0.489 ' HA ' HD13 ' A' ' 33' ' ' LEU . 83.5 m95 -63.02 -23.38 67.43 Favored 'General case' 0 N--CA 1.491 1.58 0 C-N-CA 123.875 0.87 . . . . 71.04 111.6 179.441 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 4.1 m-20 -55.61 -47.83 75.89 Favored 'General case' 0 N--CA 1.473 0.702 0 C-N-CA 124.984 1.314 . . . . 51.43 110.18 175.22 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 0.469 HD12 HD22 ' A' ' 24' ' ' LEU . 82.0 mt -72.3 -24.33 61.31 Favored 'General case' 0 CA--C 1.544 0.723 0 CA-C-N 114.306 -1.315 . . . . 53.4 110.954 -177.872 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 33' ' ' LEU . . . . . 0.489 HD13 ' HA ' ' A' ' 30' ' ' TRP . 9.4 mp -66.23 -45.18 81.57 Favored 'General case' 0 C--N 1.363 1.184 0 N-CA-C 110.101 -0.333 . . . . 73.23 110.101 171.228 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 88.8 mt -65.54 -38.63 90.17 Favored 'General case' 0 N--CA 1.482 1.136 0 C-N-CA 123.325 0.65 . . . . 72.41 111.784 -178.677 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 95.7 mt-30 -71.09 -49.68 41.81 Favored 'General case' 0 N--CA 1.478 0.938 0 C-N-CA 122.588 0.355 . . . . 74.5 110.681 179.211 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 85.2 mm-40 -73.95 -14.2 61.01 Favored 'General case' 0 N--CA 1.483 1.182 0 C-N-CA 123.102 0.561 . . . . 53.32 112.464 179.314 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 37' ' ' GLU . . . . . 0.453 ' O ' ' HG ' ' A' ' 41' ' ' LEU . 42.9 tt0 -51.92 -52.13 52.1 Favored 'General case' 0 N--CA 1.484 1.236 0 C-N-CA 123.94 0.896 . . . . 73.42 111.32 176.485 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 62.9 t -56.63 -47.84 81.59 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.755 0 O-C-N 123.889 0.743 . . . . 71.53 110.661 -178.856 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 32.0 m -67.04 -37.0 83.31 Favored 'General case' 0 CA--C 1.538 0.508 0 CA-C-N 115.455 -0.793 . . . . 75.55 111.801 -177.695 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 43.8 t80 -70.69 -49.47 46.77 Favored 'General case' 0 N--CA 1.47 0.541 0 C-N-CA 123.248 0.619 . . . . 72.14 110.65 -176.875 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 41' ' ' LEU . . . . . 0.564 HD22 HD22 ' A' ' 92' ' ' LEU . 22.2 mt -68.36 -41.88 80.03 Favored 'General case' 0 N--CA 1.478 0.939 0 O-C-N 123.851 0.719 . . . . 74.13 110.144 -176.749 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 41.1 tt0 -57.43 -56.03 27.16 Favored 'General case' 0 C--N 1.358 0.965 0 O-C-N 123.924 0.765 . . . . 70.54 110.788 176.119 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 43' ' ' SER . . . . . 0.537 ' O ' HG23 ' A' ' 47' ' ' VAL . 73.0 m -57.54 -56.98 14.93 Favored 'General case' 0 C--N 1.352 0.704 0 O-C-N 124.046 0.841 . . . . 74.21 110.692 -177.587 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 14.6 tt -59.2 -40.8 82.01 Favored 'Isoleucine or valine' 0 C--N 1.354 0.803 0 O-C-N 123.799 0.687 . . . . 63.4 111.39 -172.139 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 38.1 mm-40 -64.07 -47.55 79.65 Favored 'General case' 0 C--N 1.358 0.964 0 CA-C-O 119.435 -0.317 . . . . 71.44 111.412 176.429 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 18.3 m -66.53 -27.6 67.89 Favored 'General case' 0 CA--C 1.551 0.983 0 O-C-N 123.457 0.473 . . . . 73.51 111.849 -177.222 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 47' ' ' VAL . . . . . 0.537 HG23 ' O ' ' A' ' 43' ' ' SER . 59.1 t -80.97 -38.37 16.81 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.384 0 C-N-CA 123.335 0.654 . . . . 72.02 110.612 -179.194 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 48' ' ' MET . . . . . . . . . . . . . 68.5 mtm -73.13 -21.9 60.63 Favored 'General case' 0 N--CA 1.486 1.374 0 C-N-CA 122.755 0.422 . . . . 62.45 110.407 172.894 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 17.2 tp10 -88.0 -18.74 28.34 Favored 'General case' 0 N--CA 1.481 1.096 0 C-N-CA 124.251 1.02 . . . . 73.2 110.167 174.793 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 14.2 tppt? -78.36 138.76 38.7 Favored 'General case' 0 C--O 1.24 0.581 0 N-CA-C 109.27 -0.641 . . . . 64.5 109.27 -179.852 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 52.0 tt0 -68.5 124.99 25.08 Favored 'General case' 0 C--O 1.241 0.639 0 CA-C-N 115.423 -0.808 . . . . 71.31 109.558 -177.899 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 52' ' ' THR . . . . . 0.463 HG21 ' HB3' ' A' ' 114' ' ' LEU . 29.7 m -61.08 121.34 61.82 Favored Pre-proline 0 CA--C 1.555 1.155 0 C-N-CA 123.672 0.789 . . . . 73.21 110.612 178.686 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 55.7 Cg_endo -67.19 155.88 68.69 Favored 'Trans proline' 0 C--N 1.376 1.988 0 C-N-CA 122.414 2.076 . . . . 65.23 111.764 176.484 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 18.1 Cg_exo -67.08 -52.87 0.56 Allowed 'Trans proline' 0 C--N 1.376 1.992 0 C-N-CA 122.399 2.066 . . . . 75.32 111.72 177.574 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . -70.11 86.8 0.31 Allowed Glycine 0 C--N 1.349 1.251 0 O-C-N 124.09 0.869 . . . . 63.24 112.912 -175.618 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 56' ' ' ILE . . . . . 0.472 ' O ' ' HB ' ' A' ' 60' ' ' ILE . 71.9 mt -115.5 -50.28 4.82 Favored 'Isoleucine or valine' 0 C--O 1.209 -1.044 0 C-N-CA 124.646 1.178 . . . . 73.21 108.99 176.416 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 10.4 p 60.43 -177.37 0.1 Allowed 'General case' 0 CA--C 1.557 1.23 0 C-N-CA 125.872 1.669 . . . . 53.0 111.077 -178.2 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -55.57 -42.85 75.3 Favored 'General case' 0 N--CA 1.479 1.011 0 C-N-CA 124.345 1.058 . . . . 71.44 110.144 176.168 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 49.3 m -61.76 -53.97 48.83 Favored 'General case' 0 CA--C 1.545 0.788 0 CA-C-N 115.697 -0.683 . . . . 30.1 112.759 -173.264 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 60' ' ' ILE . . . . . 0.472 ' HB ' ' O ' ' A' ' 56' ' ' ILE . 26.1 mt -79.28 -23.74 12.52 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.182 0 N-CA-C 109.631 -0.507 . . . . 70.15 109.631 -174.648 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 61' ' ' GLN . . . . . 0.47 ' HG3' ' HG ' ' A' ' 109' ' ' LEU . 53.2 tt0 -58.75 -48.23 81.92 Favored 'General case' 0 C--N 1.358 0.942 0 N-CA-C 109.866 -0.42 . . . . 75.35 109.866 172.005 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 3.4 m-20 -71.56 -37.68 71.05 Favored 'General case' 0 CA--C 1.547 0.842 0 CA-C-N 115.973 -0.558 . . . . 62.41 112.416 178.616 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 63' ' ' MET . . . . . . . . . . . . . 69.2 mtm -64.93 -59.79 3.78 Favored 'General case' 0 N--CA 1.488 1.466 0 CA-C-N 117.775 0.261 . . . . 70.13 111.284 179.172 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 64' ' ' VAL . . . . . 0.456 ' O ' HG13 ' A' ' 68' ' ' ILE . 55.5 t -57.64 -49.44 80.64 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.033 0 C-N-CA 123.516 0.726 . . . . 74.23 111.984 178.263 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 65' ' ' ALA . . . . . 0.498 ' HB2' HD23 ' A' ' 109' ' ' LEU . . . -64.7 -33.21 75.41 Favored 'General case' 0 N--CA 1.495 1.795 0 CA-C-N 118.977 0.808 . . . . 50.2 111.279 -179.638 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -64.36 -39.02 96.61 Favored Glycine 0 C--N 1.347 1.19 0 N-CA-C 112.182 -0.367 . . . . 52.44 112.182 174.795 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 67' ' ' TYR . . . . . 0.47 ' O ' HG22 ' A' ' 71' ' ' THR . 14.2 m-30 -65.48 -42.6 92.06 Favored 'General case' 0 N--CA 1.471 0.61 0 C-N-CA 123.636 0.774 . . . . 74.13 110.752 175.306 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 68' ' ' ILE . . . . . 0.542 ' O ' ' HG ' ' A' ' 72' ' ' LEU . 78.5 mt -59.34 -49.97 81.57 Favored 'Isoleucine or valine' 0 C--N 1.355 0.836 0 O-C-N 124.619 1.199 . . . . 74.23 109.38 178.689 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 69' ' ' LYS . . . . . 0.576 ' HB2' ' HE2' ' A' ' 106' ' ' TYR . 27.9 tptp -57.37 -46.09 83.76 Favored 'General case' 0 N--CA 1.472 0.666 0 C-N-CA 124.013 0.925 . . . . 74.24 110.393 -179.26 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 53.5 tt0 -59.35 -48.21 82.49 Favored 'General case' 0 C--N 1.354 0.802 0 CA-C-N 115.306 -0.861 . . . . 72.32 111.058 -179.411 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 71' ' ' THR . . . . . 0.47 HG22 ' O ' ' A' ' 67' ' ' TYR . 9.2 t -76.08 -23.74 55.03 Favored 'General case' 0 C--O 1.24 0.584 0 O-C-N 123.401 0.438 . . . . 74.12 110.227 -174.438 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 72' ' ' LEU . . . . . 0.631 ' HA ' HH12 ' A' ' 98' ' ' ARG . 39.5 mt -61.37 -51.73 67.56 Favored 'General case' 0 C--N 1.363 1.158 0 N-CA-C 108.648 -0.871 . . . . 72.42 108.648 171.796 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 28.6 m-20 -64.51 -48.57 74.65 Favored 'General case' 0 N--CA 1.484 1.231 0 O-C-N 123.945 0.778 . . . . 75.51 112.429 179.716 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 94.6 m-20 -52.02 -56.63 13.09 Favored 'General case' 0 N--CA 1.491 1.593 0 C-N-CA 124.03 0.932 . . . . 63.2 110.729 -179.989 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 15.6 tt0 -70.49 -30.52 67.32 Favored 'General case' 0 CA--C 1.551 1.014 0 CA-C-N 114.787 -1.097 . . . . 74.24 110.762 -176.527 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 57.4 tt0 -64.22 -41.26 97.11 Favored 'General case' 0 N--CA 1.487 1.419 0 C-N-CA 123.49 0.716 . . . . 55.11 110.77 176.744 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 95.2 mt -67.26 -38.99 86.03 Favored 'General case' 0 N--CA 1.47 0.57 0 CA-C-N 115.7 -0.682 . . . . 73.42 109.929 178.085 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 78' ' ' LEU . . . . . 0.589 HD21 ' HA ' ' A' ' 22' ' ' LEU . 74.9 mt -58.78 -51.25 70.8 Favored 'General case' 0 C--N 1.357 0.898 0 CA-C-N 115.867 -0.606 . . . . 74.5 111.454 172.042 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 2.9 mptm? -61.33 -38.97 88.81 Favored 'General case' 0 N--CA 1.481 1.122 0 C-N-CA 123.956 0.902 . . . . 73.15 111.313 -179.442 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -67.94 -29.83 73.82 Favored Glycine 0 C--N 1.341 0.857 0 O-C-N 123.738 0.649 . . . . 62.13 112.204 177.429 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 81' ' ' LEU . . . . . 0.431 HD22 ' HH2' ' A' ' 30' ' ' TRP . 4.3 tt -78.2 -39.28 41.13 Favored 'General case' 0 CA--C 1.554 1.115 0 C-N-CA 123.5 0.72 . . . . 72.32 109.582 176.088 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 82' ' ' LEU . . . . . 0.433 ' HG ' ' O ' ' A' ' 78' ' ' LEU . 94.0 mt . . . . . 0 N--CA 1.48 1.073 0 C-N-CA 123.184 0.594 . . . . 74.13 111.057 -171.997 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 92' ' ' LEU . . . . . 0.564 HD22 HD22 ' A' ' 41' ' ' LEU . 11.9 mt . . . . . 0 N--CA 1.476 0.875 0 N-CA-C 110.552 -0.166 . . . . 70.0 110.552 . . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 49.4 mt -77.24 -43.52 31.13 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.244 0 N-CA-C 109.076 -0.713 . . . . 72.14 109.076 173.14 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -171.62 -29.41 0.02 OUTLIER Glycine 0 C--N 1.346 1.115 0 CA-C-N 115.14 -0.936 . . . . 72.21 112.289 -179.226 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 14.1 pt20 -140.99 -177.41 5.08 Favored 'General case' 0 N--CA 1.481 1.102 0 C-N-CA 123.61 0.764 . . . . 73.52 110.112 179.544 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 50.2 m -66.91 83.01 0.11 Allowed 'General case' 0 CA--C 1.541 0.615 0 C-N-CA 124.233 1.013 . . . . 74.33 112.249 -174.618 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 89.7 m -88.12 -41.85 12.75 Favored 'General case' 0 CA--C 1.54 0.558 0 C-N-CA 123.744 0.818 . . . . 64.41 110.075 176.526 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 98' ' ' ARG . . . . . 0.631 HH12 ' HA ' ' A' ' 72' ' ' LEU . 1.7 tmt_? -49.88 -57.65 6.99 Favored 'General case' 0 N--CA 1.478 0.948 0 C-N-CA 125.075 1.35 . . . . 64.2 112.929 -165.57 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 8.9 tt0 -60.51 -52.4 65.35 Favored 'General case' 0 N--CA 1.477 0.916 0 O-C-N 123.789 0.681 . . . . 64.43 110.861 -170.318 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 65.5 tttp -64.78 -42.99 94.65 Favored 'General case' 0 CA--C 1.542 0.673 0 O-C-N 124.15 0.906 . . . . 51.42 111.473 -178.397 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 26.5 t -69.37 -40.24 77.55 Favored 'General case' 0 N--CA 1.467 0.419 0 C-N-CA 123.426 0.691 . . . . 71.11 111.613 -173.122 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 102' ' ' LEU . . . . . 0.49 ' HG ' HG23 ' A' ' 68' ' ' ILE . 3.4 tp -80.38 -34.65 36.19 Favored 'General case' 0 N--CA 1.471 0.6 0 C-N-CA 122.787 0.435 . . . . 62.25 110.47 -176.372 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 7.6 t30 -63.41 -40.03 96.11 Favored 'General case' 0 N--CA 1.479 1.016 0 C-N-CA 122.933 0.493 . . . . 54.41 109.907 172.902 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 12.0 t30 -67.07 -41.28 86.69 Favored 'General case' 0 N--CA 1.473 0.722 0 CA-C-N 115.651 -0.704 . . . . 71.52 110.126 177.188 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -59.14 -45.17 91.66 Favored 'General case' 0 N--CA 1.47 0.566 0 O-C-N 123.598 0.561 . . . . 55.33 110.402 177.44 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 106' ' ' TYR . . . . . 0.576 ' HE2' ' HB2' ' A' ' 69' ' ' LYS . 19.9 t80 -60.71 -55.4 33.67 Favored 'General case' 0 C--N 1.355 0.821 0 O-C-N 124.046 0.841 . . . . 74.41 110.477 178.999 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -66.09 -44.04 92.13 Favored Glycine 0 C--N 1.349 1.302 0 O-C-N 124.318 1.011 . . . . 43.14 112.494 -171.058 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 20.4 mmm180 -67.1 -33.3 75.18 Favored 'General case' 0 CA--C 1.541 0.633 0 C-N-CA 123.258 0.623 . . . . 72.44 111.048 177.512 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 109' ' ' LEU . . . . . 0.535 ' HA ' ' N ' ' A' ' 114' ' ' LEU . 35.6 tp -68.33 -43.43 77.57 Favored 'General case' 0 N--CA 1.485 1.287 0 C-N-CA 122.819 0.448 . . . . 62.1 110.359 176.327 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 33.2 t -68.06 -31.73 71.57 Favored 'General case' 0 CA--C 1.54 0.595 0 CA-C-N 114.701 -1.136 . . . . 70.11 110.296 -178.326 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . -89.64 -65.18 1.25 Allowed Glycine 0 C--N 1.36 1.898 0 CA-C-O 119.109 -0.828 . . . . 73.24 113.941 -179.502 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 112' ' ' MET . . . . . 0.484 ' O ' ' HG ' ' A' ' 113' ' ' LEU . 10.0 tpt -98.1 -72.52 0.65 Allowed 'General case' 0 N--CA 1.486 1.347 0 CA-C-N 118.609 1.204 . . . . 74.11 112.273 174.637 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 113' ' ' LEU . . . . . 0.484 ' HG ' ' O ' ' A' ' 112' ' ' MET . 12.2 mt 171.25 45.88 0.0 OUTLIER 'General case' 0 N--CA 1.505 2.305 0 C-N-CA 125.445 1.498 . . . . 62.44 109.561 -174.406 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 114' ' ' LEU . . . . . 0.535 ' N ' ' HA ' ' A' ' 109' ' ' LEU . 2.1 tt . . . . . 0 N--CA 1.507 2.388 0 C-N-CA 126.633 1.973 . . . . 62.13 111.343 172.075 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 1' ' ' MET . . . . . 0.4 ' O ' HG23 ' A' ' 5' ' ' VAL . 24.6 ptm . . . . . 0 N--CA 1.483 1.221 0 CA-C-O 119.706 -0.188 . . . . 71.02 111.327 . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 26.2 p -56.05 -39.65 72.35 Favored 'General case' 0 N--CA 1.484 1.267 0 C-N-CA 123.286 0.634 . . . . 75.24 111.739 -179.934 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 48.3 m -68.46 -30.76 69.7 Favored 'General case' 0 CA--C 1.54 0.593 0 C-N-CA 123.375 0.67 . . . . 65.14 111.637 177.124 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 4' ' ' THR . . . . . 0.516 ' HA ' ' HG3' ' A' ' 53' ' ' PRO . 12.4 m -74.42 -35.99 63.43 Favored 'General case' 0 C--N 1.351 0.668 0 C-N-CA 123.04 0.536 . . . . 73.12 111.226 177.207 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 5' ' ' VAL . . . . . 0.4 HG23 ' O ' ' A' ' 1' ' ' MET . 48.7 t -66.27 -40.29 86.47 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.745 0 N-CA-C 109.248 -0.649 . . . . 73.03 109.248 175.478 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 6' ' ' GLU . . . . . 0.511 ' O ' ' HG3' ' A' ' 10' ' ' ARG . 5.0 tm-20 -65.34 -37.21 86.37 Favored 'General case' 0 CA--C 1.542 0.652 0 CA-C-N 114.466 -1.243 . . . . 65.11 110.062 176.157 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 7' ' ' PHE . . . . . 0.421 ' O ' ' HB2' ' A' ' 10' ' ' ARG . 69.0 t80 -67.88 -44.62 76.63 Favored 'General case' 0 N--CA 1.48 1.069 0 C-N-CA 124.516 1.126 . . . . 63.31 112.103 178.4 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 8' ' ' ILE . . . . . 0.49 HD11 HG23 ' A' ' 60' ' ' ILE . 83.9 mt -65.49 -37.68 80.63 Favored 'Isoleucine or valine' 0 C--O 1.214 -0.813 0 N-CA-C 108.752 -0.832 . . . . 74.45 108.752 175.611 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 28.4 t-20 -65.2 -28.87 69.69 Favored 'General case' 0 N--CA 1.482 1.131 0 C-N-CA 124.594 1.157 . . . . 63.53 110.937 175.762 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 10' ' ' ARG . . . . . 0.6 ' HB3' HG22 ' A' ' 47' ' ' VAL . 65.4 mtt180 -62.56 -53.78 49.53 Favored 'General case' 0 N--CA 1.484 1.251 0 CA-C-O 121.766 0.793 . . . . 74.24 109.216 172.408 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 11' ' ' TRP . . . . . . . . . . . . . 98.3 m95 -73.89 -20.62 60.35 Favored 'General case' 0 N--CA 1.475 0.801 0 CA-C-N 114.927 -1.033 . . . . 74.23 112.741 -177.963 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 12' ' ' GLN . . . . . 0.439 ' HG3' ' O ' ' A' ' 8' ' ' ILE . 58.7 mt-30 -72.18 -38.86 69.01 Favored 'General case' 0 C--O 1.214 -0.813 0 N-CA-C 108.795 -0.817 . . . . 60.53 108.795 170.117 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 16.5 tpt180 -58.57 -52.34 66.07 Favored 'General case' 0 CA--C 1.54 0.563 0 O-C-N 123.812 0.695 . . . . 74.03 109.702 178.996 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 14' ' ' ILE . . . . . 0.463 HG22 ' OG1' ' A' ' 71' ' ' THR . 22.8 mt -65.04 -46.83 90.21 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.24 0 O-C-N 123.459 0.474 . . . . 63.12 111.03 179.507 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 15' ' ' ALA . . . . . 0.568 ' HA ' ' HB ' ' A' ' 71' ' ' THR . . . -58.54 -46.78 86.1 Favored 'General case' 0 N--CA 1.491 1.604 0 C-N-CA 123.703 0.801 . . . . 62.23 111.919 -177.278 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 82.7 mt -70.26 -44.6 68.11 Favored 'General case' 0 N--CA 1.479 1.014 0 CA-C-N 114.891 -1.049 . . . . 75.13 111.101 -176.445 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.496 ' O ' ' HG ' ' A' ' 21' ' ' LEU . 74.3 mt -64.83 -45.29 86.78 Favored 'General case' 0 CA--C 1.544 0.717 0 O-C-N 123.607 0.567 . . . . 74.04 111.092 -179.531 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 18' ' ' SER . . . . . 0.408 ' HB3' ' OH ' ' A' ' 40' ' ' TYR . 80.4 p -64.68 -39.01 92.93 Favored 'General case' 0 N--CA 1.484 1.248 0 C-N-CA 123.159 0.584 . . . . 74.45 111.392 -179.36 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 6.0 tp-100 -58.98 -48.3 82.04 Favored 'General case' 0 C--N 1.354 0.777 0 O-C-N 123.972 0.795 . . . . 74.25 110.079 175.045 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 38.4 m -56.74 -50.97 70.65 Favored 'General case' 0 C--N 1.354 0.793 0 O-C-N 124.14 0.9 . . . . 74.35 110.188 177.517 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 21' ' ' LEU . . . . . 0.497 HD22 ' HA ' ' A' ' 33' ' ' LEU . 81.1 mt -65.32 -30.23 71.06 Favored 'General case' 0 CA--C 1.538 0.507 0 C-N-CA 123.754 0.822 . . . . 62.43 111.163 -175.497 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.707 ' HA ' HD21 ' A' ' 78' ' ' LEU . 63.9 tp -64.72 -58.13 7.09 Favored 'General case' 0 C--N 1.353 0.752 0 N-CA-C 109.534 -0.543 . . . . 74.34 109.534 176.989 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 39.3 mt-10 -57.12 -47.28 81.49 Favored 'General case' 0 N--CA 1.475 0.779 0 O-C-N 124.396 1.06 . . . . 63.33 110.991 -178.015 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 95.9 mt -64.33 -40.33 95.68 Favored 'General case' 0 N--CA 1.473 0.714 0 C-N-CA 123.899 0.88 . . . . 74.15 111.442 -177.372 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 25' ' ' ALA . . . . . 0.493 ' HB2' HD21 ' A' ' 33' ' ' LEU . . . -61.42 -44.73 96.62 Favored 'General case' 0 N--CA 1.476 0.863 0 C-N-CA 122.895 0.478 . . . . 43.33 110.847 178.195 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 89.6 mt-30 -64.84 -30.81 71.83 Favored 'General case' 0 N--CA 1.477 0.883 0 O-C-N 124.088 0.868 . . . . 62.43 111.2 178.351 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 53.6 mtt180 -83.16 -5.79 59.25 Favored 'General case' 0 N--CA 1.481 1.106 0 C-N-CA 123.568 0.747 . . . . 73.2 112.071 177.271 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 86.67 7.65 78.21 Favored Glycine 0 C--N 1.349 1.271 0 N-CA-C 114.027 0.371 . . . . 63.35 114.027 178.144 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 11.2 mm-40 -82.37 57.63 3.74 Favored 'General case' 0 CA--C 1.546 0.791 0 C-N-CA 124.281 1.032 . . . . 61.42 111.251 178.382 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 30' ' ' TRP . . . . . 0.401 ' O ' ' HG ' ' A' ' 34' ' ' LEU . 84.7 m95 -63.43 -32.04 73.37 Favored 'General case' 0 N--CA 1.477 0.917 0 C-N-CA 123.656 0.782 . . . . 72.13 110.942 -178.769 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 10.1 m-20 -56.66 -42.17 78.52 Favored 'General case' 0 N--CA 1.476 0.846 0 C-N-CA 124.032 0.933 . . . . 64.51 110.706 177.846 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 83.3 mt -66.12 -34.51 78.21 Favored 'General case' 0 N--CA 1.474 0.742 0 C-N-CA 123.395 0.678 . . . . 60.04 111.199 179.743 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 33' ' ' LEU . . . . . 0.497 ' HA ' HD22 ' A' ' 21' ' ' LEU . 9.9 mp -66.22 -39.61 89.71 Favored 'General case' 0 N--CA 1.481 1.101 0 C-N-CA 122.563 0.345 . . . . 64.14 110.299 173.023 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.401 ' HG ' ' O ' ' A' ' 30' ' ' TRP . 84.9 mt -73.66 -22.94 59.81 Favored 'General case' 0 N--CA 1.478 0.945 0 C-N-CA 123.504 0.722 . . . . 72.33 111.661 -179.091 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 56.1 mt-30 -85.98 -32.73 21.37 Favored 'General case' 0 N--CA 1.486 1.372 0 C-N-CA 123.515 0.726 . . . . 61.35 110.774 176.09 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 25.5 mm-40 -86.19 -12.66 49.2 Favored 'General case' 0 N--CA 1.479 1.02 0 C-N-CA 124.017 0.927 . . . . 72.5 111.521 176.136 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 37' ' ' GLU . . . . . 0.747 ' HG3' ' HB3' ' A' ' 89' ' ' LEU . 36.3 tt0 -44.57 -65.0 0.58 Allowed 'General case' 0 N--CA 1.477 0.889 0 C-N-CA 124.543 1.137 . . . . 53.34 113.055 -178.531 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 93.2 t -65.49 -33.26 62.44 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.692 0 C-N-CA 122.955 0.502 . . . . 61.32 110.866 -175.911 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 57.7 m -63.85 -38.31 90.62 Favored 'General case' 0 N--CA 1.476 0.831 0 C-N-CA 123.069 0.548 . . . . 75.54 111.415 175.406 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 40' ' ' TYR . . . . . 0.408 ' OH ' ' HB3' ' A' ' 18' ' ' SER . 42.4 t80 -78.11 -43.04 30.09 Favored 'General case' 0 C--N 1.344 0.348 0 C-N-CA 123.326 0.65 . . . . 72.34 110.547 -174.705 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 41' ' ' LEU . . . . . 0.476 ' HG ' ' O ' ' A' ' 37' ' ' GLU . 63.2 mt -64.95 -41.52 95.42 Favored 'General case' 0 C--O 1.245 0.854 0 O-C-N 123.955 0.785 . . . . 63.13 109.554 178.529 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 53.9 tt0 -56.71 -53.4 58.22 Favored 'General case' 0 C--N 1.358 0.962 0 CA-C-N 115.157 -0.929 . . . . 71.41 110.014 173.713 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 43' ' ' SER . . . . . 0.562 ' O ' HG23 ' A' ' 47' ' ' VAL . 71.5 m -56.45 -57.16 13.51 Favored 'General case' 0 C--N 1.35 0.607 0 O-C-N 124.216 0.947 . . . . 72.05 111.658 -178.606 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 16.8 tt -61.03 -41.03 87.64 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.812 0 O-C-N 123.728 0.642 . . . . 72.33 111.335 -172.328 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 30.6 mt-10 -72.24 -37.07 69.23 Favored 'General case' 0 N--CA 1.477 0.89 0 N-CA-C 111.975 0.361 . . . . 74.14 111.975 178.824 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 46' ' ' THR . . . . . 0.505 ' O ' ' HB2' ' A' ' 50' ' ' LYS . 96.0 m -57.65 -40.2 78.74 Favored 'General case' 0 N--CA 1.486 1.36 0 C-N-CA 123.008 0.523 . . . . 61.53 110.589 174.424 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 47' ' ' VAL . . . . . 0.6 HG22 ' HB3' ' A' ' 10' ' ' ARG . 87.3 t -68.69 -49.56 63.49 Favored 'Isoleucine or valine' 0 C--O 1.243 0.724 0 C-N-CA 124.201 1.001 . . . . 51.24 111.371 -179.517 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 48' ' ' MET . . . . . . . . . . . . . 78.6 mtm -62.12 -43.74 98.18 Favored 'General case' 0 N--CA 1.482 1.165 0 O-C-N 123.877 0.735 . . . . 72.4 111.399 -176.608 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 46.0 mt-10 -85.02 4.12 35.36 Favored 'General case' 0 N--CA 1.476 0.84 0 C-N-CA 123.721 0.808 . . . . 63.05 111.944 -174.779 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 50' ' ' LYS . . . . . 0.505 ' HB2' ' O ' ' A' ' 46' ' ' THR . 1.5 tppt? -103.62 135.82 44.49 Favored 'General case' 0 N--CA 1.476 0.834 0 N-CA-C 109.56 -0.533 . . . . 73.44 109.56 179.117 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 9.0 tt0 -69.42 148.61 49.35 Favored 'General case' 0 CA--C 1.547 0.831 0 C-N-CA 123.653 0.781 . . . . 75.04 111.856 -169.615 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 15.9 m -68.68 130.58 91.78 Favored Pre-proline 0 CA--C 1.554 1.104 0 C-N-CA 124.511 1.124 . . . . 65.54 110.461 176.548 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 53' ' ' PRO . . . . . 0.516 ' HG3' ' HA ' ' A' ' 4' ' ' THR . 94.7 Cg_endo -75.38 155.89 41.25 Favored 'Trans proline' 0 CA--C 1.557 1.662 0 C-N-CA 122.591 2.194 . . . . 75.31 112.289 178.0 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_endo -70.03 -46.86 0.97 Allowed 'Trans proline' 0 C--N 1.369 1.643 0 C-N-CA 122.764 2.31 . . . . 61.21 113.413 179.029 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . -79.92 70.74 2.85 Favored Glycine 0 C--N 1.348 1.227 0 N-CA-C 114.336 0.495 . . . . 75.44 114.336 -170.179 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 56' ' ' ILE . . . . . 0.715 HG21 HD11 ' A' ' 113' ' ' LEU . 8.3 mm -101.75 142.86 15.5 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.906 0 C-N-CA 124.012 0.925 . . . . 61.45 108.781 175.518 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 72.9 p -113.18 174.32 5.96 Favored 'General case' 0 N--CA 1.478 0.93 0 N-CA-C 109.005 -0.739 . . . . 74.41 109.005 170.134 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 16.0 tpt180 -59.13 -42.74 91.36 Favored 'General case' 0 N--CA 1.478 0.934 0 C-N-CA 123.128 0.571 . . . . 70.04 109.584 176.197 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 19.8 m -56.64 -50.61 71.54 Favored 'General case' 0 C--N 1.356 0.88 0 C-N-CA 123.972 0.909 . . . . 75.42 111.082 176.733 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 60' ' ' ILE . . . . . 0.494 HD13 HG21 ' A' ' 4' ' ' THR . 99.1 mt -60.28 -42.17 89.61 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.809 0 O-C-N 123.972 0.795 . . . . 75.23 110.985 179.483 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 54.7 tt0 -58.73 -47.34 84.93 Favored 'General case' 0 CA--C 1.542 0.656 0 C-N-CA 123.51 0.724 . . . . 72.31 110.785 -179.715 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 14.4 m-20 -72.77 -32.82 65.89 Favored 'General case' 0 N--CA 1.48 1.027 0 N-CA-C 112.827 0.677 . . . . 64.23 112.827 -178.077 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 63' ' ' MET . . . . . . . . . . . . . 58.7 mtm -74.48 -41.82 60.08 Favored 'General case' 0 N--CA 1.485 1.317 0 CA-C-N 117.568 0.167 . . . . 74.44 110.938 179.673 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 64' ' ' VAL . . . . . 0.496 ' O ' HG13 ' A' ' 68' ' ' ILE . 56.1 t -64.0 -54.14 35.21 Favored 'Isoleucine or valine' 0 C--N 1.352 0.71 0 C-N-CA 123.492 0.717 . . . . 72.32 109.616 176.253 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -62.04 -32.7 73.24 Favored 'General case' 0 N--CA 1.477 0.923 0 O-C-N 123.639 0.587 . . . . 75.31 111.129 178.306 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -63.26 -40.2 98.75 Favored Glycine 0 C--N 1.348 1.205 0 N-CA-C 111.689 -0.564 . . . . 53.32 111.689 174.627 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 16.8 m-30 -75.21 -32.3 61.13 Favored 'General case' 0 C--N 1.352 0.685 0 C-N-CA 123.573 0.749 . . . . 73.23 111.722 178.702 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 68' ' ' ILE . . . . . 0.512 ' O ' ' HG ' ' A' ' 72' ' ' LEU . 62.1 mt -63.17 -56.15 19.05 Favored 'Isoleucine or valine' 0 C--N 1.357 0.903 0 N-CA-C 107.979 -1.119 . . . . 70.32 107.979 175.345 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 51.7 tptt -53.11 -43.51 66.94 Favored 'General case' 0 N--CA 1.477 0.896 0 C-N-CA 124.622 1.169 . . . . 75.21 111.527 177.481 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 61.5 tt0 -59.9 -52.39 65.63 Favored 'General case' 0 N--CA 1.472 0.629 0 CA-C-N 115.731 -0.668 . . . . 70.23 111.249 179.982 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 71' ' ' THR . . . . . 0.568 ' HB ' ' HA ' ' A' ' 15' ' ' ALA . 11.4 t -74.95 -27.07 60.03 Favored 'General case' 0 C--N 1.35 0.619 0 O-C-N 123.285 0.366 . . . . 73.34 110.275 -173.703 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 72' ' ' LEU . . . . . 0.512 ' HG ' ' O ' ' A' ' 68' ' ' ILE . 19.4 mt -61.78 -55.41 30.39 Favored 'General case' 0 C--N 1.358 0.949 0 N-CA-C 108.872 -0.788 . . . . 75.15 108.872 175.19 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -67.83 -41.95 82.24 Favored 'General case' 0 N--CA 1.479 0.982 0 N-CA-C 113.937 1.088 . . . . 74.21 113.937 -175.916 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 94.7 m-20 -60.88 -55.41 33.32 Favored 'General case' 0 N--CA 1.493 1.714 0 CA-C-O 121.869 0.842 . . . . 74.21 110.121 177.299 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 75' ' ' GLU . . . . . 0.518 ' O ' ' HG2' ' A' ' 79' ' ' LYS . 62.5 tt0 -70.08 -19.9 63.24 Favored 'General case' 0 CA--C 1.549 0.936 0 CA-C-N 114.516 -1.22 . . . . 64.01 110.801 -178.876 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 76' ' ' GLN . . . . . 0.428 ' HB2' ' O ' ' A' ' 72' ' ' LEU . 61.2 tt0 -72.92 -41.12 64.89 Favored 'General case' 0 N--CA 1.489 1.512 0 C-N-CA 123.127 0.571 . . . . 64.03 109.879 176.602 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 93.3 mt -59.58 -41.4 90.15 Favored 'General case' 0 N--CA 1.474 0.77 0 O-C-N 123.938 0.774 . . . . 73.42 109.467 172.926 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 78' ' ' LEU . . . . . 0.707 HD21 ' HA ' ' A' ' 22' ' ' LEU . 70.1 mt -58.16 -51.25 70.49 Favored 'General case' 0 N--CA 1.478 0.947 0 CA-C-N 115.611 -0.722 . . . . 63.15 111.972 170.87 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 79' ' ' LYS . . . . . 0.518 ' HG2' ' O ' ' A' ' 75' ' ' GLU . 41.3 mmtm -57.1 -42.58 81.03 Favored 'General case' 0 N--CA 1.481 1.105 0 C-N-CA 123.495 0.718 . . . . 74.45 110.827 -176.662 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 80' ' ' GLY . . . . . 0.647 ' HA2' ' HA ' ' A' ' 84' ' ' GLN . . . -67.26 -40.63 92.17 Favored Glycine 0 C--N 1.344 1.004 0 O-C-N 124.583 1.177 . . . . 42.31 113.001 179.259 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 3.1 tt -64.49 -48.3 75.69 Favored 'General case' 0 N--CA 1.475 0.805 0 C-N-CA 123.895 0.878 . . . . 74.55 109.375 179.301 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 85.7 mt -64.1 -62.69 1.46 Allowed 'General case' 0 CA--C 1.543 0.685 0 C-N-CA 124.391 1.076 . . . . 73.42 111.708 -171.885 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 7.9 tt0 -155.62 10.27 0.29 Allowed 'General case' 0 N--CA 1.488 1.426 0 N-CA-C 111.437 0.162 . . . . 73.23 111.437 -177.018 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 84' ' ' GLN . . . . . 0.647 ' HA ' ' HA2' ' A' ' 80' ' ' GLY . 28.6 tt0 72.41 -7.15 1.43 Allowed 'General case' 0 N--CA 1.493 1.7 0 C-N-CA 124.984 1.314 . . . . 71.42 112.832 -179.091 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 85' ' ' ARG . . . . . . . . . . . . . 36.3 ttp180 -82.08 140.39 33.88 Favored 'General case' 0 N--CA 1.479 0.987 0 C-N-CA 123.303 0.641 . . . . 63.41 110.721 -176.706 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 65.1 mt -65.93 -20.27 66.15 Favored 'General case' 0 N--CA 1.487 1.388 0 C-N-CA 124.381 1.072 . . . . 75.45 112.846 -174.763 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 11.3 p-10 -121.18 139.82 52.84 Favored 'General case' 0 N--CA 1.478 0.965 0 N-CA-C 108.401 -0.963 . . . . 71.43 108.401 172.15 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 26.1 mm-40 -151.29 -162.2 1.49 Allowed 'General case' 0 N--CA 1.486 1.362 0 C-N-CA 124.042 0.937 . . . . 72.5 110.093 -174.773 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 89' ' ' LEU . . . . . 0.747 ' HB3' ' HG3' ' A' ' 37' ' ' GLU . 96.4 mt 68.71 -94.96 0.03 OUTLIER 'General case' 0 C--N 1.361 1.072 0 C-N-CA 125.31 1.444 . . . . 74.1 109.678 -177.54 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 26.0 t -116.81 -78.19 0.58 Allowed 'General case' 0 C--O 1.242 0.667 0 N-CA-C 108.48 -0.933 . . . . 70.32 108.48 174.593 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 34.6 t -177.85 160.6 1.51 Allowed 'General case' 0 C--N 1.355 0.842 0 C-N-CA 123.082 0.553 . . . . 72.04 110.651 -179.886 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 85.1 mt -115.0 -71.11 0.76 Allowed 'General case' 0 N--CA 1.474 0.764 0 N-CA-C 108.364 -0.976 . . . . 73.3 108.364 170.068 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 49.8 mt -120.71 13.34 6.35 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.605 0 CA-C-O 122.003 0.906 . . . . 70.34 109.186 176.865 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 87.37 -11.91 64.33 Favored Glycine 0 N--CA 1.475 1.285 0 CA-C-N 116.042 -0.526 . . . . 64.42 113.967 -178.567 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 33.7 tt0 -132.77 174.1 10.67 Favored 'General case' 0 N--CA 1.477 0.894 0 N-CA-C 108.395 -0.965 . . . . 73.03 108.395 -178.398 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 45.6 m -62.6 81.74 0.02 OUTLIER 'General case' 0 N--CA 1.477 0.893 0 C-N-CA 123.936 0.894 . . . . 60.24 111.62 177.247 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 35.4 m -72.27 -43.33 64.43 Favored 'General case' 0 C--O 1.224 -0.289 0 CA-C-N 115.143 -0.935 . . . . 64.31 109.615 175.748 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 98' ' ' ARG . . . . . 0.495 ' NH1' ' HB3' ' A' ' 75' ' ' GLU . 6.9 ttp180 -59.92 -48.53 81.34 Favored 'General case' 0 CA--C 1.536 0.431 0 O-C-N 124.215 0.947 . . . . 52.54 112.705 -169.417 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 1.5 tm0? -62.96 -55.41 26.1 Favored 'General case' 0 N--CA 1.472 0.651 0 N-CA-C 109.595 -0.52 . . . . 61.14 109.595 -175.071 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 65.4 tttp -56.5 -54.2 48.59 Favored 'General case' 0 CA--C 1.543 0.7 0 O-C-N 123.963 0.789 . . . . 73.22 111.105 -179.868 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 46.8 t -67.53 -55.58 12.94 Favored 'General case' 0 CA--C 1.538 0.516 0 C-N-CA 123.686 0.794 . . . . 64.45 112.022 -171.775 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 8.0 mp -76.83 -30.54 56.4 Favored 'General case' 0 N--CA 1.485 1.282 0 N-CA-C 112.518 0.562 . . . . 63.14 112.518 -172.142 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 8.2 t30 -75.64 -41.87 53.03 Favored 'General case' 0 N--CA 1.485 1.316 0 CA-C-N 118.34 0.518 . . . . 63.51 110.257 177.46 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 104' ' ' ASN . . . . . 0.478 ' O ' ' HG2' ' A' ' 108' ' ' ARG . 28.0 t-20 -62.8 -44.28 96.57 Favored 'General case' 0 N--CA 1.481 1.084 0 N-CA-C 109.165 -0.68 . . . . 54.35 109.165 173.725 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -59.62 -38.27 80.88 Favored 'General case' 0 C--N 1.353 0.745 0 C-N-CA 123.843 0.857 . . . . 55.21 111.436 178.561 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 106' ' ' TYR . . . . . . . . . . . . . 4.3 t80 -61.0 -48.64 80.89 Favored 'General case' 0 CA--C 1.54 0.583 0 N-CA-C 108.738 -0.838 . . . . 75.31 108.738 175.104 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -61.93 -36.86 93.46 Favored Glycine 0 C--N 1.353 1.474 0 O-C-N 123.845 0.716 . . . . 64.14 112.786 -179.813 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 108' ' ' ARG . . . . . 0.478 ' HG2' ' O ' ' A' ' 104' ' ' ASN . 34.1 mmt180 -70.59 -40.38 73.28 Favored 'General case' 0 N--CA 1.473 0.679 0 C-N-CA 123.177 0.591 . . . . 61.21 110.035 -179.79 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 109' ' ' LEU . . . . . 0.413 ' HA ' ' N ' ' A' ' 114' ' ' LEU . 59.7 tp -66.75 -39.66 87.99 Favored 'General case' 0 N--CA 1.48 1.064 0 C-N-CA 123.741 0.816 . . . . 72.53 110.271 178.924 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 23.3 t -76.03 -27.76 57.44 Favored 'General case' 0 CA--C 1.543 0.696 0 CA-C-N 114.888 -1.051 . . . . 63.42 110.397 -179.802 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . -90.03 -67.04 1.21 Allowed Glycine 0 C--N 1.361 1.941 0 CA-C-O 119.194 -0.781 . . . . 61.14 113.698 -177.665 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 112' ' ' MET . . . . . 0.683 ' HB2' ' HB3' ' A' ' 118' ' ' ALA . 3.1 tmm? -97.15 -66.14 0.92 Allowed 'General case' 0 N--CA 1.481 1.088 0 CA-C-N 118.369 1.085 . . . . 75.21 110.605 179.289 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 113' ' ' LEU . . . . . 0.715 HD11 HG21 ' A' ' 56' ' ' ILE . 19.7 tp 160.21 54.35 0.0 OUTLIER 'General case' 0 N--CA 1.489 1.498 0 C-N-CA 126.378 1.871 . . . . 74.24 108.501 -178.501 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 114' ' ' LEU . . . . . 0.413 ' N ' ' HA ' ' A' ' 109' ' ' LEU . 22.3 tp 61.05 58.75 2.18 Favored 'General case' 0 CA--C 1.543 0.702 0 C-N-CA 125.764 1.626 . . . . 72.53 111.911 176.271 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 115' ' ' VAL . . . . . . . . . . . . . 24.3 m -132.97 140.92 39.13 Favored Pre-proline 0 N--CA 1.478 0.931 0 CA-C-N 114.857 -1.065 . . . . 74.15 108.326 170.586 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 10.1 Cg_exo -70.57 79.69 1.18 Allowed 'Trans proline' 0 C--N 1.374 1.887 0 C-N-CA 122.768 2.312 . . . . 72.41 111.817 -179.938 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 31.0 t70 -158.75 -71.97 0.09 Allowed 'General case' 0 C--N 1.349 0.571 0 CA-C-N 115.315 -0.857 . . . . 74.3 110.664 -178.055 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 118' ' ' ALA . . . . . 0.683 ' HB3' ' HB2' ' A' ' 112' ' ' MET . . . -103.34 108.33 58.71 Favored Pre-proline 0 N--CA 1.477 0.883 0 C-N-CA 123.441 0.696 . . . . 73.34 111.042 -173.559 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 119' ' ' PRO . . . . . . . . . . . . . 83.2 Cg_endo -91.54 142.52 2.85 Favored 'Trans proline' 0 C--N 1.369 1.649 0 C-N-CA 122.913 2.409 . . . . 74.25 111.035 167.402 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . -154.43 165.07 31.79 Favored Glycine 0 N--CA 1.466 0.696 0 N-CA-C 112.302 -0.319 . . . . 61.14 112.302 -176.338 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . -159.37 157.47 30.41 Favored 'General case' 0 N--CA 1.472 0.645 0 C-N-CA 123.238 0.615 . . . . 75.23 110.046 179.992 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 122' ' ' SER . . . . . . . . . . . . . 30.9 m . . . . . 0 C--O 1.249 1.07 0 C-N-CA 123.656 0.782 . . . . 75.21 109.367 -179.077 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 25.3 ttt . . . . . 0 CA--C 1.553 1.078 0 CA-C-O 119.495 -0.288 . . . . 61.41 110.856 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 37.1 p -56.03 -49.08 74.68 Favored 'General case' 0 N--CA 1.487 1.405 0 N-CA-C 112.704 0.631 . . . . 72.14 112.704 -172.142 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 55.2 m -68.41 -26.67 65.65 Favored 'General case' 0 N--CA 1.483 1.183 0 C-N-CA 122.459 0.304 . . . . 73.42 111.774 -178.597 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 4' ' ' THR . . . . . 0.515 HG21 HD13 ' A' ' 60' ' ' ILE . 28.2 m -75.02 -41.3 59.56 Favored 'General case' 0 C--N 1.349 0.566 0 C-N-CA 123.191 0.596 . . . . 73.42 110.755 177.37 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 87.9 t -68.32 -36.36 74.7 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.817 0 C-N-CA 123.381 0.673 . . . . 65.11 109.438 177.361 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 42.2 mm-40 -62.37 -46.62 87.82 Favored 'General case' 0 N--CA 1.478 0.931 0 C-N-CA 123.761 0.824 . . . . 74.34 110.566 173.252 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 31.0 t80 -64.93 -47.91 76.0 Favored 'General case' 0 N--CA 1.475 0.821 0 O-C-N 123.989 0.805 . . . . 74.32 110.603 -175.878 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 8' ' ' ILE . . . . . 0.499 HD11 HG23 ' A' ' 60' ' ' ILE . 77.4 mt -65.75 -36.96 78.81 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.856 0 C-N-CA 123.607 0.763 . . . . 70.43 110.439 178.577 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 26.0 t-20 -73.29 -27.8 61.75 Favored 'General case' 0 N--CA 1.489 1.489 0 C-N-CA 123.201 0.6 . . . . 73.25 111.195 -179.681 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 10' ' ' ARG . . . . . 0.587 ' HB3' HG22 ' A' ' 47' ' ' VAL . 62.7 mtt85 -72.11 -37.43 69.51 Favored 'General case' 0 CA--C 1.54 0.595 0 C-N-CA 123.054 0.542 . . . . 71.44 109.754 173.038 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 11' ' ' TRP . . . . . . . . . . . . . 86.5 m95 -76.14 -20.92 57.17 Favored 'General case' 0 N--CA 1.475 0.824 0 CA-C-N 116.043 -0.526 . . . . 70.13 111.549 172.012 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 53.5 mt-30 -68.15 -46.38 70.93 Favored 'General case' 0 C--N 1.359 0.982 0 N-CA-C 107.553 -1.276 . . . . 65.12 107.553 168.839 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 13' ' ' ARG . . . . . 0.668 ' HE ' HD11 ' A' ' 17' ' ' LEU . 16.2 tpt180 -59.02 -46.66 87.64 Favored 'General case' 0 CA--C 1.548 0.868 0 O-C-N 123.8 0.688 . . . . 74.41 110.927 -177.622 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 14' ' ' ILE . . . . . 0.441 HD13 HG13 ' A' ' 44' ' ' ILE . 56.8 mt -66.21 -52.81 43.5 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.095 0 O-C-N 123.201 0.313 . . . . 72.44 110.607 177.8 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 15' ' ' ALA . . . . . 0.569 ' HA ' ' HB ' ' A' ' 71' ' ' THR . . . -56.56 -45.15 81.43 Favored 'General case' 0 N--CA 1.488 1.436 0 C-N-CA 123.828 0.851 . . . . 34.12 111.794 -177.032 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 97.0 mt -78.58 -40.6 34.23 Favored 'General case' 0 N--CA 1.481 1.119 0 CA-C-N 114.923 -1.035 . . . . 72.45 111.39 -171.904 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.668 HD11 ' HE ' ' A' ' 13' ' ' ARG . 30.3 mt -64.0 -51.3 64.89 Favored 'General case' 0 C--N 1.36 1.05 0 CA-C-O 119.166 -0.445 . . . . 74.1 110.478 177.536 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 80.5 p -62.31 -36.47 82.25 Favored 'General case' 0 N--CA 1.478 0.945 0 O-C-N 123.789 0.681 . . . . 75.04 111.123 -179.94 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 30.9 tp60 -62.19 -44.39 96.68 Favored 'General case' 0 C--N 1.358 0.976 0 C-N-CA 123.288 0.635 . . . . 72.42 110.305 175.105 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 63.4 m -62.04 -43.84 97.97 Favored 'General case' 0 C--O 1.214 -0.782 0 O-C-N 123.918 0.761 . . . . 63.43 109.663 176.975 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 21' ' ' LEU . . . . . 0.714 HD22 ' HA ' ' A' ' 33' ' ' LEU . 52.4 mt -64.15 -31.92 73.3 Favored 'General case' 0 C--N 1.351 0.638 0 C-N-CA 123.268 0.627 . . . . 75.24 110.54 -178.009 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.721 ' HA ' HD21 ' A' ' 78' ' ' LEU . 50.7 tp -66.85 -54.64 20.38 Favored 'General case' 0 N--CA 1.48 1.039 0 C-N-CA 123.096 0.558 . . . . 55.11 110.082 176.173 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 23' ' ' GLU . . . . . 0.412 ' HB3' ' NH1' ' A' ' 27' ' ' ARG . 11.6 mm-40 -52.69 -52.48 55.81 Favored 'General case' 0 CA--C 1.547 0.858 0 C-N-CA 124.593 1.157 . . . . 74.15 111.414 177.935 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.448 HD22 HD12 ' A' ' 32' ' ' LEU . 77.8 mt -63.45 -43.78 96.39 Favored 'General case' 0 CA--C 1.538 0.516 0 CA-C-N 114.485 -1.234 . . . . 65.34 110.941 -176.752 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 25' ' ' ALA . . . . . 0.516 ' HB2' HD21 ' A' ' 33' ' ' LEU . . . -58.28 -48.35 80.75 Favored 'General case' 0 N--CA 1.483 1.214 0 C-N-CA 123.264 0.625 . . . . 62.33 110.884 -179.838 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 96.3 mt-30 -63.77 -37.46 87.46 Favored 'General case' 0 CA--C 1.545 0.777 0 CA-C-N 114.815 -1.084 . . . . 74.3 110.904 179.716 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 27' ' ' ARG . . . . . 0.412 ' NH1' ' HB3' ' A' ' 23' ' ' GLU . 78.2 mtt180 -87.97 3.78 47.41 Favored 'General case' 0 N--CA 1.482 1.152 0 C-N-CA 123.793 0.837 . . . . 74.2 112.793 -178.222 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 83.97 12.12 77.57 Favored Glycine 0 C--N 1.351 1.405 0 N-CA-C 115.06 0.784 . . . . 75.42 115.06 171.876 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 29' ' ' GLU . . . . . 0.433 ' HB2' ' HB3' ' A' ' 24' ' ' LEU . 14.3 mm-40 -91.02 50.71 1.82 Allowed 'General case' 0 CA--C 1.55 0.977 0 C-N-CA 124.649 1.18 . . . . 70.44 110.464 176.053 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 30' ' ' TRP . . . . . 0.602 ' HA ' HD13 ' A' ' 33' ' ' LEU . 75.3 m95 -64.55 -26.67 68.52 Favored 'General case' 0 N--CA 1.485 1.295 0 C-N-CA 123.204 0.601 . . . . 75.13 111.005 -178.257 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 8.8 m-20 -57.03 -42.81 81.13 Favored 'General case' 0 N--CA 1.478 0.927 0 C-N-CA 123.274 0.63 . . . . 63.22 110.393 172.98 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.448 HD12 HD22 ' A' ' 24' ' ' LEU . 76.1 mt -72.08 -18.93 61.89 Favored 'General case' 0 CA--C 1.547 0.839 0 CA-C-N 116.237 -0.438 . . . . 72.42 111.354 -178.882 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 33' ' ' LEU . . . . . 0.714 ' HA ' HD22 ' A' ' 21' ' ' LEU . 10.2 mp -69.37 -46.95 65.73 Favored 'General case' 0 N--CA 1.485 1.307 0 N-CA-C 109.254 -0.647 . . . . 65.53 109.254 167.317 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 59.8 mt -61.41 -38.68 87.97 Favored 'General case' 0 N--CA 1.483 1.212 0 O-C-N 123.99 0.807 . . . . 74.21 111.306 179.291 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -69.05 -45.27 70.83 Favored 'General case' 0 N--CA 1.481 1.116 0 C-N-CA 123.955 0.902 . . . . 75.32 111.34 -179.996 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 36' ' ' GLN . . . . . 0.485 ' HB2' HD21 ' A' ' 21' ' ' LEU . 87.1 mm-40 -81.42 -15.35 55.4 Favored 'General case' 0 N--CA 1.487 1.423 0 C-N-CA 122.791 0.436 . . . . 63.14 111.634 -178.282 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 37' ' ' GLU . . . . . 0.464 ' HG3' ' HB3' ' A' ' 89' ' ' LEU . 24.1 tt0 -45.81 -65.97 0.47 Allowed 'General case' 0 N--CA 1.48 1.048 0 C-N-CA 124.849 1.259 . . . . 72.25 113.282 -176.559 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 48.9 t -61.62 -35.44 67.22 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.087 0 C-N-CA 123.682 0.793 . . . . 54.13 111.104 -170.472 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 49.1 m -65.57 -49.29 69.38 Favored 'General case' 0 CA--C 1.54 0.563 0 C-N-CA 123.788 0.835 . . . . 74.23 110.729 176.573 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 38.0 t80 -60.99 -40.51 93.74 Favored 'General case' 0 N--CA 1.48 1.032 0 C-N-CA 124.203 1.001 . . . . 74.14 110.982 -178.862 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 41' ' ' LEU . . . . . 0.672 ' HB3' HD21 ' A' ' 92' ' ' LEU . 69.7 mt -70.14 -48.31 57.96 Favored 'General case' 0 C--O 1.252 1.185 0 O-C-N 124.613 1.195 . . . . 75.4 111.761 -175.292 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 46.6 tt0 -63.27 -39.48 94.7 Favored 'General case' 0 CA--C 1.551 1.015 0 CA-C-N 115.592 -0.731 . . . . 72.45 109.831 177.644 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 43' ' ' SER . . . . . 0.561 ' O ' HG23 ' A' ' 47' ' ' VAL . 67.2 m -61.96 -56.39 19.61 Favored 'General case' 0 C--N 1.356 0.862 0 C-N-CA 123.28 0.632 . . . . 51.54 111.022 178.27 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 44' ' ' ILE . . . . . 0.441 HG13 HD13 ' A' ' 14' ' ' ILE . 11.5 tt -58.04 -42.16 82.18 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.36 0 C-N-CA 123.729 0.812 . . . . 52.04 110.977 -173.756 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 72.1 mm-40 -60.81 -48.45 81.75 Favored 'General case' 0 C--N 1.362 1.151 0 O-C-N 123.492 0.495 . . . . 54.33 111.272 175.174 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 66.9 m -57.06 -39.12 74.29 Favored 'General case' 0 N--CA 1.489 1.515 0 C-N-CA 122.991 0.516 . . . . 75.34 111.895 178.971 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 47' ' ' VAL . . . . . 0.587 HG22 ' HB3' ' A' ' 10' ' ' ARG . 43.3 t -65.98 -44.75 92.16 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.173 0 C-N-CA 123.302 0.641 . . . . 45.54 110.377 -178.479 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 48' ' ' MET . . . . . 0.562 ' SD ' ' HB2' ' A' ' 101' ' ' SER . 75.2 mtm -69.75 -27.23 64.77 Favored 'General case' 0 N--CA 1.485 1.276 0 CA-C-N 116.093 -0.503 . . . . 70.1 111.8 179.221 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 38.5 mt-10 -71.22 -24.47 62.21 Favored 'General case' 0 N--CA 1.481 1.107 0 C-N-CA 123.037 0.535 . . . . 74.2 111.319 173.868 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -87.04 142.5 27.89 Favored 'General case' 0 N--CA 1.478 0.974 0 C-N-CA 123.203 0.601 . . . . 73.43 110.28 -178.944 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 8.8 tt0 -85.56 158.52 20.11 Favored 'General case' 0 N--CA 1.474 0.755 0 C-N-CA 123.761 0.824 . . . . 72.12 110.017 -178.921 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 52' ' ' THR . . . . . 0.451 ' OG1' ' HB3' ' A' ' 114' ' ' LEU . 22.0 m -78.36 129.87 73.52 Favored Pre-proline 0 CA--C 1.546 0.823 0 C-N-CA 123.119 0.567 . . . . 72.13 110.263 175.514 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 53' ' ' PRO . . . . . 0.51 ' HG3' ' HA ' ' A' ' 4' ' ' THR . 56.8 Cg_endo -67.01 157.88 59.56 Favored 'Trans proline' 0 C--N 1.376 2.022 0 C-N-CA 123.2 2.6 . . . . 54.31 112.652 177.754 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 38.8 Cg_endo -65.49 -45.54 6.83 Favored 'Trans proline' 0 C--N 1.375 1.948 0 C-N-CA 122.843 2.362 . . . . 72.2 112.75 176.397 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . -69.2 78.8 0.3 Allowed Glycine 0 C--N 1.359 1.843 0 O-C-N 123.765 0.666 . . . . 63.51 114.054 -175.488 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 23.8 mm -117.91 136.39 55.26 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.575 0 C-N-CA 124.752 1.221 . . . . 71.44 108.337 178.444 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 72.2 p -106.66 179.12 4.36 Favored 'General case' 0 N--CA 1.473 0.717 0 N-CA-C 108.537 -0.912 . . . . 50.21 108.537 168.121 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 29.8 tpt180 -65.96 -43.36 88.16 Favored 'General case' 0 CA--C 1.54 0.588 0 N-CA-C 109.819 -0.437 . . . . 72.24 109.819 174.549 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 71.4 p -62.64 -42.45 99.61 Favored 'General case' 0 CA--C 1.545 0.762 0 C-N-CA 123.5 0.72 . . . . 71.4 110.934 -179.544 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 60' ' ' ILE . . . . . 0.515 HD13 HG21 ' A' ' 4' ' ' THR . 93.9 mt -59.81 -45.65 94.56 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.019 0 C-N-CA 123.806 0.842 . . . . 61.1 110.513 173.762 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 64.5 tt0 -59.91 -37.39 79.28 Favored 'General case' 0 N--CA 1.478 0.932 0 C-N-CA 123.875 0.87 . . . . 74.24 111.104 179.657 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 70.5 m-20 -71.21 -39.44 71.74 Favored 'General case' 0 N--CA 1.481 1.112 0 C-N-CA 123.383 0.673 . . . . 61.11 111.02 179.085 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 63' ' ' MET . . . . . . . . . . . . . 71.0 mtm -71.31 -41.58 69.72 Favored 'General case' 0 N--CA 1.481 1.099 0 C-N-CA 122.923 0.489 . . . . 54.44 111.649 -178.997 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 64' ' ' VAL . . . . . 0.456 ' O ' HG13 ' A' ' 68' ' ' ILE . 85.8 t -67.9 -55.69 15.8 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.755 0 N-CA-C 109.531 -0.544 . . . . 54.01 109.531 179.497 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 65' ' ' ALA . . . . . 0.594 ' HB2' HD23 ' A' ' 109' ' ' LEU . . . -63.07 -28.38 70.04 Favored 'General case' 0 N--CA 1.488 1.472 0 O-C-N 123.351 0.407 . . . . 54.01 110.849 178.594 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -67.02 -40.79 93.32 Favored Glycine 0 C--N 1.35 1.345 0 O-C-N 123.562 0.539 . . . . 53.22 112.519 175.531 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 16.6 m-30 -72.54 -38.82 67.91 Favored 'General case' 0 N--CA 1.48 1.074 0 C-N-CA 123.328 0.651 . . . . 65.53 110.988 178.189 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 68' ' ' ILE . . . . . 0.558 ' O ' ' HG ' ' A' ' 72' ' ' LEU . 78.3 mt -57.96 -50.43 77.93 Favored 'Isoleucine or valine' 0 C--N 1.353 0.736 0 O-C-N 124.575 1.172 . . . . 41.31 108.361 173.783 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 69' ' ' LYS . . . . . 0.597 ' HB2' ' HE2' ' A' ' 106' ' ' TYR . 0.7 OUTLIER -57.83 -49.07 77.92 Favored 'General case' 0 C--N 1.353 0.757 0 C-N-CA 123.886 0.874 . . . . 73.14 110.673 -178.847 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 58.9 tt0 -58.25 -44.88 88.53 Favored 'General case' 0 N--CA 1.471 0.593 0 O-C-N 124.705 1.253 . . . . 75.51 110.784 -176.984 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 71' ' ' THR . . . . . 0.569 ' HB ' ' HA ' ' A' ' 15' ' ' ALA . 12.8 t -76.93 -22.43 53.31 Favored 'General case' 0 C--O 1.21 -0.999 0 CA-C-O 118.846 -0.597 . . . . 73.31 110.344 -177.965 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 72' ' ' LEU . . . . . 0.731 HD21 ' HB3' ' A' ' 102' ' ' LEU . 40.5 mt -72.23 -32.98 67.21 Favored 'General case' 0 N--CA 1.49 1.57 0 CA-C-N 118.136 0.426 . . . . 75.5 110.789 173.5 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 38.8 m-20 -64.13 -49.87 70.47 Favored 'General case' 0 N--CA 1.477 0.91 0 N-CA-C 108.542 -0.91 . . . . 61.31 108.542 172.071 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 70.5 m-20 -62.28 -37.08 84.12 Favored 'General case' 0 N--CA 1.478 0.964 0 CA-C-N 115.037 -0.983 . . . . 71.3 111.566 179.96 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 75' ' ' GLU . . . . . 0.435 ' HG2' ' O ' ' A' ' 71' ' ' THR . 17.2 mm-40 -66.47 -51.62 54.89 Favored 'General case' 0 N--CA 1.481 1.094 0 C-N-CA 123.316 0.646 . . . . 54.35 110.275 178.667 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 9.1 tt0 -58.09 -48.85 78.9 Favored 'General case' 0 N--CA 1.475 0.818 0 O-C-N 123.492 0.495 . . . . 75.3 110.807 -177.778 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 96.8 mt -63.63 -57.13 11.03 Favored 'General case' 0 N--CA 1.471 0.625 0 O-C-N 123.975 0.797 . . . . 73.52 111.043 -176.959 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 78' ' ' LEU . . . . . 0.721 HD21 ' HA ' ' A' ' 22' ' ' LEU . 82.4 mt -63.54 -66.47 0.54 Allowed 'General case' 0 N--CA 1.481 1.107 0 O-C-N 123.553 0.533 . . . . 73.41 111.785 -178.514 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 33.0 mmtp -59.54 -35.15 73.66 Favored 'General case' 0 N--CA 1.475 0.793 0 O-C-N 124.219 0.95 . . . . 71.22 110.928 -173.808 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -66.69 -40.26 93.91 Favored Glycine 0 C--N 1.355 1.606 0 O-C-N 123.526 0.516 . . . . 71.41 113.019 175.069 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 8.2 tt -66.21 -36.96 84.42 Favored 'General case' 0 N--CA 1.485 1.322 0 C-N-CA 123.465 0.706 . . . . 75.24 109.737 177.092 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 95.1 mt -77.73 -36.76 50.53 Favored 'General case' 0 N--CA 1.473 0.71 0 C-N-CA 123.955 0.902 . . . . 73.31 111.328 -175.516 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 55.8 tt0 -168.98 -74.34 0.02 OUTLIER 'General case' 0 N--CA 1.477 0.901 0 C-N-CA 123.657 0.783 . . . . 75.23 109.714 177.796 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 73.9 mm-40 -157.17 168.0 28.73 Favored 'General case' 0 N--CA 1.489 1.475 0 C-N-CA 125.709 1.603 . . . . 74.52 108.309 -178.457 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 85' ' ' ARG . . . . . . . . . . . . . 81.4 mtm-85 -65.1 82.91 0.04 OUTLIER 'General case' 0 N--CA 1.486 1.338 0 C-N-CA 123.248 0.619 . . . . 74.31 111.042 -178.846 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 86' ' ' LEU . . . . . 0.699 HD21 ' HA ' ' A' ' 96' ' ' SER . 9.4 mt -174.58 151.85 1.57 Allowed 'General case' 0 N--CA 1.476 0.861 0 C-N-CA 126.24 1.816 . . . . 70.42 107.678 -179.951 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 87' ' ' ASP . . . . . 0.503 ' HB2' ' NH1' ' A' ' 98' ' ' ARG . 2.6 m-20 -76.58 84.58 3.25 Favored 'General case' 0 C--O 1.242 0.677 0 N-CA-C 108.707 -0.849 . . . . 63.23 108.707 177.169 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -74.03 -16.66 61.04 Favored 'General case' 0 CA--C 1.547 0.827 0 CA-C-N 114.76 -1.109 . . . . 75.3 109.702 169.158 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 89' ' ' LEU . . . . . 0.464 ' HB3' ' HG3' ' A' ' 37' ' ' GLU . 88.4 mt -49.54 -49.51 45.8 Favored 'General case' 0 C--N 1.358 0.96 0 C-N-CA 124.42 1.088 . . . . 73.3 110.234 168.154 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 90' ' ' SER . . . . . 0.415 ' HB3' ' CD1' ' A' ' 41' ' ' LEU . 31.3 t -169.64 129.36 1.0 Allowed 'General case' 0 CA--C 1.542 0.648 0 CA-C-N 114.651 -1.159 . . . . 43.1 108.242 172.682 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 19.8 m -69.6 111.44 5.41 Favored 'General case' 0 CA--C 1.539 0.552 0 C-N-CA 123.702 0.801 . . . . 73.05 109.83 -177.0 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 92' ' ' LEU . . . . . 0.672 HD21 ' HB3' ' A' ' 41' ' ' LEU . 94.7 mt -67.81 -75.43 0.1 Allowed 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 124.238 1.015 . . . . 63.44 110.607 -179.447 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 42.6 mt -124.46 65.87 0.3 Allowed 'Isoleucine or valine' 0 CA--C 1.546 0.811 0 N-CA-C 107.537 -1.282 . . . . 71.24 107.537 172.621 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 48.39 -87.53 0.01 OUTLIER Glycine 0 C--N 1.363 2.081 0 CA-C-N 114.219 -1.355 . . . . 65.24 115.157 172.322 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 5.8 pm0 -66.49 -173.52 0.22 Allowed 'General case' 0 N--CA 1.477 0.878 0 C-N-CA 124.564 1.145 . . . . 74.1 111.461 178.628 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 96' ' ' SER . . . . . 0.699 ' HA ' HD21 ' A' ' 86' ' ' LEU . 44.5 m -80.42 38.57 0.43 Allowed 'General case' 0 CA--C 1.545 0.78 0 N-CA-C 113.289 0.848 . . . . 60.31 113.289 -173.037 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 39.1 m -49.48 -61.12 2.28 Favored 'General case' 0 N--CA 1.48 1.026 0 C-N-CA 124.014 0.926 . . . . 64.42 110.828 173.028 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 98' ' ' ARG . . . . . 0.642 ' HD2' ' HB2' ' A' ' 92' ' ' LEU . 0.0 OUTLIER -47.62 -56.07 7.99 Favored 'General case' 0 CA--C 1.552 1.036 0 C-N-CA 125.955 1.702 . . . . 74.42 113.533 178.306 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 31.0 mm-40 -66.28 -43.65 85.78 Favored 'General case' 0 N--CA 1.482 1.157 0 C-N-CA 122.968 0.507 . . . . 74.52 111.068 -175.375 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 13.8 tmtt? -63.36 -38.13 89.97 Favored 'General case' 0 C--O 1.217 -0.629 0 CA-C-N 114.897 -1.047 . . . . 74.02 110.638 178.579 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 101' ' ' SER . . . . . 0.562 ' HB2' ' SD ' ' A' ' 48' ' ' MET . 73.1 m -78.33 -32.15 49.06 Favored 'General case' 0 N--CA 1.479 0.981 0 C-N-CA 123.08 0.552 . . . . 74.11 112.076 -172.9 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 102' ' ' LEU . . . . . 0.731 ' HB3' HD21 ' A' ' 72' ' ' LEU . 10.0 mp -71.29 -43.3 67.41 Favored 'General case' 0 N--CA 1.483 1.184 0 N-CA-C 110.074 -0.343 . . . . 62.11 110.074 172.561 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 8.9 t30 -64.08 -41.01 97.47 Favored 'General case' 0 N--CA 1.481 1.079 0 CA-C-O 121.159 0.504 . . . . 75.23 110.507 176.625 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 7.2 t30 -64.05 -39.3 93.77 Favored 'General case' 0 N--CA 1.478 0.958 0 C-N-CA 124.397 1.079 . . . . 75.22 109.469 176.54 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -59.41 -48.39 81.82 Favored 'General case' 0 C--N 1.347 0.467 0 O-C-N 124.049 0.843 . . . . 74.32 110.444 178.598 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 106' ' ' TYR . . . . . 0.597 ' HE2' ' HB2' ' A' ' 69' ' ' LYS . 20.0 t80 -59.47 -56.32 23.44 Favored 'General case' 0 CA--C 1.55 0.957 0 O-C-N 123.867 0.73 . . . . 73.1 111.074 179.8 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -69.0 -41.01 83.62 Favored Glycine 0 C--N 1.347 1.194 0 O-C-N 123.989 0.805 . . . . 70.34 113.302 -171.272 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 5.5 mmp_? -68.91 -33.91 74.53 Favored 'General case' 0 C--N 1.349 0.578 0 CA-C-O 119.258 -0.401 . . . . 65.2 110.455 177.42 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 109' ' ' LEU . . . . . 0.594 HD23 ' HB2' ' A' ' 65' ' ' ALA . 47.3 tp -61.56 -44.8 96.37 Favored 'General case' 0 N--CA 1.482 1.162 0 CA-C-O 120.888 0.375 . . . . 61.0 110.301 175.388 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 10.9 t -69.58 -34.28 73.91 Favored 'General case' 0 CA--C 1.554 1.127 0 CA-C-N 114.749 -1.114 . . . . 51.2 110.938 -179.043 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . -91.2 -63.27 1.19 Allowed Glycine 0 C--N 1.357 1.735 0 N-CA-C 114.454 0.542 . . . . 63.24 114.454 -177.649 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 112' ' ' MET . . . . . . . . . . . . . 3.8 mmm -93.13 -68.92 0.77 Allowed 'General case' 0 N--CA 1.489 1.481 0 CA-C-N 117.454 0.627 . . . . 72.31 112.021 -178.578 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 113' ' ' LEU . . . . . 0.525 HD22 ' H ' ' A' ' 120' ' ' GLY . 23.8 tp 174.01 13.41 0.0 OUTLIER 'General case' 0 N--CA 1.492 1.635 0 C-N-CA 125.172 1.389 . . . . 61.32 110.018 178.28 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 114' ' ' LEU . . . . . 0.451 ' HB3' ' OG1' ' A' ' 52' ' ' THR . 2.5 tt 83.0 -24.54 0.17 Allowed 'General case' 0 N--CA 1.5 2.063 0 C-N-CA 126.683 1.993 . . . . 52.15 109.842 -170.321 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 115' ' ' VAL . . . . . . . . . . . . . 7.2 p -113.17 135.96 21.77 Favored Pre-proline 0 CA--C 1.548 0.884 0 N-CA-C 107.097 -1.446 . . . . 73.42 107.097 176.167 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 97.5 Cg_endo -78.2 30.25 0.45 Allowed 'Trans proline' 0 C--N 1.376 1.985 0 C-N-CA 122.623 2.215 . . . . 71.51 113.218 178.21 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 26.8 t70 -85.72 -82.27 0.19 Allowed 'General case' 0 CA--C 1.549 0.934 0 C-N-CA 123.643 0.777 . . . . 73.12 110.747 -175.884 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -155.73 128.79 4.31 Favored Pre-proline 0 CA--C 1.546 0.794 0 C-N-CA 123.555 0.742 . . . . 62.15 109.037 -177.527 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 119' ' ' PRO . . . . . . . . . . . . . 48.5 Cg_endo -68.31 101.71 0.75 Allowed 'Trans proline' 0 C--N 1.377 2.045 0 C-N-CA 122.417 2.078 . . . . 62.43 111.587 179.46 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 120' ' ' GLY . . . . . 0.525 ' H ' HD22 ' A' ' 113' ' ' LEU . . . -113.99 18.42 19.05 Favored Glycine 0 C--N 1.347 1.15 0 CA-C-N 115.803 -0.635 . . . . 75.24 113.128 -178.77 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . -71.6 105.49 3.68 Favored 'General case' 0 CA--C 1.546 0.807 0 N-CA-C 109.877 -0.416 . . . . 53.53 109.877 177.827 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 122' ' ' SER . . . . . . . . . . . . . 48.8 m . . . . . 0 C--O 1.249 1.05 0 N-CA-C 109.253 -0.647 . . . . 51.14 109.253 177.431 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 1' ' ' MET . . . . . 0.45 ' HG3' HG23 ' A' ' 5' ' ' VAL . 16.7 ptt? . . . . . 0 N--CA 1.486 1.329 0 CA-C-O 120.683 0.278 . . . . 72.1 110.65 . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 9.2 t -54.6 -40.32 68.74 Favored 'General case' 0 N--CA 1.483 1.216 0 C-N-CA 123.353 0.661 . . . . 74.22 112.725 -172.766 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 17.2 m -72.46 -32.42 66.23 Favored 'General case' 0 N--CA 1.479 1.019 0 C-N-CA 123.247 0.619 . . . . 73.03 111.4 -178.758 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 52.5 m -74.57 -39.11 62.45 Favored 'General case' 0 C--O 1.217 -0.64 0 C-N-CA 123.07 0.548 . . . . 53.41 110.295 178.233 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 5' ' ' VAL . . . . . 0.45 HG23 ' HG3' ' A' ' 1' ' ' MET . 90.2 t -63.77 -40.48 89.2 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.905 0 C-N-CA 123.309 0.644 . . . . 64.04 109.297 176.581 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 33.9 mm-40 -57.1 -51.98 67.11 Favored 'General case' 0 N--CA 1.473 0.685 0 O-C-N 123.939 0.774 . . . . 63.34 110.625 171.228 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 42.6 t80 -61.88 -43.86 97.99 Favored 'General case' 0 CA--C 1.552 1.027 0 C-N-CA 124.106 0.962 . . . . 74.22 111.337 -173.464 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 8' ' ' ILE . . . . . 0.445 HD11 HG23 ' A' ' 60' ' ' ILE . 77.5 mt -63.84 -45.19 97.76 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.873 0 C-N-CA 123.772 0.829 . . . . 64.01 109.357 176.473 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 28.5 t-20 -67.09 -27.41 67.33 Favored 'General case' 0 N--CA 1.479 0.991 0 C-N-CA 123.834 0.854 . . . . 75.35 111.54 -177.25 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 10' ' ' ARG . . . . . 0.536 ' HB3' HG22 ' A' ' 47' ' ' VAL . 50.8 mtt180 -81.46 -28.02 34.34 Favored 'General case' 0 CA--C 1.543 0.684 0 C-N-CA 123.394 0.678 . . . . 74.24 110.191 176.477 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 11' ' ' TRP . . . . . . . . . . . . . 61.2 m95 -74.53 -28.21 60.87 Favored 'General case' 0 N--CA 1.474 0.774 0 CA-C-O 119.313 -0.375 . . . . 73.25 110.828 167.663 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 12' ' ' GLN . . . . . 0.49 ' HG2' ' CE2' ' A' ' 67' ' ' TYR . 41.1 mt-30 -67.52 -38.79 84.76 Favored 'General case' 0 C--N 1.358 0.956 0 N-CA-C 108.064 -1.087 . . . . 62.31 108.064 170.165 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 32.2 tpt180 -57.1 -55.54 33.38 Favored 'General case' 0 CA--C 1.542 0.643 0 CA-C-N 115.328 -0.851 . . . . 73.43 109.984 179.753 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 14' ' ' ILE . . . . . 0.431 HG22 ' OG1' ' A' ' 71' ' ' THR . 19.1 mt -64.81 -45.97 93.41 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.357 0 O-C-N 122.938 0.148 . . . . 73.25 111.001 179.806 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 15' ' ' ALA . . . . . 0.601 ' HA ' ' HB ' ' A' ' 71' ' ' THR . . . -58.05 -48.52 79.84 Favored 'General case' 0 N--CA 1.487 1.399 0 C-N-CA 124.406 1.082 . . . . 64.31 112.154 -176.426 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 87.0 mt -78.64 -37.44 42.09 Favored 'General case' 0 N--CA 1.48 1.051 0 CA-C-N 114.902 -1.045 . . . . 73.53 110.903 -173.085 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.508 ' O ' ' HG ' ' A' ' 21' ' ' LEU . 59.0 mt -62.46 -48.1 81.12 Favored 'General case' 0 N--CA 1.479 0.976 0 O-C-N 123.344 0.403 . . . . 70.34 110.461 176.816 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 78.5 p -64.63 -38.34 90.68 Favored 'General case' 0 N--CA 1.475 0.808 0 C-N-CA 123.01 0.524 . . . . 62.55 111.125 -179.804 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 7.0 tp-100 -60.83 -42.33 97.52 Favored 'General case' 0 C--N 1.354 0.782 0 O-C-N 123.704 0.628 . . . . 64.14 110.625 175.207 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 48.6 m -60.89 -48.77 80.31 Favored 'General case' 0 C--N 1.346 0.441 0 O-C-N 123.391 0.432 . . . . 65.33 110.071 175.611 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 21' ' ' LEU . . . . . 0.549 HD22 ' HA ' ' A' ' 33' ' ' LEU . 59.2 mt -64.8 -26.91 68.55 Favored 'General case' 0 N--CA 1.471 0.624 0 C-N-CA 123.62 0.768 . . . . 71.41 110.836 -178.114 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.636 ' HA ' HD21 ' A' ' 78' ' ' LEU . 46.0 tp -68.07 -58.35 4.64 Favored 'General case' 0 C--N 1.35 0.599 0 C-N-CA 123.376 0.67 . . . . 71.43 109.564 176.767 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 41.0 mt-10 -53.91 -46.03 71.34 Favored 'General case' 0 N--CA 1.48 1.031 0 C-N-CA 124.147 0.979 . . . . 75.24 111.073 -179.955 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.5 ' HB3' ' HB2' ' A' ' 29' ' ' GLU . 96.0 mt -67.08 -46.89 72.9 Favored 'General case' 0 CA--C 1.538 0.511 0 CA-C-N 114.661 -1.154 . . . . 43.53 111.455 -176.623 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 25' ' ' ALA . . . . . 0.435 ' HB2' HD21 ' A' ' 33' ' ' LEU . . . -64.16 -34.25 77.65 Favored 'General case' 0 N--CA 1.484 1.25 0 CA-C-N 117.971 0.351 . . . . 63.11 111.501 -179.555 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 98.0 mt-30 -63.65 -38.43 91.09 Favored 'General case' 0 N--CA 1.482 1.143 0 C-N-CA 123.333 0.653 . . . . 64.5 110.61 173.681 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 97.2 mtt180 -75.78 -17.39 59.89 Favored 'General case' 0 N--CA 1.483 1.197 0 C-N-CA 123.161 0.584 . . . . 70.21 111.868 174.775 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 92.3 20.79 34.31 Favored Glycine 0 C--N 1.346 1.127 0 N-CA-C 112.727 -0.149 . . . . 10.3 112.727 179.078 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 29' ' ' GLU . . . . . 0.5 ' HB2' ' HB3' ' A' ' 24' ' ' LEU . 49.3 mm-40 -84.54 68.77 10.44 Favored 'General case' 0 C--O 1.238 0.452 0 C-N-CA 124.312 1.045 . . . . 74.42 110.871 -179.775 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 30' ' ' TRP . . . . . . . . . . . . . 24.8 m95 -63.68 -42.18 98.07 Favored 'General case' 0 N--CA 1.475 0.788 0 CA-C-N 115.114 -0.948 . . . . 74.21 111.097 -176.134 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 9.8 m-20 -60.62 -41.68 95.33 Favored 'General case' 0 N--CA 1.478 0.971 0 C-N-CA 123.48 0.712 . . . . 74.22 110.893 -178.813 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 72.6 mt -64.47 -37.03 86.11 Favored 'General case' 0 N--CA 1.478 0.941 0 O-C-N 123.61 0.569 . . . . 62.34 111.211 -178.907 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 33' ' ' LEU . . . . . 0.549 ' HA ' HD22 ' A' ' 21' ' ' LEU . 10.7 mp -61.74 -46.92 87.54 Favored 'General case' 0 N--CA 1.486 1.325 0 CA-C-O 120.719 0.295 . . . . 74.12 110.24 172.365 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 91.2 mt -67.66 -26.97 66.47 Favored 'General case' 0 CA--C 1.549 0.915 0 C-N-CA 123.482 0.713 . . . . 64.4 112.18 -177.227 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 53.0 mt-30 -77.96 -36.78 48.72 Favored 'General case' 0 N--CA 1.48 1.035 0 C-N-CA 123.304 0.642 . . . . 74.13 110.619 176.705 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 30.9 mm-40 -82.79 -15.24 52.47 Favored 'General case' 0 N--CA 1.483 1.188 0 C-N-CA 123.09 0.556 . . . . 70.21 111.532 177.931 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 37' ' ' GLU . . . . . 0.428 ' O ' ' HG ' ' A' ' 41' ' ' LEU . 31.8 tt0 -45.49 -57.47 4.1 Favored 'General case' 0 N--CA 1.481 1.086 0 C-N-CA 124.681 1.192 . . . . 73.51 112.972 -174.823 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 46.1 t -58.04 -39.88 74.31 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.143 0 C-N-CA 123.344 0.658 . . . . 74.55 111.378 -175.514 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 74.3 m -68.38 -43.7 76.78 Favored 'General case' 0 N--CA 1.474 0.739 0 C-N-CA 123.097 0.559 . . . . 72.13 111.272 179.189 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 40' ' ' TYR . . . . . 0.408 ' O ' HG22 ' A' ' 44' ' ' ILE . 34.9 t80 -64.96 -47.51 77.36 Favored 'General case' 0 N--CA 1.471 0.61 0 O-C-N 123.824 0.703 . . . . 71.1 110.059 -177.128 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 41' ' ' LEU . . . . . 0.428 ' HG ' ' O ' ' A' ' 37' ' ' GLU . 57.8 mt -59.81 -50.53 73.46 Favored 'General case' 0 C--N 1.351 0.667 0 O-C-N 124.636 1.21 . . . . 73.24 110.082 178.952 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 53.4 tt0 -60.22 -41.72 93.69 Favored 'General case' 0 N--CA 1.476 0.87 0 O-C-N 123.637 0.585 . . . . 72.34 111.497 -178.442 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 43' ' ' SER . . . . . 0.487 ' O ' HG23 ' A' ' 47' ' ' VAL . 70.2 m -60.85 -60.38 3.88 Favored 'General case' 0 N--CA 1.471 0.591 0 C-N-CA 123.169 0.588 . . . . 75.31 110.641 -179.102 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 44' ' ' ILE . . . . . 0.458 HG12 ' HE2' ' A' ' 48' ' ' MET . 16.3 tt -63.37 -30.33 49.5 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.977 0 O-C-N 123.808 0.692 . . . . 72.42 111.321 -175.57 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 9.6 mm-40 -59.38 -55.12 38.7 Favored 'General case' 0 N--CA 1.481 1.103 0 C-N-CA 123.301 0.64 . . . . 65.41 110.796 171.226 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 46' ' ' THR . . . . . 0.411 ' O ' ' HB2' ' A' ' 50' ' ' LYS . 19.9 m -67.18 -23.8 65.8 Favored 'General case' 0 CA--C 1.55 0.967 0 CA-C-N 115.656 -0.702 . . . . 71.11 111.652 -174.369 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 47' ' ' VAL . . . . . 0.536 HG22 ' HB3' ' A' ' 10' ' ' ARG . 40.4 t -83.28 -35.82 12.2 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.086 0 C-N-CA 122.618 0.367 . . . . 72.33 111.143 176.532 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 48' ' ' MET . . . . . 0.458 ' HE2' HG12 ' A' ' 44' ' ' ILE . 74.6 mtm -70.13 -34.93 73.69 Favored 'General case' 0 N--CA 1.49 1.567 0 C-N-CA 122.504 0.321 . . . . 54.52 111.476 179.398 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 10.9 pt-20 -78.01 -22.53 49.16 Favored 'General case' 0 N--CA 1.478 0.964 0 C-N-CA 122.347 0.259 . . . . 74.22 110.443 175.776 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 50' ' ' LYS . . . . . 0.411 ' HB2' ' O ' ' A' ' 46' ' ' THR . 15.0 tppt? -69.21 133.77 48.39 Favored 'General case' 0 N--CA 1.473 0.686 0 C-N-CA 123.61 0.764 . . . . 74.04 111.117 -174.207 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 8.3 tt0 -83.72 128.41 34.51 Favored 'General case' 0 C--O 1.239 0.535 0 N-CA-C 108.886 -0.783 . . . . 71.14 108.886 174.757 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 17.1 m -70.36 134.29 86.95 Favored Pre-proline 0 CA--C 1.551 0.99 0 C-N-CA 124.058 0.943 . . . . 62.45 110.658 178.995 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 24.2 Cg_exo -66.5 152.52 80.65 Favored 'Trans proline' 0 C--N 1.378 2.089 0 C-N-CA 121.908 1.739 . . . . 74.55 111.961 171.954 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 21.3 Cg_exo -67.36 -46.78 2.61 Favored 'Trans proline' 0 C--N 1.372 1.809 0 C-N-CA 122.998 2.465 . . . . 64.11 111.685 173.354 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . -66.22 81.28 0.1 Allowed Glycine 0 C--N 1.351 1.396 0 O-C-N 124.112 0.882 . . . . 61.01 113.455 -178.651 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 56' ' ' ILE . . . . . 0.553 ' HB ' HD11 ' A' ' 113' ' ' LEU . 6.9 mt -137.87 117.6 15.37 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.515 0 C-N-CA 125.54 1.536 . . . . 75.12 107.702 178.325 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 57' ' ' THR . . . . . 0.499 ' H ' HD12 ' A' ' 60' ' ' ILE . 47.4 p -78.01 -178.26 5.44 Favored 'General case' 0 N--CA 1.473 0.682 0 C-N-CA 123.863 0.865 . . . . 71.45 110.482 -179.271 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 28.4 tpt180 -65.19 -45.17 85.88 Favored 'General case' 0 CA--C 1.542 0.644 0 CA-C-N 116.248 -0.433 . . . . 71.44 110.019 174.881 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 40.3 m -58.53 -42.46 87.82 Favored 'General case' 0 N--CA 1.485 1.276 0 CA-C-O 121.405 0.621 . . . . 71.52 111.096 179.732 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 60' ' ' ILE . . . . . 0.499 HD12 ' H ' ' A' ' 57' ' ' THR . 83.7 mt -66.68 -41.19 87.73 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.522 0 CA-C-N 115.073 -0.967 . . . . 62.04 110.104 178.25 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 58.9 tt0 -62.17 -36.22 81.19 Favored 'General case' 0 CA--C 1.547 0.844 0 C-N-CA 123.393 0.677 . . . . 73.44 110.43 177.332 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 65.9 m-20 -66.05 -46.55 77.39 Favored 'General case' 0 N--CA 1.48 1.057 0 C-N-CA 123.288 0.635 . . . . 65.41 110.764 178.518 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 63' ' ' MET . . . . . . . . . . . . . 71.1 mtm -65.74 -51.9 55.5 Favored 'General case' 0 N--CA 1.482 1.175 0 O-C-N 123.557 0.536 . . . . 43.41 111.16 -179.007 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 64' ' ' VAL . . . . . 0.516 ' O ' HG13 ' A' ' 68' ' ' ILE . 77.1 t -57.98 -56.17 17.41 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.725 0 C-N-CA 123.955 0.902 . . . . 64.32 110.809 179.997 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 65' ' ' ALA . . . . . 0.482 ' HB2' HD23 ' A' ' 109' ' ' LEU . . . -59.14 -42.2 90.13 Favored 'General case' 0 N--CA 1.487 1.41 0 C-N-CA 123.05 0.54 . . . . 33.52 110.767 179.837 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -56.34 -42.69 89.36 Favored Glycine 0 C--N 1.344 1.026 0 O-C-N 124.153 0.908 . . . . 34.02 112.12 176.814 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 67' ' ' TYR . . . . . 0.49 ' CE2' ' HG2' ' A' ' 12' ' ' GLN . 16.7 m-30 -70.7 -37.79 73.6 Favored 'General case' 0 N--CA 1.478 0.945 0 C-N-CA 123.847 0.859 . . . . 75.03 111.946 179.09 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 68' ' ' ILE . . . . . 0.516 HG13 ' O ' ' A' ' 64' ' ' VAL . 64.7 mt -58.44 -58.88 4.69 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.027 0 O-C-N 124.169 0.918 . . . . 75.34 108.851 179.185 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 69' ' ' LYS . . . . . 0.482 ' HB2' ' HE2' ' A' ' 106' ' ' TYR . 20.1 ttpp -60.63 -41.12 94.23 Favored 'General case' 0 C--N 1.347 0.462 0 O-C-N 124.151 0.907 . . . . 61.42 110.243 -179.143 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 62.3 tt0 -57.02 -47.98 79.59 Favored 'General case' 0 N--CA 1.478 0.95 0 C-N-CA 123.538 0.735 . . . . 71.21 111.406 -178.788 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 71' ' ' THR . . . . . 0.601 ' HB ' ' HA ' ' A' ' 15' ' ' ALA . 9.1 t -77.64 -25.47 49.7 Favored 'General case' 0 C--N 1.351 0.647 0 N-CA-C 110.07 -0.345 . . . . 73.53 110.07 -175.469 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 72' ' ' LEU . . . . . 0.475 ' HG ' ' O ' ' A' ' 68' ' ' ILE . 37.5 mt -67.75 -38.8 83.95 Favored 'General case' 0 C--O 1.209 -1.07 0 O-C-N 123.507 0.504 . . . . 74.21 110.107 171.026 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 75.2 m-20 -73.62 -41.22 63.08 Favored 'General case' 0 N--CA 1.484 1.234 0 C-N-CA 123.53 0.732 . . . . 65.22 110.995 -178.544 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 74' ' ' ASN . . . . . 0.437 ' HA ' HD22 ' A' ' 22' ' ' LEU . 86.4 m-20 -61.79 -52.11 65.55 Favored 'General case' 0 N--CA 1.475 0.804 0 O-C-N 123.911 0.757 . . . . 63.33 109.558 178.491 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 75' ' ' GLU . . . . . 0.421 ' O ' ' HG2' ' A' ' 79' ' ' LYS . 17.3 tt0 -76.58 -19.22 58.11 Favored 'General case' 0 CA--C 1.552 1.042 0 CA-C-N 115.642 -0.708 . . . . 73.22 111.688 -178.101 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 59.7 tt0 -68.65 -46.74 68.37 Favored 'General case' 0 N--CA 1.488 1.448 0 N-CA-C 109.547 -0.538 . . . . 75.05 109.547 173.6 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 92.3 mt -61.26 -38.87 88.26 Favored 'General case' 0 C--N 1.346 0.449 0 CA-C-N 115.661 -0.699 . . . . 60.2 109.623 174.449 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 78' ' ' LEU . . . . . 0.636 HD21 ' HA ' ' A' ' 22' ' ' LEU . 50.3 mt -59.07 -42.64 90.87 Favored 'General case' 0 C--N 1.358 0.962 0 O-C-N 123.92 0.762 . . . . 75.12 111.833 172.805 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 79' ' ' LYS . . . . . 0.432 ' HD2' HD23 ' A' ' 86' ' ' LEU . 28.9 mmtm -57.08 -47.15 81.71 Favored 'General case' 0 N--CA 1.482 1.135 0 N-CA-C 109.735 -0.469 . . . . 74.02 109.735 176.608 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 80' ' ' GLY . . . . . 0.707 ' HA2' ' HA ' ' A' ' 84' ' ' GLN . . . -67.6 -28.75 73.56 Favored Glycine 0 C--N 1.344 0.998 0 O-C-N 124.518 1.136 . . . . 40.35 114.17 178.754 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 5.8 tt -85.43 -39.56 17.4 Favored 'General case' 0 N--CA 1.478 0.925 0 C-N-CA 124.309 1.044 . . . . 72.51 110.528 -173.279 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 67.5 mt -84.23 -43.39 14.94 Favored 'General case' 0 CA--C 1.548 0.885 0 C-N-CA 123.704 0.801 . . . . 72.24 111.265 -169.847 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 21.8 tp60 -151.48 1.29 0.38 Allowed 'General case' 0 N--CA 1.493 1.69 0 N-CA-C 112.192 0.441 . . . . 71.12 112.192 -177.801 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 84' ' ' GLN . . . . . 0.707 ' HA ' ' HA2' ' A' ' 80' ' ' GLY . 95.9 mt-30 62.65 19.25 11.21 Favored 'General case' 0 N--CA 1.491 1.584 0 C-N-CA 124.188 0.995 . . . . 70.51 111.267 -169.929 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 85' ' ' ARG . . . . . . . . . . . . . 34.2 ttt180 -165.17 172.72 12.17 Favored 'General case' 0 CA--C 1.55 0.966 0 C-N-CA 123.456 0.702 . . . . 74.52 109.658 -168.143 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 86' ' ' LEU . . . . . 0.432 HD23 ' HD2' ' A' ' 79' ' ' LYS . 89.9 mt -57.94 97.88 0.03 OUTLIER 'General case' 0 C--N 1.356 0.875 0 C-N-CA 124.578 1.151 . . . . 65.12 112.01 178.093 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 5.9 p-10 -86.44 -161.15 0.62 Allowed 'General case' 0 CA--C 1.553 1.072 0 C-N-CA 123.843 0.857 . . . . 71.23 109.945 175.778 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 9.5 tp10 -60.33 -24.88 65.37 Favored 'General case' 0 N--CA 1.483 1.209 0 C-N-CA 123.786 0.835 . . . . 73.22 113.066 -175.515 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 96.1 mt -65.83 -10.41 37.63 Favored 'General case' 0 N--CA 1.486 1.347 0 N-CA-C 113.299 0.852 . . . . 61.34 113.299 -177.299 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 94.7 p -82.58 -5.04 58.55 Favored 'General case' 0 N--CA 1.482 1.148 0 C-N-CA 122.957 0.503 . . . . 55.0 111.496 175.723 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 45.7 t -70.53 84.99 0.61 Allowed 'General case' 0 N--CA 1.481 1.103 0 C-N-CA 124.149 0.98 . . . . 61.02 110.497 178.426 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 92' ' ' LEU . . . . . 0.473 HD12 ' HG2' ' A' ' 98' ' ' ARG . 80.7 mt -141.31 -139.19 0.12 Allowed 'General case' 0 N--CA 1.476 0.861 0 C-N-CA 124.402 1.081 . . . . 52.4 108.492 -175.865 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 28.3 mt -45.84 -43.83 4.55 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.819 0 C-N-CA 123.87 0.868 . . . . 73.54 110.535 171.629 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -171.09 158.96 30.74 Favored Glycine 0 C--O 1.252 1.225 0 CA-C-N 114.227 -1.352 . . . . 72.12 111.167 175.162 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 4.9 pm0 -55.56 127.34 29.3 Favored 'General case' 0 CA--C 1.552 1.056 0 C-N-CA 124.248 1.019 . . . . 71.34 110.126 172.224 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 20.1 t 76.52 -46.29 0.52 Allowed 'General case' 0 N--CA 1.487 1.397 0 C-N-CA 125.618 1.567 . . . . 73.43 113.824 178.126 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 6.5 t -52.4 -32.32 38.4 Favored 'General case' 0 N--CA 1.491 1.583 0 C-N-CA 123.947 0.899 . . . . 71.2 112.624 -169.163 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 98' ' ' ARG . . . . . 0.473 ' HG2' HD12 ' A' ' 92' ' ' LEU . 0.0 OUTLIER -68.12 -33.84 75.26 Favored 'General case' 0 CA--C 1.55 0.961 0 O-C-N 123.875 0.734 . . . . 75.2 112.852 -175.076 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 93.6 mt-30 -66.51 -39.65 88.79 Favored 'General case' 0 N--CA 1.481 1.118 0 N-CA-C 109.176 -0.675 . . . . 71.43 109.176 175.649 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.29 -35.69 81.04 Favored 'General case' 0 C--O 1.214 -0.779 0 CA-C-N 115.153 -0.93 . . . . 73.11 110.497 172.697 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 62.4 m -63.53 -45.12 92.06 Favored 'General case' 0 N--CA 1.479 0.987 0 C-N-CA 123.152 0.581 . . . . 71.2 111.292 -177.226 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 9.1 mp -76.17 -38.79 56.18 Favored 'General case' 0 N--CA 1.485 1.323 0 O-C-N 123.186 0.304 . . . . 75.14 111.494 179.103 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 4.4 t-20 -63.52 -40.32 96.72 Favored 'General case' 0 N--CA 1.486 1.342 0 CA-C-O 121.244 0.545 . . . . 50.52 110.684 177.374 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 26.1 t-20 -72.27 -38.77 68.76 Favored 'General case' 0 N--CA 1.471 0.584 0 CA-C-N 115.271 -0.877 . . . . 72.52 109.492 178.876 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -62.59 -31.36 72.18 Favored 'General case' 0 N--CA 1.476 0.848 0 C-N-CA 123.408 0.683 . . . . 64.31 111.079 175.863 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 106' ' ' TYR . . . . . 0.482 ' HE2' ' HB2' ' A' ' 69' ' ' LYS . 2.9 t80 -67.71 -50.56 56.85 Favored 'General case' 0 C--N 1.35 0.628 0 N-CA-C 108.921 -0.77 . . . . 72.32 108.921 175.808 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -62.86 -30.3 76.75 Favored Glycine 0 C--N 1.351 1.381 0 O-C-N 123.608 0.568 . . . . 74.51 113.107 177.377 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 1.2 mpt_? -77.14 -29.43 54.65 Favored 'General case' 0 N--CA 1.468 0.461 0 C-N-CA 123.985 0.914 . . . . 72.03 110.185 176.67 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 109' ' ' LEU . . . . . 0.492 HD13 ' HB2' ' A' ' 114' ' ' LEU . 34.6 tp -71.7 -34.92 70.03 Favored 'General case' 0 N--CA 1.479 1.018 0 N-CA-C 109.393 -0.595 . . . . 74.54 109.393 175.08 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 47.9 t -66.04 -42.93 88.93 Favored 'General case' 0 CA--C 1.54 0.578 0 CA-C-N 114.912 -1.04 . . . . 53.25 109.819 173.52 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . -90.27 -68.07 1.21 Allowed Glycine 0 C--N 1.364 2.138 0 CA-C-O 119.027 -0.874 . . . . 61.24 114.8 -175.816 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 112' ' ' MET . . . . . 0.637 ' HG3' ' HA ' ' A' ' 117' ' ' ASP . 2.8 tmm? -97.85 -66.33 0.91 Allowed 'General case' 0 N--CA 1.488 1.447 0 CA-C-N 118.647 1.224 . . . . 72.53 113.049 -174.078 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 113' ' ' LEU . . . . . 0.553 HD11 ' HB ' ' A' ' 56' ' ' ILE . 0.2 OUTLIER 171.39 50.29 0.0 OUTLIER 'General case' 0 N--CA 1.495 1.786 0 C-N-CA 124.324 1.049 . . . . 70.12 109.866 178.164 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 114' ' ' LEU . . . . . 0.492 ' HB2' HD13 ' A' ' 109' ' ' LEU . 6.0 tt 77.69 -27.23 0.17 Allowed 'General case' 0 N--CA 1.501 2.088 0 C-N-CA 126.136 1.774 . . . . 33.43 112.17 175.608 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 115' ' ' VAL . . . . . 0.435 ' HA ' ' HD3' ' A' ' 116' ' ' PRO . 2.9 m -92.35 141.58 25.07 Favored Pre-proline 0 CA--C 1.546 0.8 0 C-N-CA 123.966 0.906 . . . . 63.33 109.135 178.427 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 116' ' ' PRO . . . . . 0.435 ' HD3' ' HA ' ' A' ' 115' ' ' VAL . 21.6 Cg_exo -66.09 78.92 0.3 Allowed 'Trans proline' 0 C--N 1.377 2.031 0 C-N-CA 123.728 2.952 . . . . 60.25 113.685 -175.56 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 117' ' ' ASP . . . . . 0.637 ' HA ' ' HG3' ' A' ' 112' ' ' MET . 62.8 m-20 63.55 5.57 2.2 Favored 'General case' 0 N--CA 1.482 1.147 0 C-N-CA 125.722 1.609 . . . . 72.12 114.404 172.645 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -97.27 139.18 21.31 Favored Pre-proline 0 N--CA 1.479 1.0 0 C-N-CA 123.369 0.667 . . . . 54.54 110.004 -179.447 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 119' ' ' PRO . . . . . . . . . . . . . 34.7 Cg_endo -63.68 124.36 13.54 Favored 'Trans proline' 0 C--N 1.375 1.969 0 C-N-CA 122.45 2.1 . . . . 71.11 111.883 -179.985 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . -68.98 178.49 25.73 Favored Glycine 0 C--N 1.346 1.119 0 N-CA-C 114.611 0.604 . . . . 73.24 114.611 -175.127 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . -144.96 135.42 24.28 Favored 'General case' 0 N--CA 1.475 0.801 0 C-N-CA 123.362 0.665 . . . . 71.05 110.154 -178.583 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 122' ' ' SER . . . . . . . . . . . . . 20.3 m . . . . . 0 CA--C 1.553 1.089 0 C-N-CA 123.535 0.734 . . . . 74.55 109.401 176.438 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 1' ' ' MET . . . . . 0.443 ' HG2' HG23 ' A' ' 5' ' ' VAL . 25.1 ttt . . . . . 0 CA--C 1.554 1.106 0 CA-C-O 119.738 -0.173 . . . . 62.21 110.938 . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 39.8 p -51.29 -40.39 58.87 Favored 'General case' 0 N--CA 1.486 1.357 0 C-N-CA 123.802 0.841 . . . . 71.32 112.638 -174.643 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 79.6 p -64.88 -41.98 95.19 Favored 'General case' 0 C--N 1.357 0.895 0 O-C-N 123.456 0.472 . . . . 73.24 110.436 -178.268 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 4' ' ' THR . . . . . 0.476 ' HA ' ' HG2' ' A' ' 53' ' ' PRO . 33.5 m -67.57 -47.08 70.83 Favored 'General case' 0 C--N 1.356 0.878 0 O-C-N 123.632 0.582 . . . . 70.44 111.278 178.968 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 5' ' ' VAL . . . . . 0.443 HG23 ' HG2' ' A' ' 1' ' ' MET . 64.1 t -60.39 -43.27 93.55 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.411 0 C-N-CA 123.546 0.738 . . . . 71.2 110.708 -178.606 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 6' ' ' GLU . . . . . 0.464 ' O ' ' HG3' ' A' ' 10' ' ' ARG . 3.2 tm-20 -71.87 -34.2 69.02 Favored 'General case' 0 CA--C 1.54 0.594 0 CA-C-N 114.727 -1.124 . . . . 75.1 109.822 -178.014 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 59.4 t80 -67.72 -39.22 84.31 Favored 'General case' 0 CA--C 1.553 1.064 0 C-N-CA 123.578 0.751 . . . . 74.33 110.807 176.545 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 8' ' ' ILE . . . . . 0.41 HG13 ' O ' ' A' ' 4' ' ' THR . 87.8 mt -64.07 -39.94 87.28 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.965 0 N-CA-C 109.058 -0.719 . . . . 74.13 109.058 174.054 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 3.8 t-20 -66.63 -30.74 71.08 Favored 'General case' 0 C--N 1.354 0.779 0 O-C-N 123.919 0.762 . . . . 53.53 110.57 179.434 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 10' ' ' ARG . . . . . 0.464 ' HG3' ' O ' ' A' ' 6' ' ' GLU . 85.4 mtt180 -64.58 -46.08 84.27 Favored 'General case' 0 N--CA 1.477 0.91 0 C-N-CA 123.211 0.605 . . . . 62.31 109.745 173.349 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 11' ' ' TRP . . . . . 0.453 ' CD1' HG13 ' A' ' 64' ' ' VAL . 81.5 m95 -65.65 -31.73 72.92 Favored 'General case' 0 N--CA 1.48 1.033 0 O-C-N 123.618 0.574 . . . . 73.01 111.962 176.629 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 12' ' ' GLN . . . . . 0.429 ' HG2' ' CE2' ' A' ' 67' ' ' TYR . 55.3 mt-30 -61.6 -45.86 92.3 Favored 'General case' 0 C--N 1.354 0.776 0 N-CA-C 108.685 -0.857 . . . . 73.44 108.685 172.718 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 13' ' ' ARG . . . . . 0.438 ' NH2' ' HB3' ' A' ' 39' ' ' SER . 14.0 tpt180 -61.41 -49.41 76.97 Favored 'General case' 0 CA--C 1.545 0.788 0 O-C-N 123.832 0.708 . . . . 73.14 110.907 -178.221 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 14' ' ' ILE . . . . . 0.471 HD11 HG21 ' A' ' 47' ' ' VAL . 54.3 mt -62.75 -47.99 90.25 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.409 0 C-N-CA 122.658 0.383 . . . . 71.42 110.57 -178.785 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 15' ' ' ALA . . . . . 0.551 ' HA ' ' HB ' ' A' ' 71' ' ' THR . . . -59.07 -45.72 90.11 Favored 'General case' 0 N--CA 1.477 0.924 0 C-N-CA 124.148 0.979 . . . . 73.44 111.388 -178.249 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 94.5 mt -76.34 -34.13 58.98 Favored 'General case' 0 N--CA 1.482 1.17 0 O-C-N 124.344 1.028 . . . . 72.44 111.499 -175.885 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.474 ' O ' ' HG ' ' A' ' 21' ' ' LEU . 34.2 mt -64.09 -56.83 12.13 Favored 'General case' 0 N--CA 1.476 0.864 0 N-CA-C 109.242 -0.651 . . . . 72.04 109.242 176.868 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 69.0 p -63.03 -32.01 73.28 Favored 'General case' 0 N--CA 1.475 0.777 0 O-C-N 124.223 0.952 . . . . 54.5 111.582 -178.78 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 29.5 tp60 -59.63 -51.95 67.62 Favored 'General case' 0 N--CA 1.478 0.971 0 C-N-CA 123.662 0.785 . . . . 75.32 109.861 172.716 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 51.3 m -60.15 -41.97 93.88 Favored 'General case' 0 C--O 1.215 -0.759 0 O-C-N 124.163 0.914 . . . . 74.43 110.314 177.045 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 21' ' ' LEU . . . . . 0.572 HD22 ' HA ' ' A' ' 33' ' ' LEU . 35.2 mt -67.65 -33.34 74.76 Favored 'General case' 0 C--N 1.348 0.527 0 C-N-CA 123.035 0.534 . . . . 75.23 110.849 -176.459 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.556 ' HA ' HD21 ' A' ' 78' ' ' LEU . 47.8 tp -69.83 -49.95 47.54 Favored 'General case' 0 C--O 1.244 0.771 0 O-C-N 123.74 0.65 . . . . 74.22 109.939 179.041 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 23' ' ' GLU . . . . . 0.565 ' HB3' ' HE ' ' A' ' 27' ' ' ARG . 42.5 mt-10 -55.21 -60.48 3.33 Favored 'General case' 0 C--N 1.352 0.678 0 O-C-N 124.219 0.949 . . . . 71.12 110.37 176.941 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.486 HD23 ' HD2' ' A' ' 27' ' ' ARG . 79.1 mt -61.36 -32.19 72.09 Favored 'General case' 0 CA--C 1.542 0.639 0 C-N-CA 124.652 1.181 . . . . 74.24 111.847 -176.543 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 25' ' ' ALA . . . . . 0.469 ' HB2' HD21 ' A' ' 33' ' ' LEU . . . -61.22 -49.07 78.62 Favored 'General case' 0 N--CA 1.482 1.131 0 CA-C-O 120.873 0.368 . . . . 70.43 110.191 174.912 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 95.2 mt-30 -72.11 -22.99 61.25 Favored 'General case' 0 CA--C 1.549 0.924 0 CA-C-N 115.017 -0.992 . . . . 54.11 111.759 -179.216 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 27' ' ' ARG . . . . . 0.565 ' HE ' ' HB3' ' A' ' 23' ' ' GLU . 47.2 mtt-85 -80.52 -10.03 59.75 Favored 'General case' 0 N--CA 1.485 1.324 0 C-N-CA 123.638 0.775 . . . . 63.54 110.95 174.179 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 83.39 9.0 84.28 Favored Glycine 0 C--N 1.348 1.228 0 C-N-CA 122.673 0.178 . . . . 72.11 113.316 -178.8 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 20.9 mm-40 -86.56 55.08 3.4 Favored 'General case' 0 CA--C 1.547 0.846 0 C-N-CA 125.306 1.442 . . . . 51.22 110.777 178.836 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 30' ' ' TRP . . . . . 0.439 ' O ' ' HG ' ' A' ' 34' ' ' LEU . 86.4 m95 -63.13 -29.03 70.47 Favored 'General case' 0 N--CA 1.481 1.089 0 C-N-CA 123.681 0.792 . . . . 54.53 111.313 -177.654 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 20.1 m-20 -53.6 -48.93 68.8 Favored 'General case' 0 N--CA 1.48 1.069 0 C-N-CA 123.608 0.763 . . . . 72.1 110.131 175.43 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.466 HD12 HD22 ' A' ' 24' ' ' LEU . 34.7 mt -63.97 -30.67 71.73 Favored 'General case' 0 CA--C 1.542 0.654 0 CA-C-N 115.094 -0.957 . . . . 64.2 111.063 -176.242 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 33' ' ' LEU . . . . . 0.572 ' HA ' HD22 ' A' ' 21' ' ' LEU . 9.8 mp -63.96 -46.3 85.26 Favored 'General case' 0 N--CA 1.477 0.91 0 O-C-N 123.585 0.553 . . . . 75.03 110.159 171.327 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.439 ' HG ' ' O ' ' A' ' 30' ' ' TRP . 64.6 mt -63.37 -30.78 71.86 Favored 'General case' 0 N--CA 1.484 1.269 0 C-N-CA 123.367 0.667 . . . . 72.04 112.21 -177.862 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 1.3 mp0 -74.24 -49.06 24.87 Favored 'General case' 0 N--CA 1.485 1.284 0 C-N-CA 122.526 0.33 . . . . 73.11 111.009 173.798 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 36' ' ' GLN . . . . . 0.505 ' HB2' HD21 ' A' ' 21' ' ' LEU . 84.5 mm-40 -69.42 -14.44 62.9 Favored 'General case' 0 N--CA 1.48 1.034 0 C-N-CA 123.41 0.684 . . . . 74.23 111.966 179.617 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 37' ' ' GLU . . . . . 0.478 ' O ' ' HG ' ' A' ' 41' ' ' LEU . 28.2 tt0 -48.04 -54.62 12.43 Favored 'General case' 0 N--CA 1.481 1.086 0 C-N-CA 124.903 1.281 . . . . 65.33 111.876 178.536 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 59.6 t -57.4 -45.38 85.5 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.998 0 C-N-CA 123.973 0.909 . . . . 74.03 110.726 -176.494 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 39' ' ' SER . . . . . 0.438 ' HB3' ' NH2' ' A' ' 13' ' ' ARG . 41.5 m -67.08 -36.88 82.95 Favored 'General case' 0 CA--C 1.542 0.643 0 CA-C-N 114.792 -1.095 . . . . 65.21 111.401 179.056 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 76.5 t80 -69.2 -46.94 66.22 Favored 'General case' 0 N--CA 1.477 0.896 0 C-N-CA 123.745 0.818 . . . . 72.51 110.291 -176.255 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 41' ' ' LEU . . . . . 0.478 ' HG ' ' O ' ' A' ' 37' ' ' GLU . 73.9 mt -58.31 -52.18 66.69 Favored 'General case' 0 C--N 1.355 0.807 0 O-C-N 124.672 1.233 . . . . 53.14 109.13 176.773 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 50.3 tt0 -54.76 -48.22 72.92 Favored 'General case' 0 C--N 1.354 0.779 0 O-C-N 124.003 0.814 . . . . 75.11 111.498 -178.232 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 43' ' ' SER . . . . . 0.472 ' O ' HG23 ' A' ' 47' ' ' VAL . 68.1 m -61.41 -59.7 4.85 Favored 'General case' 0 CA--C 1.545 0.767 0 C-N-CA 123.069 0.548 . . . . 44.22 111.259 -178.263 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 12.6 tt -59.95 -39.37 79.96 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.145 0 O-C-N 123.821 0.701 . . . . 74.35 111.319 -172.914 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 18.3 mm-40 -65.25 -54.34 30.82 Favored 'General case' 0 N--CA 1.475 0.796 0 C-N-CA 123.554 0.741 . . . . 73.12 110.892 177.673 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 46' ' ' THR . . . . . 0.446 ' O ' ' HD3' ' A' ' 50' ' ' LYS . 87.9 m -56.47 -31.46 64.04 Favored 'General case' 0 N--CA 1.489 1.502 0 C-N-CA 123.469 0.708 . . . . 43.21 111.925 -177.831 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 47' ' ' VAL . . . . . 0.472 HG23 ' O ' ' A' ' 43' ' ' SER . 60.9 t -76.21 -46.33 33.63 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.821 0 CA-C-N 116.848 -0.16 . . . . 74.35 111.212 177.332 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 48' ' ' MET . . . . . . . . . . . . . 70.6 mtm -74.6 -21.07 59.66 Favored 'General case' 0 N--CA 1.487 1.392 0 N-CA-C 112.811 0.671 . . . . 75.24 112.811 -175.842 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 50.7 mt-10 -83.14 -37.3 23.9 Favored 'General case' 0 N--CA 1.488 1.455 0 C-N-CA 122.699 0.4 . . . . 75.23 111.07 177.681 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 50' ' ' LYS . . . . . 0.446 ' HD3' ' O ' ' A' ' 46' ' ' THR . 13.6 mptt -91.45 147.02 23.33 Favored 'General case' 0 N--CA 1.475 0.8 0 CA-C-N 115.67 -0.696 . . . . 64.52 110.036 -170.485 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 7.6 tt0 -71.83 136.52 47.04 Favored 'General case' 0 CA--C 1.539 0.539 0 CA-C-N 115.013 -0.994 . . . . 73.4 110.757 -173.655 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 52' ' ' THR . . . . . 0.77 HG21 ' HB3' ' A' ' 114' ' ' LEU . 59.9 m -70.44 133.16 87.22 Favored Pre-proline 0 CA--C 1.555 1.168 0 CA-C-N 115.263 -0.88 . . . . 74.14 110.109 173.313 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 53' ' ' PRO . . . . . 0.476 ' HG2' ' HA ' ' A' ' 4' ' ' THR . 45.4 Cg_exo -58.62 151.98 59.08 Favored 'Trans proline' 0 C--N 1.383 2.356 0 C-N-CA 122.379 2.053 . . . . 73.12 113.162 177.63 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 54' ' ' PRO . . . . . 0.427 ' HD3' ' HA ' ' A' ' 53' ' ' PRO . 18.5 Cg_exo -68.68 -46.96 1.52 Allowed 'Trans proline' 0 C--N 1.375 1.972 0 C-N-CA 122.963 2.442 . . . . 71.24 110.994 172.827 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . -68.99 87.18 0.22 Allowed Glycine 0 C--N 1.349 1.268 0 CA-C-N 114.928 -1.033 . . . . 70.32 113.134 -179.164 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 80.3 mt -128.15 123.99 61.54 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.639 0 C-N-CA 124.574 1.15 . . . . 53.21 108.005 173.891 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 57' ' ' THR . . . . . 0.462 ' H ' HD12 ' A' ' 60' ' ' ILE . 31.9 p -85.2 179.23 7.27 Favored 'General case' 0 N--CA 1.473 0.703 0 N-CA-C 109.31 -0.626 . . . . 61.44 109.31 176.249 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 39.1 tpt85 -64.43 -47.04 80.63 Favored 'General case' 0 CA--C 1.541 0.606 0 C-N-CA 122.917 0.487 . . . . 73.44 109.772 176.176 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 17.7 m -60.84 -41.61 96.17 Favored 'General case' 0 N--CA 1.475 0.811 0 C-N-CA 123.683 0.793 . . . . 52.05 111.35 179.517 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 60' ' ' ILE . . . . . 0.462 HD12 ' H ' ' A' ' 57' ' ' THR . 98.1 mt -64.28 -42.04 94.22 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.95 0 C-N-CA 123.242 0.617 . . . . 72.21 110.43 177.826 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 49.0 tt0 -58.08 -42.23 85.11 Favored 'General case' 0 CA--C 1.544 0.72 0 O-C-N 123.801 0.688 . . . . 74.14 110.548 176.359 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 35.4 m-20 -68.82 -39.31 80.08 Favored 'General case' 0 N--CA 1.48 1.026 0 C-N-CA 123.214 0.606 . . . . 72.4 112.078 -179.608 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 63' ' ' MET . . . . . . . . . . . . . 71.6 mtm -68.68 -46.17 69.77 Favored 'General case' 0 N--CA 1.482 1.175 0 O-C-N 123.322 0.389 . . . . 63.45 110.691 -179.821 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 64' ' ' VAL . . . . . 0.529 ' O ' HG13 ' A' ' 68' ' ' ILE . 70.6 t -63.91 -60.05 3.34 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.558 0 CA-C-N 115.175 -0.92 . . . . 54.1 109.916 178.827 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 65' ' ' ALA . . . . . 0.57 ' HB2' HD23 ' A' ' 109' ' ' LEU . . . -60.92 -29.55 69.67 Favored 'General case' 0 N--CA 1.493 1.689 0 C-N-CA 123.298 0.639 . . . . 53.24 112.018 -179.054 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -67.0 -42.1 92.78 Favored Glycine 0 C--N 1.345 1.073 0 O-C-N 123.66 0.6 . . . . 65.42 111.928 176.018 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 67' ' ' TYR . . . . . 0.429 ' CE2' ' HG2' ' A' ' 12' ' ' GLN . 9.8 m-30 -75.89 -29.34 58.42 Favored 'General case' 0 N--CA 1.473 0.701 0 C-N-CA 123.046 0.539 . . . . 74.22 112.276 177.289 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 68' ' ' ILE . . . . . 0.539 ' O ' ' HG ' ' A' ' 72' ' ' LEU . 47.3 mt -64.03 -50.01 79.04 Favored 'Isoleucine or valine' 0 C--N 1.355 0.845 0 N-CA-C 107.251 -1.388 . . . . 73.35 107.251 172.306 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 69' ' ' LYS . . . . . 0.565 ' HB2' ' HE2' ' A' ' 106' ' ' TYR . 48.0 tttp -52.11 -48.46 64.77 Favored 'General case' 0 N--CA 1.481 1.098 0 C-N-CA 123.967 0.907 . . . . 55.11 111.149 176.432 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 60.7 tt0 -59.53 -46.38 89.04 Favored 'General case' 0 C--N 1.348 0.505 0 O-C-N 124.534 1.146 . . . . 72.55 110.41 -176.398 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 71' ' ' THR . . . . . 0.551 ' HB ' ' HA ' ' A' ' 15' ' ' ALA . 12.3 t -78.8 -18.74 53.63 Favored 'General case' 0 C--O 1.215 -0.752 0 CA-C-O 118.525 -0.75 . . . . 74.34 110.906 -177.91 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 72' ' ' LEU . . . . . 0.539 ' HG ' ' O ' ' A' ' 68' ' ' ILE . 37.6 mt -76.63 -33.42 58.35 Favored 'General case' 0 N--CA 1.491 1.611 0 CA-C-N 118.447 0.567 . . . . 64.44 110.791 173.596 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 50.8 m-20 -69.71 -49.01 57.43 Favored 'General case' 0 N--CA 1.476 0.855 0 N-CA-C 109.114 -0.698 . . . . 64.12 109.114 175.025 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 78.6 m-20 -57.86 -41.72 82.99 Favored 'General case' 0 N--CA 1.48 1.031 0 O-C-N 124.12 0.888 . . . . 73.13 110.714 175.522 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 75' ' ' GLU . . . . . 0.458 ' O ' ' HG2' ' A' ' 79' ' ' LYS . 11.2 tp10 -53.91 -61.64 2.17 Favored 'General case' 0 N--CA 1.485 1.284 0 C-N-CA 125.389 1.476 . . . . 54.42 110.697 176.234 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 61.9 tt0 -58.13 -46.77 85.03 Favored 'General case' 0 CA--C 1.543 0.702 0 O-C-N 124.056 0.848 . . . . 73.23 111.107 -174.094 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 95.2 mt -67.18 -40.25 86.55 Favored 'General case' 0 CA--C 1.545 0.751 0 CA-C-N 115.535 -0.757 . . . . 60.03 111.607 -176.538 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 78' ' ' LEU . . . . . 0.556 HD21 ' HA ' ' A' ' 22' ' ' LEU . 15.9 mt -65.79 -46.23 79.47 Favored 'General case' 0 N--CA 1.478 0.944 0 O-C-N 123.442 0.464 . . . . 75.21 111.807 -179.031 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 79' ' ' LYS . . . . . 0.458 ' HG2' ' O ' ' A' ' 75' ' ' GLU . 22.8 mmtp -70.57 -32.92 70.51 Favored 'General case' 0 N--CA 1.481 1.1 0 CA-C-O 121.002 0.429 . . . . 75.4 109.947 -178.438 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -64.67 -28.8 73.77 Favored Glycine 0 C--N 1.345 1.076 0 CA-C-N 114.594 -1.185 . . . . 75.11 112.983 172.354 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -83.79 -38.99 20.57 Favored 'General case' 0 CA--C 1.558 1.256 0 C-N-CA 123.46 0.704 . . . . 72.21 110.527 176.813 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 78.9 mt -72.29 -63.88 1.06 Allowed 'General case' 0 N--CA 1.483 1.21 0 C-N-CA 123.546 0.738 . . . . 71.31 111.634 -172.624 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 18.1 tp60 -135.29 21.85 3.44 Favored 'General case' 0 CA--C 1.547 0.852 0 C-N-CA 123.032 0.533 . . . . 60.31 109.746 -173.778 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 50.5 tt0 73.39 -17.01 0.45 Allowed 'General case' 0 N--CA 1.49 1.574 0 C-N-CA 125.299 1.44 . . . . 74.41 112.657 175.368 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 85' ' ' ARG . . . . . . . . . . . . . 81.3 mtt85 -145.02 171.99 13.69 Favored 'General case' 0 N--CA 1.469 0.519 0 C-N-CA 124.828 1.251 . . . . 71.52 109.21 -173.402 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 82.5 mt -53.89 96.78 0.02 OUTLIER 'General case' 0 N--CA 1.481 1.11 0 C-N-CA 124.147 0.979 . . . . 74.4 111.734 -175.746 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 27.0 t70 -166.79 112.21 0.78 Allowed 'General case' 0 CA--C 1.536 0.409 0 N-CA-C 107.612 -1.255 . . . . 71.21 107.612 -179.276 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -100.68 -174.84 2.74 Favored 'General case' 0 N--CA 1.481 1.123 0 C-N-CA 123.375 0.67 . . . . 71.43 111.166 -175.342 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 39.9 mt -54.14 -40.63 67.56 Favored 'General case' 0 CA--C 1.548 0.887 0 CA-C-N 114.282 -1.326 . . . . 61.24 111.825 179.765 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 90' ' ' SER . . . . . 0.475 ' HB3' HD11 ' A' ' 41' ' ' LEU . 47.0 t -152.8 143.95 23.13 Favored 'General case' 0 N--CA 1.47 0.572 0 C-N-CA 123.641 0.777 . . . . 75.4 109.874 179.941 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 56.8 p -64.57 143.23 58.07 Favored 'General case' 0 CA--C 1.55 0.944 0 C-N-CA 123.843 0.857 . . . . 73.33 111.701 -177.578 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 92' ' ' LEU . . . . . 0.49 ' HB2' ' HA ' ' A' ' 96' ' ' SER . 90.8 mt -79.95 -84.21 0.09 Allowed 'General case' 0 CA--C 1.549 0.908 0 C-N-CA 123.725 0.81 . . . . 55.03 111.248 -175.253 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 5.9 mt -99.34 35.06 0.22 Allowed 'Isoleucine or valine' 0 N--CA 1.484 1.247 0 N-CA-C 108.34 -0.985 . . . . 64.43 108.34 -179.69 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 74.21 -70.87 1.53 Allowed Glycine 0 C--N 1.349 1.298 0 N-CA-C 109.255 -1.538 . . . . 74.31 109.255 -163.928 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 50.5 mt-30 -69.76 97.13 1.04 Allowed 'General case' 0 C--N 1.349 0.587 0 N-CA-C 108.038 -1.097 . . . . 74.12 108.038 161.782 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 96' ' ' SER . . . . . 0.49 ' HA ' ' HB2' ' A' ' 92' ' ' LEU . 17.3 m -71.69 90.29 1.05 Allowed 'General case' 0 CA--C 1.535 0.376 0 N-CA-C 109.176 -0.676 . . . . 75.23 109.176 178.707 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 11.3 t -85.96 44.34 1.12 Allowed 'General case' 0 CA--C 1.557 1.25 0 C-N-CA 123.825 0.85 . . . . 74.34 110.111 -179.182 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 98' ' ' ARG . . . . . 0.452 ' HD2' ' H ' ' A' ' 98' ' ' ARG . 0.2 OUTLIER -58.98 -53.35 59.37 Favored 'General case' 0 CA--C 1.548 0.891 0 C-N-CA 123.974 0.91 . . . . 74.12 110.86 -174.161 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 24.8 tt0 -72.61 -50.15 27.26 Favored 'General case' 0 C--N 1.346 0.441 0 C-N-CA 123.836 0.854 . . . . 65.22 109.508 -175.399 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 71.0 mmtt -60.44 -55.47 33.14 Favored 'General case' 0 N--CA 1.472 0.674 0 O-C-N 123.971 0.795 . . . . 71.14 110.501 -173.245 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 39.0 t -72.28 -44.25 63.05 Favored 'General case' 0 CA--C 1.546 0.825 0 O-C-N 124.062 0.851 . . . . 63.14 112.344 -174.526 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 6.4 tp -72.38 -38.24 68.53 Favored 'General case' 0 N--CA 1.49 1.563 0 CA-C-N 118.532 0.605 . . . . 72.23 110.617 -174.505 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 66.5 t30 -77.59 -24.89 49.61 Favored 'General case' 0 N--CA 1.478 0.949 0 CA-C-N 116.435 -0.348 . . . . 64.31 110.682 177.237 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 2.6 t-20 -66.74 -38.29 86.36 Favored 'General case' 0 N--CA 1.488 1.445 0 C-N-CA 122.864 0.465 . . . . 71.14 109.818 171.201 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -61.34 -47.81 84.18 Favored 'General case' 0 C--N 1.352 0.7 0 O-C-N 123.896 0.748 . . . . 73.54 109.96 174.621 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 106' ' ' TYR . . . . . 0.565 ' HE2' ' HB2' ' A' ' 69' ' ' LYS . 4.6 t80 -55.93 -53.42 57.09 Favored 'General case' 0 CA--C 1.55 0.956 0 O-C-N 124.248 0.968 . . . . 73.5 111.06 176.354 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -68.5 -37.97 86.05 Favored Glycine 0 C--N 1.349 1.266 0 O-C-N 123.781 0.676 . . . . 63.45 113.268 -172.043 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 38.3 ttp-105 -71.01 -32.59 69.43 Favored 'General case' 0 CA--C 1.543 0.707 0 C-N-CA 123.665 0.786 . . . . 62.35 109.779 177.395 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 109' ' ' LEU . . . . . 0.57 HD23 ' HB2' ' A' ' 65' ' ' ALA . 47.9 tp -66.99 -46.14 75.5 Favored 'General case' 0 N--CA 1.481 1.103 0 C-N-CA 123.297 0.639 . . . . 73.11 110.778 175.129 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 23.0 t -67.83 -35.43 78.58 Favored 'General case' 0 CA--C 1.543 0.681 0 O-C-N 124.147 0.904 . . . . 51.5 110.229 -178.643 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . -84.26 -63.93 1.62 Allowed Glycine 0 C--N 1.36 1.874 0 CA-C-O 119.274 -0.737 . . . . 65.13 113.28 -176.363 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 112' ' ' MET . . . . . 0.452 ' O ' ' HB2' ' A' ' 113' ' ' LEU . 2.0 tmm? -95.24 -66.24 0.92 Allowed 'General case' 0 N--CA 1.487 1.393 0 CA-C-N 118.496 1.148 . . . . 70.02 110.351 179.586 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 113' ' ' LEU . . . . . 0.452 ' HB2' ' O ' ' A' ' 112' ' ' MET . 14.8 tp 164.4 28.17 0.0 OUTLIER 'General case' 0 N--CA 1.505 2.309 0 C-N-CA 125.445 1.498 . . . . 72.11 110.472 179.269 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 114' ' ' LEU . . . . . 0.77 ' HB3' HG21 ' A' ' 52' ' ' THR . 0.5 OUTLIER 75.26 -6.04 2.05 Favored 'General case' 0 N--CA 1.501 2.12 0 C-N-CA 125.553 1.541 . . . . 71.23 111.215 -178.569 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 115' ' ' VAL . . . . . . . . . . . . . 22.7 t -107.97 123.94 36.25 Favored Pre-proline 0 CA--C 1.541 0.616 0 N-CA-C 107.167 -1.42 . . . . 71.44 107.167 178.467 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 60.7 Cg_endo -74.39 102.92 1.61 Allowed 'Trans proline' 0 CA--C 1.554 1.495 0 C-N-CA 121.652 1.568 . . . . 70.15 111.885 176.562 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 30.2 m-20 -141.35 55.57 1.53 Allowed 'General case' 0 N--CA 1.488 1.456 0 C-N-CA 124.103 0.961 . . . . 75.21 110.364 177.669 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . 68.9 139.65 0.06 OUTLIER Pre-proline 0 CA--C 1.558 1.256 0 C-N-CA 124.939 1.296 . . . . 42.52 112.438 179.141 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 119' ' ' PRO . . . . . . . . . . . . . 85.4 Cg_endo -80.26 -171.16 1.17 Allowed 'Trans proline' 0 C--N 1.373 1.819 0 C-N-CA 122.427 2.085 . . . . 71.43 110.542 167.453 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . -138.75 171.98 23.29 Favored Glycine 0 N--CA 1.467 0.742 0 N-CA-C 111.716 -0.554 . . . . 74.32 111.716 -178.568 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . -63.26 -34.62 78.07 Favored 'General case' 0 N--CA 1.477 0.912 0 C-N-CA 123.852 0.861 . . . . 74.22 111.195 177.686 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 122' ' ' SER . . . . . . . . . . . . . 56.2 m . . . . . 0 CA--C 1.554 1.113 0 C-N-CA 124.473 1.109 . . . . 73.22 108.67 175.651 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 12.4 tpt . . . . . 0 N--CA 1.478 0.971 0 CA-C-O 119.045 -0.502 . . . . 62.31 111.548 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 46.7 p -55.46 -41.35 72.8 Favored 'General case' 0 N--CA 1.484 1.228 0 C-N-CA 122.754 0.422 . . . . 74.44 112.075 -175.94 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 14.7 m -58.35 -42.32 86.66 Favored 'General case' 0 N--CA 1.48 1.03 0 C-N-CA 123.299 0.64 . . . . 73.24 111.121 177.629 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 56.9 m -68.77 -40.62 79.6 Favored 'General case' 0 CA--C 1.544 0.744 0 C-N-CA 123.552 0.741 . . . . 65.35 111.38 177.908 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 88.4 t -63.46 -40.78 90.31 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.021 0 C-N-CA 123.06 0.544 . . . . 53.24 110.127 179.943 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 6' ' ' GLU . . . . . 0.428 ' O ' ' HG3' ' A' ' 10' ' ' ARG . 50.3 mm-40 -71.68 -35.07 70.18 Favored 'General case' 0 N--CA 1.469 0.502 0 O-C-N 123.718 0.636 . . . . 70.33 111.031 178.599 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 55.4 t80 -67.62 -45.06 76.49 Favored 'General case' 0 CA--C 1.551 1.0 0 C-N-CA 123.031 0.533 . . . . 74.43 110.529 179.62 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 8' ' ' ILE . . . . . 0.521 HD11 HG23 ' A' ' 60' ' ' ILE . 90.2 mt -62.97 -40.24 88.25 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.811 0 C-N-CA 123.621 0.768 . . . . 73.4 109.381 173.677 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 20.9 t-20 -61.79 -33.35 73.95 Favored 'General case' 0 N--CA 1.481 1.117 0 C-N-CA 124.063 0.945 . . . . 73.13 111.239 177.227 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 10' ' ' ARG . . . . . 0.654 ' HB3' HG22 ' A' ' 47' ' ' VAL . 64.0 mtt85 -68.59 -40.48 80.48 Favored 'General case' 0 CA--C 1.536 0.442 0 C-N-CA 123.124 0.569 . . . . 73.33 110.377 175.565 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 11' ' ' TRP . . . . . 0.427 ' CD1' HG13 ' A' ' 64' ' ' VAL . 74.8 m95 -69.84 -32.12 70.35 Favored 'General case' 0 N--CA 1.479 1.011 0 N-CA-C 112.14 0.422 . . . . 75.21 112.14 174.931 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 12' ' ' GLN . . . . . 0.411 ' HG3' ' O ' ' A' ' 8' ' ' ILE . 52.9 mt-30 -63.23 -42.02 99.18 Favored 'General case' 0 N--CA 1.472 0.637 0 N-CA-C 108.701 -0.851 . . . . 73.33 108.701 172.302 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 15.5 tpt180 -63.31 -50.69 69.05 Favored 'General case' 0 CA--C 1.541 0.605 0 CA-C-N 115.174 -0.921 . . . . 63.14 110.587 -177.091 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 14' ' ' ILE . . . . . 0.517 HD11 HG21 ' A' ' 47' ' ' VAL . 70.2 mt -63.11 -44.06 99.27 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.062 0 C-N-CA 123.456 0.702 . . . . 71.43 110.653 -179.041 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 15' ' ' ALA . . . . . 0.587 ' HA ' ' HB ' ' A' ' 71' ' ' THR . . . -61.21 -50.79 71.69 Favored 'General case' 0 N--CA 1.479 0.991 0 C-N-CA 124.073 0.949 . . . . 73.41 111.964 -179.672 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 97.9 mt -76.61 -35.17 58.25 Favored 'General case' 0 N--CA 1.48 1.057 0 CA-C-N 114.795 -1.093 . . . . 63.5 111.516 -172.655 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.498 ' O ' ' HG ' ' A' ' 21' ' ' LEU . 45.7 mt -66.43 -47.8 72.06 Favored 'General case' 0 N--CA 1.473 0.707 0 CA-C-O 118.971 -0.537 . . . . 75.01 109.947 175.9 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 98.2 p -65.67 -30.73 71.47 Favored 'General case' 0 N--CA 1.487 1.421 0 C-N-CA 122.611 0.364 . . . . 75.12 111.246 179.151 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 27.1 tp60 -59.31 -49.63 77.08 Favored 'General case' 0 C--N 1.354 0.799 0 O-C-N 123.737 0.648 . . . . 74.41 109.303 171.134 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 44.6 m -62.65 -41.73 99.21 Favored 'General case' 0 CA--C 1.542 0.644 0 CA-C-N 115.233 -0.894 . . . . 75.05 111.163 178.179 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 21' ' ' LEU . . . . . 0.498 ' HG ' ' O ' ' A' ' 17' ' ' LEU . 80.2 mt -63.26 -39.83 95.72 Favored 'General case' 0 N--CA 1.478 0.967 0 C-N-CA 123.64 0.776 . . . . 72.42 110.087 -177.421 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.566 ' HA ' HD21 ' A' ' 78' ' ' LEU . 55.6 tp -64.29 -54.77 28.01 Favored 'General case' 0 CA--C 1.539 0.546 0 CA-C-N 115.628 -0.715 . . . . 71.43 110.224 178.058 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 47.3 mt-10 -54.17 -50.82 66.12 Favored 'General case' 0 N--CA 1.483 1.186 0 C-N-CA 123.862 0.865 . . . . 74.41 111.279 -178.954 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.441 ' HB3' ' HB2' ' A' ' 29' ' ' GLU . 91.7 mt -63.47 -40.28 96.69 Favored 'General case' 0 N--CA 1.47 0.554 0 CA-C-N 115.012 -0.995 . . . . 65.23 111.067 -177.363 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 25' ' ' ALA . . . . . 0.424 ' HB2' HD21 ' A' ' 33' ' ' LEU . . . -59.91 -40.6 89.37 Favored 'General case' 0 N--CA 1.482 1.161 0 C-N-CA 123.137 0.575 . . . . 70.01 111.352 176.813 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 86.7 mt-30 -64.42 -35.8 82.08 Favored 'General case' 0 N--CA 1.48 1.067 0 C-N-CA 123.899 0.88 . . . . 73.2 110.975 175.776 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 57.7 mtt180 -82.35 -6.79 59.49 Favored 'General case' 0 N--CA 1.482 1.134 0 C-N-CA 123.914 0.886 . . . . 74.11 112.021 179.36 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 84.09 9.77 81.73 Favored Glycine 0 C--N 1.352 1.441 0 N-CA-C 113.587 0.195 . . . . 65.13 113.587 -179.916 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 29' ' ' GLU . . . . . 0.441 ' HB2' ' HB3' ' A' ' 24' ' ' LEU . 40.4 mm-40 -85.5 54.28 3.06 Favored 'General case' 0 CA--C 1.546 0.793 0 C-N-CA 124.626 1.17 . . . . 64.13 111.168 179.629 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 30' ' ' TRP . . . . . 0.492 ' O ' ' HG ' ' A' ' 34' ' ' LEU . 96.0 m95 -64.79 -28.8 69.82 Favored 'General case' 0 N--CA 1.475 0.781 0 C-N-CA 123.402 0.681 . . . . 74.32 111.797 -176.869 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 11.1 m-20 -59.54 -39.46 84.04 Favored 'General case' 0 N--CA 1.486 1.352 0 C-N-CA 123.23 0.612 . . . . 74.44 110.439 178.456 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 88.0 mt -67.82 -31.45 71.3 Favored 'General case' 0 CA--C 1.543 0.679 0 CA-C-N 115.255 -0.884 . . . . 74.11 110.963 179.135 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 33' ' ' LEU . . . . . 0.447 HD13 ' HA ' ' A' ' 30' ' ' TRP . 9.2 mp -65.44 -43.7 89.62 Favored 'General case' 0 N--CA 1.488 1.45 0 N-CA-C 110.051 -0.351 . . . . 72.54 110.051 171.627 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.492 ' HG ' ' O ' ' A' ' 30' ' ' TRP . 49.0 mt -66.3 -33.19 75.19 Favored 'General case' 0 N--CA 1.477 0.914 0 O-C-N 123.989 0.806 . . . . 70.21 111.442 -176.844 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 98.1 mt-30 -74.07 -53.88 9.02 Favored 'General case' 0 N--CA 1.477 0.903 0 C-N-CA 123.414 0.686 . . . . 54.25 110.294 177.04 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 83.5 mm-40 -63.86 -18.1 63.82 Favored 'General case' 0 N--CA 1.484 1.225 0 O-C-N 123.773 0.67 . . . . 73.23 111.637 178.848 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 37' ' ' GLU . . . . . 0.561 ' O ' ' HG ' ' A' ' 41' ' ' LEU . 30.3 tt0 -48.97 -60.97 2.32 Favored 'General case' 0 C--N 1.361 1.094 0 C-N-CA 124.523 1.129 . . . . 72.35 111.523 178.995 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 58.1 t -60.76 -40.59 85.48 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.291 0 O-C-N 123.787 0.679 . . . . 70.23 111.45 -173.973 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 50.8 m -62.22 -39.75 93.82 Favored 'General case' 0 CA--C 1.545 0.784 0 C-N-CA 123.382 0.673 . . . . 63.43 110.794 175.478 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 37.9 t80 -70.94 -40.15 72.22 Favored 'General case' 0 C--N 1.35 0.598 0 C-N-CA 124.274 1.029 . . . . 71.12 110.357 -176.976 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 41' ' ' LEU . . . . . 0.561 ' HG ' ' O ' ' A' ' 37' ' ' GLU . 67.3 mt -61.11 -51.07 70.68 Favored 'General case' 0 C--N 1.355 0.845 0 O-C-N 124.291 0.995 . . . . 73.12 108.623 178.773 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 50.8 tt0 -56.51 -42.03 77.69 Favored 'General case' 0 CA--C 1.544 0.735 0 CA-C-N 114.659 -1.155 . . . . 74.22 110.65 178.303 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 43' ' ' SER . . . . . 0.558 ' O ' HG23 ' A' ' 47' ' ' VAL . 68.8 m -61.54 -62.82 1.55 Allowed 'General case' 0 C--N 1.357 0.898 0 C-N-CA 122.959 0.504 . . . . 72.53 110.968 179.345 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 13.7 tt -64.02 -35.35 73.26 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.914 0 C-N-CA 123.836 0.854 . . . . 64.21 111.477 -169.882 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 10.7 mm-40 -65.86 -49.25 68.82 Favored 'General case' 0 C--N 1.348 0.528 0 CA-C-N 115.873 -0.603 . . . . 74.35 110.317 175.332 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 60.9 m -53.64 -39.94 65.43 Favored 'General case' 0 N--CA 1.484 1.239 0 O-C-N 123.864 0.727 . . . . 50.15 111.163 177.784 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 47' ' ' VAL . . . . . 0.654 HG22 ' HB3' ' A' ' 10' ' ' ARG . 20.9 t -68.56 -49.09 68.4 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.004 0 C-N-CA 123.104 0.562 . . . . 71.42 111.575 -178.228 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 48' ' ' MET . . . . . . . . . . . . . 70.3 mtm -75.62 -14.38 60.37 Favored 'General case' 0 N--CA 1.483 1.187 0 C-N-CA 122.507 0.323 . . . . 62.13 111.761 -177.784 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 47.0 mt-10 -95.98 -11.98 25.71 Favored 'General case' 0 N--CA 1.481 1.089 0 C-N-CA 123.724 0.81 . . . . 75.13 110.555 171.82 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 14.9 tppt? -87.2 132.94 33.72 Favored 'General case' 0 N--CA 1.472 0.628 0 N-CA-C 108.883 -0.784 . . . . 74.41 108.883 177.331 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 3.4 tt0 -66.83 131.22 45.45 Favored 'General case' 0 C--O 1.242 0.683 0 N-CA-C 108.961 -0.755 . . . . 74.15 108.961 174.634 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 22.1 m -69.25 127.09 93.08 Favored Pre-proline 0 CA--C 1.551 0.995 0 O-C-N 123.579 0.55 . . . . 72.1 109.555 175.905 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_endo -66.32 155.02 71.98 Favored 'Trans proline' 0 C--N 1.377 2.079 0 C-N-CA 122.258 1.972 . . . . 71.13 112.031 178.97 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 17.4 Cg_exo -67.85 -47.74 1.75 Allowed 'Trans proline' 0 C--N 1.372 1.798 0 C-N-CA 122.941 2.427 . . . . 75.1 111.653 177.406 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . -63.2 85.0 0.05 OUTLIER Glycine 0 C--N 1.353 1.48 0 O-C-N 124.411 1.07 . . . . 62.35 113.593 -177.413 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 59.2 mt -133.69 102.12 4.4 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.683 0 C-N-CA 124.764 1.226 . . . . 75.42 108.399 178.081 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 57' ' ' THR . . . . . 0.425 ' H ' HD12 ' A' ' 60' ' ' ILE . 40.8 p -82.42 -173.62 4.69 Favored 'General case' 0 N--CA 1.471 0.601 0 C-N-CA 123.652 0.781 . . . . 64.1 110.31 175.192 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 22.0 tpt180 -63.01 -48.82 77.14 Favored 'General case' 0 CA--C 1.54 0.596 0 C-N-CA 123.608 0.763 . . . . 72.25 110.665 179.711 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 20.3 m -56.89 -43.98 81.86 Favored 'General case' 0 N--CA 1.479 1.017 0 C-N-CA 123.43 0.692 . . . . 65.42 111.375 179.389 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 60' ' ' ILE . . . . . 0.521 HG23 HD11 ' A' ' 8' ' ' ILE . 69.6 mt -64.08 -42.27 95.09 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.808 0 CA-C-N 115.114 -0.948 . . . . 74.11 110.328 178.728 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 60.4 tt0 -61.23 -41.27 96.58 Favored 'General case' 0 CA--C 1.546 0.79 0 C-N-CA 124.09 0.956 . . . . 71.4 111.087 179.729 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 14.1 m-20 -68.27 -43.3 78.11 Favored 'General case' 0 N--CA 1.479 0.986 0 C-N-CA 123.235 0.614 . . . . 73.55 111.632 179.503 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 63' ' ' MET . . . . . . . . . . . . . 73.3 mtm -65.88 -51.3 59.92 Favored 'General case' 0 N--CA 1.482 1.129 0 O-C-N 123.206 0.316 . . . . 54.41 111.109 179.864 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 64' ' ' VAL . . . . . 0.498 ' O ' HG13 ' A' ' 68' ' ' ILE . 53.1 t -59.98 -61.12 1.63 Allowed 'Isoleucine or valine' 0 CA--C 1.543 0.703 0 C-N-CA 123.707 0.803 . . . . 73.21 110.692 -179.522 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -64.67 -32.33 73.94 Favored 'General case' 0 N--CA 1.483 1.181 0 C-N-CA 122.697 0.399 . . . . 55.24 111.706 -176.708 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -65.94 -38.78 94.51 Favored Glycine 0 C--N 1.349 1.271 0 O-C-N 123.412 0.445 . . . . 30.25 112.049 177.798 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 67' ' ' TYR . . . . . 0.439 ' O ' HG22 ' A' ' 71' ' ' THR . 8.1 m-85 -74.9 -34.39 62.16 Favored 'General case' 0 N--CA 1.469 0.524 0 C-N-CA 123.439 0.696 . . . . 75.42 111.971 177.973 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 68' ' ' ILE . . . . . 0.549 ' O ' ' HG ' ' A' ' 72' ' ' LEU . 48.1 mt -61.93 -52.69 57.54 Favored 'Isoleucine or valine' 0 C--N 1.36 1.061 0 N-CA-C 108.353 -0.98 . . . . 61.43 108.353 174.369 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 69' ' ' LYS . . . . . 0.575 ' HB2' ' HE2' ' A' ' 106' ' ' TYR . 12.1 tmtt? -53.83 -47.76 70.58 Favored 'General case' 0 N--CA 1.479 1.017 0 C-N-CA 124.542 1.137 . . . . 75.13 109.772 -179.408 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 58.0 tt0 -55.49 -54.39 44.43 Favored 'General case' 0 C--N 1.347 0.485 0 CA-C-N 114.951 -1.022 . . . . 62.34 111.974 179.626 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 71' ' ' THR . . . . . 0.587 ' HB ' ' HA ' ' A' ' 15' ' ' ALA . 10.1 t -71.48 -27.09 62.99 Favored 'General case' 0 C--O 1.251 1.169 0 CA-C-N 116.22 -0.445 . . . . 74.21 110.891 -171.816 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 72' ' ' LEU . . . . . 0.549 ' HG ' ' O ' ' A' ' 68' ' ' ILE . 43.0 mt -62.07 -55.66 26.75 Favored 'General case' 0 C--N 1.358 0.955 0 O-C-N 123.789 0.681 . . . . 71.31 109.876 173.622 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -56.29 -52.56 64.06 Favored 'General case' 0 N--CA 1.489 1.487 0 O-C-N 124.253 0.971 . . . . 74.32 111.982 -179.787 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 74' ' ' ASN . . . . . 0.431 ' N ' HD21 ' A' ' 74' ' ' ASN . 0.8 OUTLIER -58.74 -55.23 37.72 Favored 'General case' 0 C--O 1.248 0.992 0 O-C-N 124.036 0.835 . . . . 74.22 111.528 -174.786 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 75' ' ' GLU . . . . . 0.554 ' O ' ' HG2' ' A' ' 79' ' ' LYS . 14.5 tt0 -76.85 -15.4 59.72 Favored 'General case' 0 CA--C 1.545 0.763 0 CA-C-O 118.778 -0.63 . . . . 64.32 111.047 -177.107 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 76' ' ' GLN . . . . . 0.41 ' HA ' ' HG2' ' A' ' 79' ' ' LYS . 9.9 tt0 -69.46 -38.57 77.83 Favored 'General case' 0 N--CA 1.487 1.424 0 CA-C-N 118.464 0.575 . . . . 45.34 110.243 171.43 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 96.4 mt -60.62 -40.57 92.39 Favored 'General case' 0 N--CA 1.472 0.67 0 CA-C-N 115.592 -0.731 . . . . 63.34 109.087 171.031 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 78' ' ' LEU . . . . . 0.566 HD21 ' HA ' ' A' ' 22' ' ' LEU . 88.3 mt -63.76 -36.03 82.55 Favored 'General case' 0 CA--C 1.55 0.95 0 CA-C-O 118.44 -0.79 . . . . 71.12 112.262 171.634 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 79' ' ' LYS . . . . . 0.642 ' HE2' ' HB2' ' A' ' 99' ' ' GLN . 48.5 mmtm -59.34 -42.01 90.52 Favored 'General case' 0 N--CA 1.5 2.029 0 CA-C-N 119.032 0.833 . . . . 74.21 110.093 178.191 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -69.0 -43.08 74.84 Favored Glycine 0 C--N 1.349 1.297 0 CA-C-N 114.596 -1.184 . . . . 52.21 112.995 177.566 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -72.29 -33.04 67.12 Favored 'General case' 0 CA--C 1.555 1.169 0 C-N-CA 123.345 0.658 . . . . 73.51 110.436 -174.927 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 80.3 mt -73.71 -38.1 64.94 Favored 'General case' 0 N--CA 1.477 0.894 0 C-N-CA 123.35 0.66 . . . . 53.12 111.053 -178.516 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -159.93 -75.27 0.07 Allowed 'General case' 0 CA--C 1.544 0.741 0 O-C-N 123.367 0.417 . . . . 72.42 110.092 -178.811 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 9.4 tt0 -151.2 -70.0 0.17 Allowed 'General case' 0 N--CA 1.48 1.042 0 N-CA-C 110.327 -0.249 . . . . 64.23 110.327 -171.327 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 85' ' ' ARG . . . . . . . . . . . . . 9.6 ttm180 -167.38 146.85 5.14 Favored 'General case' 0 N--CA 1.479 0.996 0 N-CA-C 109.442 -0.577 . . . . 72.31 109.442 -178.447 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 86' ' ' LEU . . . . . 0.457 ' HB3' ' HB3' ' A' ' 96' ' ' SER . 91.8 mt 63.27 4.91 1.79 Allowed 'General case' 0 N--CA 1.488 1.463 0 C-N-CA 124.492 1.117 . . . . 71.13 112.247 -174.358 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 37.1 t70 -87.47 92.1 8.97 Favored 'General case' 0 C--N 1.353 0.744 0 CA-C-O 121.643 0.735 . . . . 73.35 109.985 -175.998 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 88' ' ' GLU . . . . . 0.562 ' HB3' ' HE3' ' A' ' 79' ' ' LYS . 4.3 pt-20 -89.19 156.63 18.66 Favored 'General case' 0 N--CA 1.482 1.162 0 C-N-CA 125.385 1.474 . . . . 73.13 110.798 -176.047 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 95.0 mt -50.66 -40.87 54.67 Favored 'General case' 0 N--CA 1.486 1.344 0 O-C-N 124.071 0.857 . . . . 70.24 111.372 -178.85 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 45.2 t -147.48 130.96 16.71 Favored 'General case' 0 C--O 1.241 0.627 0 CA-C-N 115.488 -0.778 . . . . 51.21 109.165 173.078 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 19.9 m -66.3 112.78 4.16 Favored 'General case' 0 C--O 1.24 0.592 0 O-C-N 124.269 0.981 . . . . 70.41 109.595 176.321 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 92' ' ' LEU . . . . . 0.496 ' HB2' ' HB ' ' A' ' 97' ' ' THR . 92.5 mt -60.43 -64.14 1.06 Allowed 'General case' 0 CA--C 1.543 0.697 0 O-C-N 123.686 0.616 . . . . 71.31 111.294 -175.654 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 39.0 mt -117.4 76.67 0.49 Allowed 'Isoleucine or valine' 0 CA--C 1.547 0.848 0 N-CA-C 109.042 -0.725 . . . . 71.2 109.042 -178.07 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 76.5 -77.03 1.45 Allowed Glycine 0 C--N 1.35 1.359 0 CA-C-N 115.388 -0.824 . . . . 71.31 113.604 174.272 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 2.9 mp0 -89.7 -173.13 3.82 Favored 'General case' 0 N--CA 1.478 0.952 0 C-N-CA 124.186 0.994 . . . . 75.04 110.364 178.71 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 96' ' ' SER . . . . . 0.457 ' HB3' ' HB3' ' A' ' 86' ' ' LEU . 58.8 m -63.27 95.8 0.1 Allowed 'General case' 0 CA--C 1.544 0.714 0 CA-C-N 115.063 -0.971 . . . . 61.13 110.367 174.618 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 97' ' ' THR . . . . . 0.496 ' HB ' ' HB2' ' A' ' 92' ' ' LEU . 87.3 m -100.37 -45.12 5.69 Favored 'General case' 0 C--O 1.215 -0.736 0 CA-C-N 114.796 -1.093 . . . . 73.24 111.272 -173.282 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 2.4 tmt_? -48.78 -58.24 5.11 Favored 'General case' 0 N--CA 1.482 1.165 0 C-N-CA 124.651 1.18 . . . . 71.3 112.077 -167.703 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 99' ' ' GLN . . . . . 0.642 ' HB2' ' HE2' ' A' ' 79' ' ' LYS . 48.3 tt0 -71.97 -43.81 64.57 Favored 'General case' 0 N--CA 1.472 0.659 0 N-CA-C 110.063 -0.347 . . . . 73.14 110.063 -169.729 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 29.4 ttpp -68.14 -47.38 68.25 Favored 'General case' 0 CA--C 1.546 0.802 0 C-N-CA 124.314 1.046 . . . . 64.15 111.192 -175.075 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 38.6 t -68.06 -42.6 80.22 Favored 'General case' 0 N--CA 1.472 0.671 0 C-N-CA 124.186 0.994 . . . . 62.34 110.729 -177.538 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 7.1 tp -74.56 -31.45 62.09 Favored 'General case' 0 CA--C 1.549 0.922 0 O-C-N 123.329 0.393 . . . . 71.21 111.187 -176.718 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 9.8 t30 -66.93 -41.89 86.25 Favored 'General case' 0 N--CA 1.48 1.059 0 C-N-CA 123.55 0.74 . . . . 44.43 109.696 173.938 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 27.7 t-20 -71.58 -28.88 64.13 Favored 'General case' 0 CA--C 1.54 0.568 0 CA-C-N 115.374 -0.83 . . . . 72.15 110.434 177.353 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -67.25 -38.79 85.74 Favored 'General case' 0 N--CA 1.48 1.037 0 C-N-CA 123.233 0.613 . . . . 74.54 110.454 176.627 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 106' ' ' TYR . . . . . 0.575 ' HE2' ' HB2' ' A' ' 69' ' ' LYS . 1.0 OUTLIER -61.21 -47.49 85.88 Favored 'General case' 0 C--N 1.355 0.814 0 N-CA-C 108.816 -0.809 . . . . 74.41 108.816 171.216 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -57.87 -40.69 93.47 Favored Glycine 0 C--N 1.351 1.386 0 O-C-N 123.732 0.645 . . . . 63.52 112.781 179.446 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 2.5 mmp_? -68.14 -34.17 75.84 Favored 'General case' 0 C--N 1.345 0.377 0 C-N-CA 123.508 0.723 . . . . 73.31 110.036 177.063 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 109' ' ' LEU . . . . . 0.445 ' HA ' ' N ' ' A' ' 114' ' ' LEU . 53.1 tp -68.37 -32.64 72.87 Favored 'General case' 0 N--CA 1.482 1.167 0 C-N-CA 123.174 0.589 . . . . 70.12 111.114 177.659 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 33.5 t -72.45 -42.49 64.95 Favored 'General case' 0 CA--C 1.541 0.598 0 CA-C-N 115.66 -0.7 . . . . 32.52 109.803 177.747 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . -88.71 -61.73 1.42 Allowed Glycine 0 C--N 1.355 1.611 0 C-N-CA 121.144 -0.551 . . . . 42.13 114.127 -175.773 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 112' ' ' MET . . . . . . . . . . . . . 2.2 mmm -93.72 -66.65 0.91 Allowed 'General case' 0 N--CA 1.486 1.338 0 CA-C-N 117.927 0.863 . . . . 71.34 112.904 -176.245 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 113' ' ' LEU . . . . . 0.424 ' HA ' HD23 ' A' ' 113' ' ' LEU . 6.6 mt 157.27 44.77 0.0 OUTLIER 'General case' 0 N--CA 1.503 2.183 0 C-N-CA 126.364 1.866 . . . . 64.23 108.6 -174.191 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 114' ' ' LEU . . . . . 0.445 ' N ' ' HA ' ' A' ' 109' ' ' LEU . 1.0 OUTLIER 76.03 -13.96 0.84 Allowed 'General case' 0 N--CA 1.503 2.194 0 C-N-CA 125.387 1.475 . . . . 74.1 111.788 174.703 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 115' ' ' VAL . . . . . 0.683 HG11 ' HA ' ' A' ' 119' ' ' PRO . 19.9 m -88.39 157.27 50.43 Favored Pre-proline 0 CA--C 1.548 0.9 0 C-N-CA 124.39 1.076 . . . . 75.42 110.266 -178.395 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 76.7 Cg_exo -53.02 -42.28 65.69 Favored 'Trans proline' 0 C--N 1.378 2.083 0 C-N-CA 123.242 2.628 . . . . 75.45 113.221 178.374 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 12.7 p-10 -166.46 -35.85 0.03 OUTLIER 'General case' 0 N--CA 1.484 1.268 0 C-N-CA 123.035 0.534 . . . . 72.34 111.218 -176.915 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -123.02 135.66 26.1 Favored Pre-proline 0 N--CA 1.477 0.918 0 C-N-CA 123.331 0.652 . . . . 73.14 109.856 -178.349 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 119' ' ' PRO . . . . . 0.683 ' HA ' HG11 ' A' ' 115' ' ' VAL . 91.9 Cg_endo -81.67 55.34 5.48 Favored 'Trans proline' 0 C--N 1.379 2.152 0 C-N-CA 123.43 2.753 . . . . 75.24 111.324 176.815 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . 101.1 -133.64 11.4 Favored Glycine 0 C--N 1.343 0.924 0 CA-C-N 114.024 -1.444 . . . . 73.52 111.263 -172.577 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . 62.81 13.75 6.77 Favored 'General case' 0 N--CA 1.488 1.472 0 C-N-CA 124.681 1.192 . . . . 55.11 112.434 -179.988 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 122' ' ' SER . . . . . . . . . . . . . 20.3 m . . . . . 0 C--O 1.252 1.207 0 C-N-CA 124.269 1.028 . . . . 73.22 108.961 -175.862 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 1' ' ' MET . . . . . 0.516 ' HG3' HG23 ' A' ' 5' ' ' VAL . 21.0 ptt? . . . . . 0 N--CA 1.486 1.339 0 CA-C-O 120.963 0.411 . . . . 44.23 110.5 . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 43.8 m -54.98 -61.32 2.39 Favored 'General case' 0 N--CA 1.482 1.141 0 C-N-CA 123.571 0.748 . . . . 53.04 112.344 -172.107 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 17.0 m -63.78 -28.66 70.02 Favored 'General case' 0 N--CA 1.478 0.962 0 C-N-CA 123.529 0.732 . . . . 74.04 112.341 -174.726 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 23.6 m -77.96 -36.56 48.98 Favored 'General case' 0 CA--C 1.549 0.934 0 C-N-CA 123.421 0.688 . . . . 51.23 111.569 -179.665 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 5' ' ' VAL . . . . . 0.516 HG23 ' HG3' ' A' ' 1' ' ' MET . 51.5 t -71.08 -38.62 72.22 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.107 0 C-N-CA 122.851 0.46 . . . . 73.44 110.143 175.76 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 6' ' ' GLU . . . . . 0.54 ' HB3' ' NH1' ' A' ' 10' ' ' ARG . 45.6 mm-40 -60.83 -45.38 94.68 Favored 'General case' 0 N--CA 1.478 0.931 0 O-C-N 123.639 0.587 . . . . 74.4 110.128 173.48 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 81.8 t80 -53.09 -58.75 5.94 Favored 'General case' 0 CA--C 1.549 0.934 0 C-N-CA 125.242 1.417 . . . . 73.2 111.534 176.646 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 8' ' ' ILE . . . . . 0.454 ' O ' ' HG3' ' A' ' 12' ' ' GLN . 70.6 mt -61.1 -45.78 97.91 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.015 0 O-C-N 123.766 0.666 . . . . 74.14 110.559 -178.78 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 4.3 t-20 -64.89 -29.54 70.5 Favored 'General case' 0 N--CA 1.482 1.132 0 C-N-CA 123.539 0.736 . . . . 65.55 111.379 -175.814 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 10' ' ' ARG . . . . . 0.593 ' HB3' HG22 ' A' ' 47' ' ' VAL . 68.3 mtt85 -78.55 -32.17 47.74 Favored 'General case' 0 CA--C 1.541 0.627 0 C-N-CA 122.986 0.514 . . . . 70.4 111.214 176.571 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 11' ' ' TRP . . . . . . . . . . . . . 85.5 m95 -71.01 -29.92 66.0 Favored 'General case' 0 N--CA 1.487 1.399 0 CA-C-N 117.53 0.15 . . . . 75.3 111.007 169.987 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 12' ' ' GLN . . . . . 0.578 ' HG2' ' CE2' ' A' ' 67' ' ' TYR . 42.9 mt-30 -63.61 -46.81 84.05 Favored 'General case' 0 C--N 1.357 0.928 0 N-CA-C 108.329 -0.989 . . . . 65.14 108.329 170.78 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 11.9 tpt180 -55.77 -49.45 73.12 Favored 'General case' 0 CA--C 1.544 0.73 0 O-C-N 124.375 1.047 . . . . 74.41 111.513 -179.118 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 54.1 mt -63.69 -45.07 98.41 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.292 0 O-C-N 123.271 0.357 . . . . 65.4 110.301 179.25 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 15' ' ' ALA . . . . . 0.594 ' HA ' ' HB ' ' A' ' 71' ' ' THR . . . -56.46 -45.45 80.87 Favored 'General case' 0 N--CA 1.485 1.321 0 C-N-CA 123.959 0.904 . . . . 43.54 111.664 178.572 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.404 ' HG ' ' O ' ' A' ' 12' ' ' GLN . 95.9 mt -79.38 -35.75 40.28 Favored 'General case' 0 N--CA 1.478 0.933 0 CA-C-N 114.562 -1.199 . . . . 72.13 111.233 -172.352 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.472 ' O ' ' HG ' ' A' ' 21' ' ' LEU . 45.6 mt -66.21 -51.84 53.74 Favored 'General case' 0 N--CA 1.476 0.849 0 O-C-N 123.655 0.597 . . . . 74.44 109.774 178.518 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 88.4 p -62.21 -38.47 89.3 Favored 'General case' 0 N--CA 1.479 0.981 0 C-N-CA 123.229 0.612 . . . . 72.12 111.031 179.457 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 6.7 tp-100 -58.61 -48.97 79.2 Favored 'General case' 0 C--N 1.356 0.867 0 O-C-N 123.873 0.733 . . . . 74.42 110.858 174.311 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 20' ' ' SER . . . . . 0.412 ' O ' ' HG ' ' A' ' 24' ' ' LEU . 69.2 m -61.09 -46.6 89.98 Favored 'General case' 0 C--O 1.213 -0.851 0 O-C-N 124.053 0.846 . . . . 61.44 110.159 178.609 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 21' ' ' LEU . . . . . 0.472 ' HG ' ' O ' ' A' ' 17' ' ' LEU . 68.5 mt -68.44 -27.53 66.26 Favored 'General case' 0 CA--C 1.537 0.471 0 C-N-CA 123.328 0.651 . . . . 73.04 111.125 -175.469 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.686 ' HA ' HD21 ' A' ' 78' ' ' LEU . 46.4 tp -71.67 -48.36 48.07 Favored 'General case' 0 N--CA 1.477 0.875 0 N-CA-C 109.372 -0.603 . . . . 32.44 109.372 176.639 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 23' ' ' GLU . . . . . 0.432 ' HB3' ' NH1' ' A' ' 27' ' ' ARG . 45.1 mt-10 -54.51 -55.14 32.19 Favored 'General case' 0 N--CA 1.479 0.984 0 O-C-N 124.3 1.0 . . . . 62.53 110.365 175.656 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.412 ' HG ' ' O ' ' A' ' 20' ' ' SER . 92.5 mt -61.13 -45.7 93.58 Favored 'General case' 0 CA--C 1.541 0.632 0 CA-C-N 114.683 -1.144 . . . . 62.55 111.356 -176.445 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 25' ' ' ALA . . . . . 0.515 ' HB2' HD21 ' A' ' 33' ' ' LEU . . . -59.62 -46.65 88.36 Favored 'General case' 0 N--CA 1.482 1.142 0 C-N-CA 122.969 0.507 . . . . 51.5 111.609 -178.94 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 95.1 mt-30 -72.4 -23.04 61.04 Favored 'General case' 0 CA--C 1.549 0.905 0 CA-C-N 115.589 -0.732 . . . . 65.44 111.551 -179.174 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 27' ' ' ARG . . . . . 0.432 ' NH1' ' HB3' ' A' ' 23' ' ' GLU . 88.9 mtt180 -88.63 4.85 45.59 Favored 'General case' 0 N--CA 1.487 1.387 0 C-N-CA 123.537 0.735 . . . . 74.21 111.776 174.304 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 77.76 9.18 87.07 Favored Glycine 0 C--N 1.352 1.466 0 N-CA-C 114.122 0.409 . . . . 62.43 114.122 177.117 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 29' ' ' GLU . . . . . 0.46 ' HB3' HD12 ' A' ' 32' ' ' LEU . 18.1 mm-40 -86.04 49.65 1.82 Allowed 'General case' 0 CA--C 1.556 1.18 0 C-N-CA 124.296 1.038 . . . . 64.2 110.259 178.287 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 30' ' ' TRP . . . . . 0.485 ' HA ' HD13 ' A' ' 33' ' ' LEU . 74.8 m95 -62.5 -30.47 71.3 Favored 'General case' 0 N--CA 1.485 1.297 0 C-N-CA 123.376 0.67 . . . . 73.34 111.027 -176.406 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 17.2 m-20 -56.27 -44.72 80.01 Favored 'General case' 0 N--CA 1.472 0.657 0 C-N-CA 123.781 0.833 . . . . 52.25 111.019 176.225 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.46 HD12 ' HB3' ' A' ' 29' ' ' GLU . 96.2 mt -64.21 -30.1 71.17 Favored 'General case' 0 CA--C 1.552 1.033 0 CA-C-N 115.755 -0.657 . . . . 72.11 110.927 -179.912 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 33' ' ' LEU . . . . . 0.515 HD21 ' HB2' ' A' ' 25' ' ' ALA . 8.4 mp -66.75 -41.93 86.99 Favored 'General case' 0 N--CA 1.491 1.584 0 C-N-CA 122.536 0.335 . . . . 70.1 110.574 171.389 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 71.8 mt -59.61 -45.43 91.97 Favored 'General case' 0 N--CA 1.484 1.241 0 C-N-CA 123.106 0.563 . . . . 74.4 111.456 -179.217 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 10.4 mp0 -71.22 -28.16 64.0 Favored 'General case' 0 N--CA 1.483 1.213 0 C-N-CA 123.188 0.595 . . . . 71.33 111.875 177.466 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 86.3 mm-40 -88.88 -11.72 43.81 Favored 'General case' 0 N--CA 1.485 1.311 0 N-CA-C 112.907 0.706 . . . . 64.52 112.907 179.027 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 37' ' ' GLU . . . . . 0.451 ' O ' ' HG ' ' A' ' 41' ' ' LEU . 38.5 tt0 -47.52 -59.66 3.08 Favored 'General case' 0 N--CA 1.481 1.118 0 C-N-CA 124.109 0.964 . . . . 72.44 112.394 -178.696 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 73.9 t -57.52 -41.06 78.1 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.28 0 C-N-CA 123.255 0.622 . . . . 72.22 111.375 -179.365 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 42.9 m -61.98 -43.74 98.19 Favored 'General case' 0 CA--C 1.543 0.71 0 C-N-CA 123.36 0.664 . . . . 62.11 111.431 179.351 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 47.6 t80 -69.34 -48.5 61.2 Favored 'General case' 0 N--CA 1.468 0.469 0 CA-C-N 115.567 -0.742 . . . . 72.13 110.471 -176.476 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 41' ' ' LEU . . . . . 0.472 HD22 HD21 ' A' ' 92' ' ' LEU . 46.5 mt -66.08 -44.51 84.25 Favored 'General case' 0 CA--C 1.538 0.502 0 O-C-N 124.485 1.116 . . . . 65.01 110.408 -176.371 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 48.3 tt0 -58.95 -49.95 75.89 Favored 'General case' 0 N--CA 1.473 0.681 0 O-C-N 123.695 0.622 . . . . 73.14 110.132 178.576 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 43' ' ' SER . . . . . 0.563 ' O ' HG23 ' A' ' 47' ' ' VAL . 69.5 m -58.93 -55.29 37.02 Favored 'General case' 0 C--N 1.354 0.761 0 O-C-N 123.803 0.689 . . . . 64.31 111.808 -178.989 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 10.1 tt -60.38 -42.44 90.9 Favored 'Isoleucine or valine' 0 CA--C 1.557 1.236 0 C-N-CA 122.854 0.461 . . . . 73.3 111.395 -173.994 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 45' ' ' GLU . . . . . 0.434 ' O ' ' HG3' ' A' ' 49' ' ' GLU . 8.6 mm-40 -61.57 -49.25 77.42 Favored 'General case' 0 N--CA 1.48 1.066 0 C-N-CA 123.056 0.542 . . . . 72.21 111.035 176.224 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 46' ' ' THR . . . . . 0.542 ' O ' ' HD3' ' A' ' 50' ' ' LYS . 95.9 m -57.53 -43.12 84.08 Favored 'General case' 0 N--CA 1.479 1.003 0 C-N-CA 123.802 0.841 . . . . 63.55 111.825 -177.141 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 47' ' ' VAL . . . . . 0.593 HG22 ' HB3' ' A' ' 10' ' ' ARG . 30.5 t -67.82 -42.56 86.07 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.717 0 C-N-CA 122.868 0.467 . . . . 73.34 110.163 -179.543 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 48' ' ' MET . . . . . . . . . . . . . 79.1 mtm -70.58 -15.57 62.77 Favored 'General case' 0 N--CA 1.48 1.074 0 N-CA-C 112.286 0.476 . . . . 75.14 112.286 177.809 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 49' ' ' GLU . . . . . 0.434 ' HG3' ' O ' ' A' ' 45' ' ' GLU . 62.5 mt-10 -73.29 -35.99 66.22 Favored 'General case' 0 N--CA 1.488 1.463 0 CA-C-N 118.152 0.433 . . . . 61.44 111.436 171.664 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 50' ' ' LYS . . . . . 0.542 ' HD3' ' O ' ' A' ' 46' ' ' THR . 10.8 mptt -78.32 135.86 37.59 Favored 'General case' 0 N--CA 1.483 1.2 0 C-N-CA 123.162 0.585 . . . . 74.31 111.192 -170.552 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 50.1 tt0 -69.15 148.29 50.13 Favored 'General case' 0 N--CA 1.474 0.747 0 C-N-CA 124.276 1.03 . . . . 71.51 110.791 177.632 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 25.1 m -65.7 127.03 92.75 Favored Pre-proline 0 CA--C 1.555 1.137 0 C-N-CA 123.893 0.877 . . . . 61.44 110.643 178.296 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 15.3 Cg_exo -69.84 151.32 68.56 Favored 'Trans proline' 0 C--N 1.38 2.235 0 C-N-CA 121.912 1.741 . . . . 64.43 111.372 173.01 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 41.7 Cg_endo -67.81 -44.12 4.5 Favored 'Trans proline' 0 C--N 1.372 1.774 0 C-N-CA 122.999 2.466 . . . . 74.5 112.035 173.832 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . -76.68 66.86 2.68 Favored Glycine 0 C--N 1.352 1.427 0 CA-C-N 116.029 -0.532 . . . . 50.02 113.645 -178.349 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 56' ' ' ILE . . . . . 0.426 HG23 HG22 ' A' ' 60' ' ' ILE . 58.2 mt -110.0 106.45 20.75 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.653 0 N-CA-C 107.41 -1.329 . . . . 73.22 107.41 170.107 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 57' ' ' THR . . . . . 0.434 ' H ' HD12 ' A' ' 60' ' ' ILE . 31.2 p -75.08 178.8 5.41 Favored 'General case' 0 N--CA 1.473 0.723 0 C-N-CA 122.911 0.484 . . . . 73.35 110.244 -179.314 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 40.8 tpt85 -64.08 -46.53 83.88 Favored 'General case' 0 N--CA 1.471 0.606 0 C-N-CA 123.273 0.629 . . . . 70.05 109.961 -179.964 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 31.8 m -63.01 -40.57 98.17 Favored 'General case' 0 CA--C 1.547 0.827 0 CA-C-N 115.596 -0.729 . . . . 70.22 111.34 178.264 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 60' ' ' ILE . . . . . 0.434 HD12 ' H ' ' A' ' 57' ' ' THR . 74.8 mt -63.16 -41.41 92.72 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.163 0 C-N-CA 122.962 0.505 . . . . 60.44 110.608 176.064 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 61.1 tt0 -59.82 -42.65 93.99 Favored 'General case' 0 N--CA 1.476 0.859 0 C-N-CA 123.641 0.776 . . . . 73.3 110.429 179.493 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 50.0 m-20 -68.23 -45.65 72.7 Favored 'General case' 0 N--CA 1.48 1.025 0 O-C-N 123.563 0.54 . . . . 75.02 112.227 178.374 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 63' ' ' MET . . . . . . . . . . . . . 65.4 mtm -64.24 -49.93 69.99 Favored 'General case' 0 N--CA 1.486 1.337 0 C-N-CA 122.331 0.253 . . . . 72.31 110.876 -177.281 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 64' ' ' VAL . . . . . 0.503 ' O ' HG13 ' A' ' 68' ' ' ILE . 82.1 t -60.46 -54.99 27.5 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.815 0 O-C-N 124.171 0.919 . . . . 64.14 110.945 178.238 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -65.99 -28.8 69.15 Favored 'General case' 0 N--CA 1.494 1.765 0 CA-C-N 118.492 0.587 . . . . 74.5 112.083 -178.817 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -69.23 -38.86 82.63 Favored Glycine 0 C--N 1.343 0.966 0 N-CA-C 111.386 -0.685 . . . . 71.31 111.386 176.407 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 67' ' ' TYR . . . . . 0.578 ' CE2' ' HG2' ' A' ' 12' ' ' GLN . 10.8 m-85 -71.0 -36.01 72.29 Favored 'General case' 0 N--CA 1.467 0.413 0 C-N-CA 123.605 0.762 . . . . 64.11 111.134 175.059 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 68' ' ' ILE . . . . . 0.562 ' O ' ' HG ' ' A' ' 72' ' ' LEU . 60.8 mt -63.18 -48.54 87.14 Favored 'Isoleucine or valine' 0 C--N 1.36 1.042 0 N-CA-C 108.649 -0.871 . . . . 73.2 108.649 176.22 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 69' ' ' LYS . . . . . 0.616 ' HB2' ' HE2' ' A' ' 106' ' ' TYR . 0.7 OUTLIER -57.67 -48.22 80.12 Favored 'General case' 0 C--N 1.356 0.861 0 C-N-CA 123.58 0.752 . . . . 72.3 110.297 -179.06 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 9.2 tt0 -60.22 -45.7 92.32 Favored 'General case' 0 C--N 1.347 0.489 0 O-C-N 124.491 1.119 . . . . 65.52 110.979 -179.026 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 71' ' ' THR . . . . . 0.594 ' HB ' ' HA ' ' A' ' 15' ' ' ALA . 15.1 t -77.9 -22.97 48.87 Favored 'General case' 0 C--N 1.354 0.779 0 CA-C-O 119.329 -0.367 . . . . 74.12 110.257 -175.554 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 72' ' ' LEU . . . . . 0.562 ' HG ' ' O ' ' A' ' 68' ' ' ILE . 28.6 mt -63.81 -50.94 66.97 Favored 'General case' 0 C--N 1.359 0.986 0 N-CA-C 108.524 -0.917 . . . . 74.13 108.524 171.831 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 73' ' ' ASP . . . . . 0.477 ' O ' ' HG ' ' A' ' 77' ' ' LEU . 60.6 m-20 -62.4 -53.75 50.42 Favored 'General case' 0 N--CA 1.476 0.842 0 O-C-N 124.363 1.039 . . . . 72.32 111.264 -178.349 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 74' ' ' ASN . . . . . 0.469 ' HA ' HD22 ' A' ' 22' ' ' LEU . 74.7 m-20 -54.32 -53.93 47.25 Favored 'General case' 0 N--CA 1.487 1.403 0 C-N-CA 123.647 0.779 . . . . 61.43 110.825 -178.904 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 43.1 tt0 -66.47 -31.03 71.51 Favored 'General case' 0 CA--C 1.549 0.942 0 C-N-CA 123.802 0.841 . . . . 70.15 111.548 -178.46 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 76' ' ' GLN . . . . . 0.495 ' HB2' ' O ' ' A' ' 72' ' ' LEU . 8.1 tt0 -74.86 -36.36 62.32 Favored 'General case' 0 N--CA 1.482 1.155 0 N-CA-C 109.906 -0.405 . . . . 52.3 109.906 -178.597 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 77' ' ' LEU . . . . . 0.477 ' HG ' ' O ' ' A' ' 73' ' ' ASP . 89.5 mt -67.38 -40.7 85.7 Favored 'General case' 0 C--N 1.351 0.654 0 O-C-N 123.84 0.712 . . . . 64.25 109.347 176.602 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 78' ' ' LEU . . . . . 0.686 HD21 ' HA ' ' A' ' 22' ' ' LEU . 73.0 mt -63.82 -62.85 1.38 Allowed 'General case' 0 N--CA 1.482 1.131 0 C-N-CA 123.915 0.886 . . . . 44.33 112.242 177.739 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 79' ' ' LYS . . . . . 0.47 ' HE2' ' HG ' ' A' ' 89' ' ' LEU . 1.0 OUTLIER -66.43 -32.89 74.54 Favored 'General case' 0 N--CA 1.476 0.873 0 C-N-CA 123.558 0.743 . . . . 72.2 110.479 -174.442 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -65.85 -40.68 95.65 Favored Glycine 0 C--N 1.349 1.262 0 CA-C-N 115.832 -0.622 . . . . 62.31 112.353 173.843 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 81' ' ' LEU . . . . . 0.433 ' HB2' ' O ' ' A' ' 77' ' ' LEU . 6.0 tt -62.13 -40.22 95.18 Favored 'General case' 0 N--CA 1.487 1.377 0 C-N-CA 124.217 1.007 . . . . 72.13 109.612 175.743 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 82' ' ' LEU . . . . . 0.443 HD12 ' HA ' ' A' ' 79' ' ' LYS . 99.1 mt -58.1 -52.8 64.03 Favored 'General case' 0 C--N 1.358 0.96 0 O-C-N 124.07 0.856 . . . . 72.42 110.11 -179.391 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 21.5 tp60 -169.67 -45.76 0.02 OUTLIER 'General case' 0 N--CA 1.48 1.045 0 O-C-N 123.844 0.715 . . . . 73.32 112.08 176.275 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -148.37 147.73 29.56 Favored 'General case' 0 N--CA 1.486 1.345 0 N-CA-C 109.403 -0.592 . . . . 55.24 109.403 -170.007 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 85' ' ' ARG . . . . . . . . . . . . . 19.6 ttm-85 -48.93 -51.82 28.07 Favored 'General case' 0 N--CA 1.485 1.314 0 C-N-CA 124.282 1.033 . . . . 73.21 111.969 179.335 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 86' ' ' LEU . . . . . 0.437 ' HB3' ' HA ' ' A' ' 96' ' ' SER . 75.0 mt -83.46 -0.31 49.52 Favored 'General case' 0 CA--C 1.552 1.031 0 CA-C-N 114.927 -1.033 . . . . 74.01 112.548 -172.248 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 26.6 t70 -67.21 172.69 4.46 Favored 'General case' 0 N--CA 1.49 1.563 0 C-N-CA 124.385 1.074 . . . . 52.3 110.603 177.302 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 88' ' ' GLU . . . . . 0.407 ' CD ' ' HZ3' ' A' ' 79' ' ' LYS . 13.7 tp10 -153.13 157.1 39.85 Favored 'General case' 0 CA--C 1.549 0.906 0 C-N-CA 122.989 0.516 . . . . 62.14 110.6 -174.888 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 89' ' ' LEU . . . . . 0.47 ' HG ' ' HE2' ' A' ' 79' ' ' LYS . 92.7 mt -61.27 -51.2 69.92 Favored 'General case' 0 N--CA 1.476 0.858 0 C-N-CA 124.849 1.26 . . . . 74.11 111.318 175.194 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 18.4 t -154.84 -164.83 1.89 Allowed 'General case' 0 CA--C 1.558 1.283 0 C-N-CA 122.871 0.468 . . . . 71.32 110.217 -178.284 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 14.5 p -75.6 107.06 7.5 Favored 'General case' 0 CA--C 1.557 1.229 0 N-CA-C 114.14 1.163 . . . . 62.3 114.14 -167.929 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 92' ' ' LEU . . . . . 0.472 HD21 HD22 ' A' ' 41' ' ' LEU . 59.5 mt -89.62 -154.73 0.33 Allowed 'General case' 0 N--CA 1.484 1.254 0 C-N-CA 124.346 1.058 . . . . 60.23 108.317 162.789 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 93' ' ' ILE . . . . . 0.539 ' HB ' HG21 ' A' ' 97' ' ' THR . 68.7 mt -51.26 -40.88 23.66 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.61 0 CA-C-O 121.364 0.602 . . . . 55.31 110.401 167.072 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 179.07 -174.69 46.7 Favored Glycine 0 C--O 1.242 0.63 0 CA-C-N 114.724 -1.125 . . . . 25.24 110.711 175.211 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 91.8 mm-40 -75.82 149.53 37.87 Favored 'General case' 0 CA--C 1.541 0.631 0 N-CA-C 110.172 -0.307 . . . . 60.53 110.172 174.722 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 96' ' ' SER . . . . . 0.437 ' HA ' ' HB3' ' A' ' 86' ' ' LEU . 29.9 t 75.77 -16.6 0.58 Allowed 'General case' 0 N--CA 1.484 1.247 0 C-N-CA 125.865 1.666 . . . . 44.02 113.119 -174.554 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 97' ' ' THR . . . . . 0.539 HG21 ' HB ' ' A' ' 93' ' ' ILE . 86.7 m -59.52 -36.86 76.93 Favored 'General case' 0 N--CA 1.477 0.89 0 C-N-CA 123.4 0.68 . . . . 70.24 112.186 -176.109 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 98' ' ' ARG . . . . . 0.547 ' HG3' ' H ' ' A' ' 99' ' ' GLN . 0.0 OUTLIER -56.42 -57.28 12.98 Favored 'General case' 0 CA--C 1.554 1.119 0 O-C-N 123.434 0.459 . . . . 74.32 111.665 -178.936 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 99' ' ' GLN . . . . . 0.547 ' H ' ' HG3' ' A' ' 98' ' ' ARG . 23.1 tm0? -78.64 -42.48 28.65 Favored 'General case' 0 C--N 1.349 0.558 0 N-CA-C 109.28 -0.637 . . . . 73.12 109.28 -170.643 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 4.5 tppp? -62.53 -52.36 63.77 Favored 'General case' 0 CA--C 1.539 0.525 0 O-C-N 123.707 0.629 . . . . 74.55 110.992 -176.592 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 33.3 t -72.89 -36.87 67.41 Favored 'General case' 0 CA--C 1.543 0.692 0 O-C-N 123.61 0.569 . . . . 74.51 111.449 -174.973 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 5.0 tp -75.98 -32.81 59.65 Favored 'General case' 0 N--CA 1.487 1.403 0 CA-C-N 118.21 0.459 . . . . 63.21 111.4 -177.743 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 7.5 t30 -78.91 -31.03 45.14 Favored 'General case' 0 N--CA 1.489 1.517 0 C-N-CA 123.326 0.65 . . . . 62.55 110.35 176.87 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 53.1 t30 -66.03 -38.75 89.21 Favored 'General case' 0 N--CA 1.487 1.393 0 C-N-CA 123.604 0.761 . . . . 75.45 109.384 171.859 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -60.49 -48.57 81.18 Favored 'General case' 0 CA--C 1.54 0.586 0 CA-C-N 115.002 -0.999 . . . . 73.52 110.522 175.459 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 106' ' ' TYR . . . . . 0.616 ' HE2' ' HB2' ' A' ' 69' ' ' LYS . 6.3 t80 -56.28 -45.07 80.29 Favored 'General case' 0 C--N 1.355 0.84 0 O-C-N 123.62 0.575 . . . . 72.42 110.18 174.702 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -58.32 -43.56 95.55 Favored Glycine 0 C--N 1.354 1.568 0 O-C-N 123.842 0.714 . . . . 71.33 112.882 -177.285 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 99.7 mtt180 -68.47 -37.93 80.6 Favored 'General case' 0 CA--C 1.544 0.715 0 C-N-CA 123.196 0.598 . . . . 73.52 111.116 177.615 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 109' ' ' LEU . . . . . 0.492 ' HA ' ' N ' ' A' ' 114' ' ' LEU . 35.8 tp -72.84 -31.15 64.57 Favored 'General case' 0 N--CA 1.488 1.449 0 C-N-CA 123.06 0.544 . . . . 65.42 111.554 -178.383 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 33.3 t -79.87 -32.55 40.43 Favored 'General case' 0 CA--C 1.537 0.48 0 C-N-CA 123.789 0.836 . . . . 65.05 109.337 178.148 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . -87.9 -64.35 1.36 Allowed Glycine 0 C--N 1.36 1.904 0 CA-C-O 119.164 -0.798 . . . . 62.21 113.606 -178.439 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 112' ' ' MET . . . . . . . . . . . . . 21.7 mmm -96.98 -69.0 0.77 Allowed 'General case' 0 N--CA 1.489 1.518 0 CA-C-N 118.34 1.07 . . . . 74.04 113.194 178.058 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 13.6 tp 172.03 25.7 0.0 OUTLIER 'General case' 0 N--CA 1.495 1.786 0 O-C-N 123.77 0.669 . . . . 74.24 110.888 -173.3 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 114' ' ' LEU . . . . . 0.492 ' N ' ' HA ' ' A' ' 109' ' ' LEU . 41.5 tp 84.2 -12.33 0.79 Allowed 'General case' 0 N--CA 1.501 2.092 0 C-N-CA 126.571 1.948 . . . . 71.14 111.9 -177.443 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 115' ' ' VAL . . . . . . . . . . . . . 35.9 m -66.77 143.94 98.32 Favored Pre-proline 0 CA--C 1.553 1.083 0 C-N-CA 122.502 0.321 . . . . 74.31 110.169 173.233 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 21.5 Cg_exo -65.74 163.69 29.57 Favored 'Trans proline' 0 C--N 1.375 1.963 0 C-N-CA 122.475 2.117 . . . . 73.22 112.281 176.611 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 17.4 m-20 59.79 79.88 0.22 Allowed 'General case' 0 N--CA 1.474 0.726 0 C-N-CA 125.018 1.327 . . . . 73.31 110.379 -176.558 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -110.22 91.67 11.92 Favored Pre-proline 0 CA--C 1.549 0.936 0 C-N-CA 123.715 0.806 . . . . 71.23 110.437 -179.293 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 119' ' ' PRO . . . . . . . . . . . . . 91.4 Cg_endo -76.12 -11.27 19.51 Favored 'Trans proline' 0 C--N 1.378 2.083 0 C-N-CA 122.95 2.433 . . . . 75.44 112.398 175.5 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . 130.28 137.38 4.16 Favored Glycine 0 C--N 1.347 1.151 0 N-CA-C 111.24 -0.744 . . . . 43.35 111.24 -178.97 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . -151.88 156.47 40.19 Favored 'General case' 0 N--CA 1.475 0.793 0 C-N-CA 123.575 0.75 . . . . 64.15 110.762 177.317 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 122' ' ' SER . . . . . . . . . . . . . 29.7 t . . . . . 0 CA--C 1.558 1.263 0 C-N-CA 123.964 0.906 . . . . 62.22 108.743 -179.196 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 1' ' ' MET . . . . . 0.605 ' HG2' ' HB ' ' A' ' 4' ' ' THR . 0.0 OUTLIER . . . . . 0 CA--C 1.55 0.96 0 N-CA-C 109.362 -0.607 . . . . 74.14 109.362 . . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 42.2 p -57.81 -48.05 80.85 Favored 'General case' 0 N--CA 1.479 1.011 0 C-N-CA 124.411 1.084 . . . . 62.24 113.555 -166.531 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 36.2 m -66.08 -38.52 88.49 Favored 'General case' 0 N--CA 1.476 0.873 0 O-C-N 123.522 0.514 . . . . 70.54 111.543 -176.078 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 4' ' ' THR . . . . . 0.618 ' HA ' ' HG3' ' A' ' 53' ' ' PRO . 15.0 m -76.24 -38.65 56.07 Favored 'General case' 0 N--CA 1.475 0.822 0 O-C-N 123.576 0.547 . . . . 62.25 112.155 -176.575 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 85.5 t -67.86 -40.52 83.7 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.87 0 N-CA-C 109.612 -0.514 . . . . 74.33 109.612 177.109 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 6' ' ' GLU . . . . . 0.505 ' O ' ' HG3' ' A' ' 10' ' ' ARG . 2.6 tm-20 -64.67 -36.83 85.53 Favored 'General case' 0 CA--C 1.549 0.922 0 C-N-CA 123.666 0.786 . . . . 73.34 109.854 175.694 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 7' ' ' PHE . . . . . 0.44 ' HZ ' HD13 ' A' ' 114' ' ' LEU . 81.3 t80 -64.26 -47.21 80.49 Favored 'General case' 0 N--CA 1.481 1.083 0 C-N-CA 124.764 1.225 . . . . 75.35 111.851 177.342 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 8' ' ' ILE . . . . . 0.436 ' O ' ' HG3' ' A' ' 12' ' ' GLN . 79.1 mt -62.99 -39.71 86.23 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.91 0 N-CA-C 109.042 -0.725 . . . . 41.42 109.042 175.588 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 2.4 t-20 -61.06 -35.54 77.21 Favored 'General case' 0 N--CA 1.484 1.231 0 C-N-CA 124.695 1.198 . . . . 61.21 111.151 178.146 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 10' ' ' ARG . . . . . 0.505 ' HG3' ' O ' ' A' ' 6' ' ' GLU . 42.1 mtt180 -59.15 -56.7 18.86 Favored 'General case' 0 N--CA 1.474 0.757 0 C-N-CA 123.473 0.709 . . . . 65.01 109.269 172.416 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 11' ' ' TRP . . . . . 0.424 ' CD1' HG13 ' A' ' 64' ' ' VAL . 93.8 m95 -69.68 -23.47 63.46 Favored 'General case' 0 N--CA 1.468 0.468 0 CA-C-N 114.966 -1.015 . . . . 74.52 112.758 -175.704 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 12' ' ' GLN . . . . . 0.436 ' HG3' ' O ' ' A' ' 8' ' ' ILE . 59.3 mt-30 -66.84 -50.37 62.77 Favored 'General case' 0 N--CA 1.473 0.724 0 N-CA-C 108.141 -1.059 . . . . 71.12 108.141 172.436 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 13' ' ' ARG . . . . . 0.575 ' HE ' HD11 ' A' ' 17' ' ' LEU . 13.2 tpt180 -57.25 -47.9 80.21 Favored 'General case' 0 CA--C 1.549 0.922 0 O-C-N 124.249 0.968 . . . . 71.45 111.221 -177.758 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 14' ' ' ILE . . . . . 0.661 HD11 HG21 ' A' ' 47' ' ' VAL . 49.0 mt -67.95 -46.17 82.45 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.063 0 CA-C-N 115.744 -0.662 . . . . 72.03 110.247 -177.309 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 15' ' ' ALA . . . . . 0.431 ' HB1' ' OE1' ' A' ' 70' ' ' GLN . . . -61.55 -44.79 96.4 Favored 'General case' 0 N--CA 1.484 1.265 0 C-N-CA 123.614 0.766 . . . . 64.11 112.038 -178.449 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 85.4 mt -71.18 -44.68 64.98 Favored 'General case' 0 N--CA 1.477 0.897 0 CA-C-N 114.838 -1.073 . . . . 64.24 110.843 -175.541 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.575 HD11 ' HE ' ' A' ' 13' ' ' ARG . 43.0 mt -72.24 -31.94 66.25 Favored 'General case' 0 N--CA 1.477 0.912 0 CA-C-O 118.874 -0.584 . . . . 71.01 112.025 -178.094 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 83.0 p -70.71 -39.45 73.41 Favored 'General case' 0 N--CA 1.486 1.34 0 CA-C-N 118.406 0.548 . . . . 73.1 110.284 175.944 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 19.4 tp60 -57.89 -43.6 86.22 Favored 'General case' 0 C--O 1.25 1.083 0 CA-C-N 115.344 -0.844 . . . . 75.35 110.079 172.183 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 49.8 m -60.01 -57.88 10.94 Favored 'General case' 0 C--N 1.353 0.753 0 CA-C-N 114.832 -1.076 . . . . 73.01 109.98 176.772 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 21' ' ' LEU . . . . . 0.539 HD22 ' HG ' ' A' ' 33' ' ' LEU . 65.1 mt -57.64 -33.77 68.64 Favored 'General case' 0 N--CA 1.479 0.989 0 C-N-CA 123.607 0.763 . . . . 63.15 111.241 -175.421 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.65 ' HA ' HD21 ' A' ' 78' ' ' LEU . 64.4 tp -63.34 -61.55 2.27 Favored 'General case' 0 C--O 1.251 1.149 0 O-C-N 123.791 0.682 . . . . 72.31 110.315 177.375 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 23' ' ' GLU . . . . . 0.468 ' O ' ' HG3' ' A' ' 27' ' ' ARG . 94.6 mt-10 -57.81 -48.0 80.99 Favored 'General case' 0 C--N 1.356 0.88 0 O-C-N 124.178 0.924 . . . . 74.52 110.58 -177.392 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 95.7 mt -62.02 -39.44 92.27 Favored 'General case' 0 N--CA 1.476 0.861 0 C-N-CA 124.558 1.143 . . . . 71.55 111.757 -176.605 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 25' ' ' ALA . . . . . 0.433 ' HB2' HD21 ' A' ' 33' ' ' LEU . . . -61.11 -44.36 97.47 Favored 'General case' 0 N--CA 1.484 1.228 0 CA-C-O 121.138 0.494 . . . . 53.23 110.904 175.958 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 81.5 mt-30 -68.03 -32.24 72.47 Favored 'General case' 0 CA--C 1.551 0.997 0 CA-C-N 114.937 -1.029 . . . . 70.24 111.471 177.3 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 27' ' ' ARG . . . . . 0.468 ' HG3' ' O ' ' A' ' 23' ' ' GLU . 89.3 mtt-85 -74.67 -20.06 60.02 Favored 'General case' 0 N--CA 1.486 1.366 0 C-N-CA 123.74 0.816 . . . . 74.11 111.226 178.811 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 94.44 5.68 61.66 Favored Glycine 0 C--N 1.351 1.385 0 O-C-N 123.272 0.358 . . . . 71.22 112.72 -176.237 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 29' ' ' GLU . . . . . 0.419 ' HG2' ' HB2' ' A' ' 27' ' ' ARG . 7.6 mm-40 -83.07 52.79 2.26 Favored 'General case' 0 CA--C 1.549 0.94 0 C-N-CA 124.058 0.943 . . . . 71.03 110.541 178.989 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 30' ' ' TRP . . . . . 0.468 ' O ' ' HG ' ' A' ' 34' ' ' LEU . 94.6 m95 -66.87 -23.81 66.06 Favored 'General case' 0 N--CA 1.473 0.695 0 C-N-CA 123.56 0.744 . . . . 71.43 111.454 -178.936 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 15.2 m-20 -54.22 -46.67 72.57 Favored 'General case' 0 N--CA 1.478 0.928 0 C-N-CA 123.754 0.821 . . . . 74.22 110.078 172.098 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 93.5 mt -63.26 -33.83 76.35 Favored 'General case' 0 C--O 1.215 -0.725 0 CA-C-N 114.905 -1.043 . . . . 75.05 110.81 178.069 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 33' ' ' LEU . . . . . 0.539 ' HG ' HD22 ' A' ' 21' ' ' LEU . 8.1 mp -68.36 -39.89 81.66 Favored 'General case' 0 N--CA 1.488 1.457 0 CA-C-N 118.053 0.388 . . . . 73.31 111.202 174.138 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.468 ' HG ' ' O ' ' A' ' 30' ' ' TRP . 93.8 mt -65.03 -38.37 90.67 Favored 'General case' 0 N--CA 1.487 1.386 0 C-N-CA 123.555 0.742 . . . . 62.51 111.542 -177.681 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 1.7 mp0 -77.22 -56.86 4.2 Favored 'General case' 0 N--CA 1.475 0.809 0 CA-C-N 116.068 -0.514 . . . . 64.53 110.643 176.986 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 82.3 mm-40 -66.81 -14.56 62.8 Favored 'General case' 0 N--CA 1.484 1.227 0 CA-C-O 118.726 -0.654 . . . . 50.15 112.6 -174.956 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 42.9 tt0 -52.79 -57.8 8.99 Favored 'General case' 0 N--CA 1.481 1.115 0 C-N-CA 123.666 0.786 . . . . 74.55 111.308 175.577 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 61.5 t -56.97 -43.88 81.61 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.163 0 C-N-CA 123.515 0.726 . . . . 70.22 111.318 -175.078 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 18.5 p -74.88 -45.49 42.59 Favored 'General case' 0 N--CA 1.477 0.91 0 C-N-CA 123.643 0.777 . . . . 63.14 112.343 -175.255 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 27.0 t80 -62.9 -42.78 99.9 Favored 'General case' 0 N--CA 1.482 1.155 0 C-N-CA 124.02 0.928 . . . . 73.54 110.821 179.963 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 41' ' ' LEU . . . . . 0.682 ' HA ' HG22 ' A' ' 44' ' ' ILE . 88.5 mt -78.47 -31.43 47.88 Favored 'General case' 0 C--O 1.222 -0.378 0 CA-C-N 115.556 -0.747 . . . . 64.33 111.175 -176.444 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 23.4 tm0? -59.59 -43.6 93.63 Favored 'General case' 0 N--CA 1.476 0.864 0 N-CA-C 108.831 -0.803 . . . . 71.15 108.831 170.005 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 43' ' ' SER . . . . . 0.565 ' O ' HG23 ' A' ' 47' ' ' VAL . 61.6 m -60.59 -55.08 37.68 Favored 'General case' 0 C--N 1.353 0.728 0 O-C-N 123.946 0.779 . . . . 72.33 111.106 178.478 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 44' ' ' ILE . . . . . 0.682 HG22 ' HA ' ' A' ' 41' ' ' LEU . 17.2 tt -65.42 -34.51 70.92 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.329 0 C-N-CA 123.019 0.528 . . . . 74.0 111.697 -172.961 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 21.6 mm-40 -61.27 -50.35 73.38 Favored 'General case' 0 C--N 1.356 0.882 0 C-N-CA 123.494 0.718 . . . . 63.35 109.836 172.078 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 46' ' ' THR . . . . . 0.422 ' O ' ' HB2' ' A' ' 50' ' ' LYS . 97.5 m -54.12 -39.02 66.04 Favored 'General case' 0 N--CA 1.481 1.105 0 C-N-CA 124.352 1.061 . . . . 72.31 111.534 177.419 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 47' ' ' VAL . . . . . 0.661 HG21 HD11 ' A' ' 14' ' ' ILE . 84.5 t -68.57 -45.0 82.41 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.969 0 C-N-CA 124.005 0.922 . . . . 75.4 111.447 -178.317 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 48' ' ' MET . . . . . . . . . . . . . 77.5 mtm -67.34 -31.49 71.79 Favored 'General case' 0 N--CA 1.482 1.149 0 O-C-N 123.491 0.494 . . . . 73.55 111.29 178.214 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 48.2 mt-10 -72.2 -31.2 65.67 Favored 'General case' 0 N--CA 1.481 1.086 0 C-N-CA 123.652 0.781 . . . . 60.32 110.975 174.576 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 50' ' ' LYS . . . . . 0.422 ' HB2' ' O ' ' A' ' 46' ' ' THR . 4.6 tppt? -79.5 160.44 26.53 Favored 'General case' 0 N--CA 1.474 0.755 0 C-N-CA 123.151 0.58 . . . . 44.01 111.858 -168.871 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 52.6 tt0 -81.95 124.87 30.13 Favored 'General case' 0 C--O 1.241 0.642 0 CA-C-N 115.165 -0.925 . . . . 64.3 110.814 -176.968 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 52' ' ' THR . . . . . 0.791 HG21 ' HB3' ' A' ' 114' ' ' LEU . 96.7 m -69.93 122.85 87.35 Favored Pre-proline 0 CA--C 1.551 0.984 0 N-CA-C 109.162 -0.681 . . . . 74.03 109.162 166.765 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 53' ' ' PRO . . . . . 0.618 ' HG3' ' HA ' ' A' ' 4' ' ' THR . 72.0 Cg_endo -69.28 156.91 63.23 Favored 'Trans proline' 0 C--N 1.369 1.645 0 C-N-CA 123.002 2.468 . . . . 62.24 112.573 178.458 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 56.7 Cg_endo -70.7 -44.61 1.36 Allowed 'Trans proline' 0 C--N 1.371 1.723 0 C-N-CA 122.526 2.151 . . . . 74.43 111.471 172.194 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . -75.04 68.93 1.94 Allowed Glycine 0 C--N 1.352 1.419 0 N-CA-C 115.048 0.779 . . . . 41.01 115.048 -172.087 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 56' ' ' ILE . . . . . 0.527 HG23 HG22 ' A' ' 60' ' ' ILE . 84.5 mt -110.24 108.46 25.48 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.656 0 N-CA-C 107.579 -1.267 . . . . 72.34 107.579 176.53 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 42.8 p -82.27 -172.45 3.99 Favored 'General case' 0 N--CA 1.483 1.176 0 C-N-CA 123.016 0.526 . . . . 71.33 110.552 -177.625 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 29.8 tpt85 -63.06 -60.33 3.59 Favored 'General case' 0 N--CA 1.475 0.794 0 C-N-CA 123.275 0.63 . . . . 64.14 110.639 -178.771 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 21.0 m -62.4 -33.6 75.09 Favored 'General case' 0 N--CA 1.475 0.798 0 C-N-CA 123.595 0.758 . . . . 51.34 111.731 -178.101 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 60' ' ' ILE . . . . . 0.527 HG22 HG23 ' A' ' 56' ' ' ILE . 74.4 mt -65.07 -43.68 95.85 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.81 0 C-N-CA 122.921 0.488 . . . . 55.42 110.125 175.087 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 60.3 tt0 -64.55 -36.64 84.89 Favored 'General case' 0 N--CA 1.48 1.072 0 C-N-CA 123.322 0.649 . . . . 73.12 111.036 179.196 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 26.5 m-20 -65.64 -46.66 78.36 Favored 'General case' 0 N--CA 1.474 0.731 0 C-N-CA 123.001 0.52 . . . . 75.32 110.853 176.976 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 63' ' ' MET . . . . . . . . . . . . . 73.3 mtm -65.96 -46.67 77.27 Favored 'General case' 0 N--CA 1.476 0.867 0 O-C-N 123.307 0.38 . . . . 72.15 111.014 -179.692 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 64' ' ' VAL . . . . . 0.494 ' O ' HG13 ' A' ' 68' ' ' ILE . 52.0 t -63.78 -60.55 2.58 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.566 0 C-N-CA 123.474 0.709 . . . . 74.41 110.615 -178.535 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 65' ' ' ALA . . . . . 0.571 ' HB2' HD23 ' A' ' 109' ' ' LEU . . . -60.59 -33.11 72.25 Favored 'General case' 0 N--CA 1.487 1.397 0 O-C-N 123.403 0.44 . . . . 62.53 111.519 -179.896 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -65.03 -38.04 94.95 Favored Glycine 0 C--N 1.347 1.146 0 CA-C-N 116.3 -0.409 . . . . 63.44 112.316 175.743 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 67' ' ' TYR . . . . . 0.5 ' O ' HG22 ' A' ' 71' ' ' THR . 17.4 m-30 -74.72 -33.55 62.4 Favored 'General case' 0 N--CA 1.473 0.679 0 C-N-CA 123.218 0.607 . . . . 53.4 111.238 177.563 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 68' ' ' ILE . . . . . 0.494 HG13 ' O ' ' A' ' 64' ' ' VAL . 59.8 mt -63.68 -49.06 83.83 Favored 'Isoleucine or valine' 0 C--N 1.36 1.052 0 N-CA-C 108.663 -0.866 . . . . 71.41 108.663 175.63 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 69' ' ' LYS . . . . . 0.51 ' HB2' ' HE2' ' A' ' 106' ' ' TYR . 44.0 tptt -56.33 -44.65 80.21 Favored 'General case' 0 C--N 1.349 0.555 0 C-N-CA 123.572 0.749 . . . . 74.11 110.901 174.64 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 70' ' ' GLN . . . . . 0.431 ' OE1' ' HB1' ' A' ' 15' ' ' ALA . 63.4 tt0 -61.47 -45.72 93.06 Favored 'General case' 0 C--N 1.349 0.549 0 O-C-N 123.679 0.612 . . . . 71.02 111.077 -177.49 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 71' ' ' THR . . . . . 0.5 HG22 ' O ' ' A' ' 67' ' ' TYR . 3.0 t -74.7 -39.73 61.78 Favored 'General case' 0 C--N 1.355 0.824 0 CA-C-O 119.646 -0.216 . . . . 75.52 111.12 -175.185 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 72' ' ' LEU . . . . . 0.487 HD21 ' HB2' ' A' ' 102' ' ' LEU . 44.2 mt -64.85 -39.0 92.85 Favored 'General case' 0 N--CA 1.472 0.67 0 C-N-CA 122.11 0.164 . . . . 75.31 111.069 178.578 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 73' ' ' ASP . . . . . 0.444 ' O ' ' HG ' ' A' ' 77' ' ' LEU . 14.2 t70 -65.71 -59.63 3.72 Favored 'General case' 0 CA--C 1.543 0.686 0 O-C-N 123.994 0.809 . . . . 70.42 109.677 -178.702 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 84.1 m-20 -59.52 -45.22 92.38 Favored 'General case' 0 N--CA 1.485 1.317 0 C-N-CA 124.036 0.934 . . . . 55.11 111.778 -176.2 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 3.3 tm-20 -75.05 -29.86 60.85 Favored 'General case' 0 CA--C 1.555 1.166 0 CA-C-N 115.661 -0.7 . . . . 73.24 110.413 -174.477 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 9.4 tt0 -75.27 -29.62 60.21 Favored 'General case' 0 N--CA 1.488 1.458 0 O-C-N 122.056 -0.403 . . . . 75.33 110.746 175.076 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 77' ' ' LEU . . . . . 0.444 ' HG ' ' O ' ' A' ' 73' ' ' ASP . 93.2 mt -65.43 -39.99 92.77 Favored 'General case' 0 N--CA 1.48 1.07 0 N-CA-C 109.428 -0.582 . . . . 61.01 109.428 172.475 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 78' ' ' LEU . . . . . 0.65 HD21 ' HA ' ' A' ' 22' ' ' LEU . 72.7 mt -58.23 -47.67 82.81 Favored 'General case' 0 N--CA 1.477 0.889 0 CA-C-N 115.378 -0.828 . . . . 74.32 111.246 170.476 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 79' ' ' LYS . . . . . 0.477 ' HB3' ' HA ' ' A' ' 85' ' ' ARG . 25.9 mmtp -66.92 -28.56 68.4 Favored 'General case' 0 N--CA 1.475 0.81 0 C-N-CA 123.161 0.584 . . . . 62.24 112.463 -177.991 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -72.26 -33.99 61.38 Favored Glycine 0 C--N 1.347 1.175 0 N-CA-C 111.572 -0.611 . . . . 54.02 111.572 171.259 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 7.1 tt -73.61 -36.11 65.45 Favored 'General case' 0 CA--C 1.554 1.125 0 C-N-CA 124.224 1.009 . . . . 41.3 110.266 177.762 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 82' ' ' LEU . . . . . 0.411 ' HG ' ' O ' ' A' ' 78' ' ' LEU . 95.1 mt -77.84 -69.54 0.54 Allowed 'General case' 0 C--N 1.357 0.929 0 C-N-CA 123.078 0.551 . . . . 73.32 111.258 -171.973 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 78.6 mm-40 -159.92 -55.55 0.06 Allowed 'General case' 0 N--CA 1.487 1.404 0 C-N-CA 123.328 0.651 . . . . 64.44 110.05 -173.388 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 6.2 tp-100 -155.75 150.6 26.35 Favored 'General case' 0 N--CA 1.484 1.259 0 C-N-CA 122.913 0.485 . . . . 74.13 110.283 -171.432 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 85' ' ' ARG . . . . . 0.477 ' HA ' ' HB3' ' A' ' 79' ' ' LYS . 38.7 mtp180 -70.17 -49.67 48.06 Favored 'General case' 0 N--CA 1.487 1.392 0 C-N-CA 124.742 1.217 . . . . 62.52 112.786 -169.615 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 76.7 mt -88.76 -2.15 58.44 Favored 'General case' 0 N--CA 1.482 1.16 0 C-N-CA 123.194 0.597 . . . . 75.24 112.041 178.533 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 24.2 t70 -80.66 88.39 5.74 Favored 'General case' 0 N--CA 1.476 0.839 0 N-CA-C 108.427 -0.953 . . . . 65.21 108.427 172.964 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 88' ' ' GLU . . . . . 0.448 ' HB3' HD12 ' A' ' 92' ' ' LEU . 29.6 mm-40 -75.91 168.81 19.35 Favored 'General case' 0 CA--C 1.546 0.809 0 CA-C-N 114.968 -1.014 . . . . 73.02 112.143 -170.529 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 89' ' ' LEU . . . . . 0.446 ' HB2' HD11 ' A' ' 41' ' ' LEU . 95.4 mt -72.76 -176.0 1.87 Allowed 'General case' 0 CA--C 1.557 1.227 0 C-N-CA 123.91 0.884 . . . . 51.32 111.597 179.883 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 7.9 m -69.53 143.28 53.46 Favored 'General case' 0 N--CA 1.479 1.004 0 C-N-CA 123.771 0.828 . . . . 74.25 111.872 -175.162 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 11.2 t 68.38 30.98 5.21 Favored 'General case' 0 CA--C 1.559 1.31 0 C-N-CA 124.331 1.053 . . . . 71.51 111.609 173.24 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 92' ' ' LEU . . . . . 0.491 HD11 HD22 ' A' ' 41' ' ' LEU . 64.4 mt -108.22 165.68 11.31 Favored 'General case' 0 N--CA 1.49 1.536 0 C-N-CA 123.618 0.767 . . . . 73.12 110.324 171.763 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 59.0 mt -62.03 92.16 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.482 1.14 0 C-N-CA 124.365 1.066 . . . . 63.21 111.877 -172.954 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 60.78 30.57 73.05 Favored Glycine 0 C--N 1.353 1.499 0 CA-C-N 115.769 -0.651 . . . . 63.24 113.506 178.83 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 21.0 pt20 42.18 36.39 0.7 Allowed 'General case' 0 N--CA 1.497 1.918 0 C-N-CA 126.297 1.839 . . . . 73.14 112.849 -172.392 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 72.7 m -155.0 -168.48 2.89 Favored 'General case' 0 N--CA 1.48 1.051 0 C-N-CA 125.719 1.608 . . . . 73.11 107.873 178.138 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 54.0 m 76.83 -42.53 0.42 Allowed 'General case' 0 N--CA 1.49 1.564 0 C-N-CA 124.678 1.191 . . . . 73.31 113.473 170.159 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 1.1 tmm_? -50.81 -51.24 52.77 Favored 'General case' 0 N--CA 1.482 1.135 0 C-N-CA 125.301 1.44 . . . . 75.13 111.522 -170.291 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 30.8 tt0 -61.61 -45.82 92.44 Favored 'General case' 0 C--N 1.355 0.831 0 O-C-N 123.496 0.497 . . . . 71.21 109.975 -175.781 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 64.4 tttp -68.29 -29.26 67.99 Favored 'General case' 0 N--CA 1.482 1.162 0 O-C-N 124.098 0.874 . . . . 71.04 111.737 179.542 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 35.1 t -72.79 -41.29 65.14 Favored 'General case' 0 N--CA 1.478 0.957 0 C-N-CA 123.361 0.665 . . . . 44.43 110.282 -177.551 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 102' ' ' LEU . . . . . 0.487 ' HB2' HD21 ' A' ' 72' ' ' LEU . 9.2 mp -79.36 -23.73 43.16 Favored 'General case' 0 N--CA 1.476 0.841 0 CA-C-N 116.07 -0.514 . . . . 61.25 110.934 174.97 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -72.46 -34.15 67.52 Favored 'General case' 0 N--CA 1.482 1.175 0 N-CA-C 108.602 -0.888 . . . . 72.15 108.602 174.476 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 9.6 t30 -71.65 -37.34 70.83 Favored 'General case' 0 N--CA 1.474 0.753 0 CA-C-N 115.213 -0.903 . . . . 73.11 109.226 174.037 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 105' ' ' ALA . . . . . 0.454 ' O ' ' HG ' ' A' ' 114' ' ' LEU . . . -61.1 -48.96 79.25 Favored 'General case' 0 CA--C 1.538 0.502 0 O-C-N 123.733 0.646 . . . . 75.24 110.315 175.504 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 106' ' ' TYR . . . . . 0.51 ' HE2' ' HB2' ' A' ' 69' ' ' LYS . 7.8 t80 -61.14 -51.9 67.14 Favored 'General case' 0 CA--C 1.541 0.611 0 CA-C-N 116.008 -0.542 . . . . 73.34 109.733 179.564 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -63.37 -44.48 96.78 Favored Glycine 0 C--N 1.354 1.581 0 O-C-N 124.212 0.945 . . . . 74.35 113.19 -173.815 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 5.8 tpm_? -69.13 -34.29 74.79 Favored 'General case' 0 C--N 1.348 0.522 0 C-N-CA 122.996 0.518 . . . . 72.33 109.909 179.935 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 109' ' ' LEU . . . . . 0.571 HD23 ' HB2' ' A' ' 65' ' ' ALA . 54.9 tp -65.91 -45.76 80.75 Favored 'General case' 0 N--CA 1.488 1.426 0 C-N-CA 123.055 0.542 . . . . 62.2 110.616 176.072 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 42.4 t -59.59 -48.58 81.11 Favored 'General case' 0 CA--C 1.531 0.249 0 O-C-N 124.738 1.274 . . . . 73.12 110.551 -176.471 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . -85.4 -59.32 1.94 Allowed Glycine 0 C--N 1.356 1.646 0 CA-C-O 119.299 -0.723 . . . . 65.52 112.957 -178.463 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 112' ' ' MET . . . . . . . . . . . . . 8.0 tpt -93.07 -70.4 0.7 Allowed 'General case' 0 N--CA 1.489 1.479 0 CA-C-N 118.216 1.008 . . . . 75.52 113.143 -178.011 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 113' ' ' LEU . . . . . 0.521 ' HB3' HG22 ' A' ' 115' ' ' VAL . 15.1 tp 168.36 13.9 0.0 OUTLIER 'General case' 0 N--CA 1.507 2.379 0 C-N-CA 123.575 0.75 . . . . 74.44 112.267 -173.498 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 114' ' ' LEU . . . . . 0.791 ' HB3' HG21 ' A' ' 52' ' ' THR . 0.9 OUTLIER 72.78 10.05 5.51 Favored 'General case' 0 N--CA 1.502 2.138 0 C-N-CA 125.089 1.356 . . . . 72.32 109.98 -176.153 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 115' ' ' VAL . . . . . 0.521 HG22 ' HB3' ' A' ' 113' ' ' LEU . 35.3 m -105.71 130.16 23.49 Favored Pre-proline 0 CA--C 1.551 1.011 0 N-CA-C 107.933 -1.136 . . . . 74.21 107.933 173.912 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 86.7 Cg_endo -76.72 -178.08 4.25 Favored 'Trans proline' 0 C--N 1.372 1.782 0 C-N-CA 122.437 2.091 . . . . 73.12 112.208 -178.136 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 24.3 t70 77.31 -31.2 0.17 Allowed 'General case' 0 N--CA 1.49 1.539 0 C-N-CA 125.269 1.428 . . . . 63.24 112.676 174.461 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -104.48 135.66 19.29 Favored Pre-proline 0 N--CA 1.475 0.81 0 C-N-CA 123.709 0.803 . . . . 73.34 110.506 -179.991 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 119' ' ' PRO . . . . . . . . . . . . . 56.3 Cg_endo -88.8 157.7 6.11 Favored 'Trans proline' 0 C--N 1.372 1.77 0 C-N-CA 122.692 2.261 . . . . 71.14 111.76 172.216 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . -116.03 175.27 15.74 Favored Glycine 0 C--N 1.343 0.965 0 CA-C-N 116.246 -0.434 . . . . 45.23 112.727 178.162 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . -70.5 132.53 45.68 Favored 'General case' 0 N--CA 1.476 0.868 0 C-N-CA 123.384 0.674 . . . . 54.4 110.652 -179.228 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 122' ' ' SER . . . . . . . . . . . . . 35.8 p . . . . . 0 C--O 1.251 1.14 0 C-N-CA 124.01 0.924 . . . . 72.31 109.382 -175.836 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 1' ' ' MET . . . . . 0.435 ' O ' HG23 ' A' ' 5' ' ' VAL . 16.5 tpt . . . . . 0 N--CA 1.487 1.376 0 CA-C-O 119.325 -0.369 . . . . 70.34 111.383 . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 30.5 p -55.63 -51.36 67.45 Favored 'General case' 0 N--CA 1.489 1.488 0 C-N-CA 123.224 0.61 . . . . 54.1 112.229 -176.647 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 35.6 m -64.55 -29.58 70.61 Favored 'General case' 0 CA--C 1.541 0.601 0 CA-C-N 115.551 -0.749 . . . . 72.5 111.14 178.576 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 4' ' ' THR . . . . . 0.503 ' HA ' ' HG3' ' A' ' 53' ' ' PRO . 4.5 m -74.13 -33.3 63.5 Favored 'General case' 0 N--CA 1.473 0.688 0 C-N-CA 123.36 0.664 . . . . 70.13 110.976 178.845 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 5' ' ' VAL . . . . . 0.435 HG23 ' O ' ' A' ' 1' ' ' MET . 89.5 t -69.39 -45.64 78.33 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.793 0 N-CA-C 109.273 -0.64 . . . . 71.53 109.273 177.045 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 25.1 mm-40 -55.07 -47.76 74.43 Favored 'General case' 0 N--CA 1.478 0.961 0 O-C-N 123.627 0.579 . . . . 73.31 110.831 172.789 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 7' ' ' PHE . . . . . 0.672 ' HZ ' HD11 ' A' ' 109' ' ' LEU . 72.8 t80 -55.38 -61.8 2.09 Favored 'General case' 0 CA--C 1.558 1.275 0 C-N-CA 124.621 1.168 . . . . 73.11 111.922 -178.573 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 8' ' ' ILE . . . . . 0.411 ' O ' ' HG3' ' A' ' 12' ' ' GLN . 65.2 mt -57.77 -48.79 82.8 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.08 0 C-N-CA 123.473 0.709 . . . . 63.35 110.615 -178.905 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 66.0 t30 -65.32 -37.82 88.28 Favored 'General case' 0 N--CA 1.473 0.679 0 O-C-N 124.067 0.855 . . . . 71.24 111.818 -171.329 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 56.3 mtt180 -69.67 -38.59 77.11 Favored 'General case' 0 CA--C 1.543 0.677 0 CA-C-N 116.151 -0.477 . . . . 75.12 110.343 176.674 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 11' ' ' TRP . . . . . . . . . . . . . 80.0 m95 -68.82 -27.92 66.28 Favored 'General case' 0 N--CA 1.488 1.44 0 N-CA-C 112.054 0.39 . . . . 63.24 112.054 174.419 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 12' ' ' GLN . . . . . 0.411 ' HG3' ' O ' ' A' ' 8' ' ' ILE . 56.1 mt-30 -64.12 -47.69 79.0 Favored 'General case' 0 N--CA 1.478 0.945 0 N-CA-C 109.083 -0.71 . . . . 52.14 109.083 172.581 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 15.7 tpt180 -54.24 -49.75 68.77 Favored 'General case' 0 CA--C 1.548 0.875 0 C-N-CA 124.036 0.934 . . . . 73.12 110.889 177.735 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 14' ' ' ILE . . . . . 0.487 HD11 HG21 ' A' ' 47' ' ' VAL . 96.9 mt -59.95 -52.56 59.7 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.894 0 C-N-CA 124.236 1.015 . . . . 74.14 111.582 -178.104 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -60.06 -45.2 93.64 Favored 'General case' 0 N--CA 1.474 0.746 0 C-N-CA 123.599 0.759 . . . . 72.05 112.037 -176.55 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 96.1 mt -69.27 -40.8 77.56 Favored 'General case' 0 N--CA 1.475 0.804 0 CA-C-N 114.956 -1.02 . . . . 55.25 111.107 -177.517 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.51 ' O ' ' HG ' ' A' ' 21' ' ' LEU . 43.1 mt -62.19 -51.92 65.87 Favored 'General case' 0 N--CA 1.478 0.927 0 C-N-CA 122.798 0.439 . . . . 63.03 110.485 177.894 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 77.8 p -61.94 -40.41 95.43 Favored 'General case' 0 N--CA 1.475 0.817 0 C-N-CA 123.275 0.63 . . . . 71.01 111.501 -176.676 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 6.6 tp-100 -63.75 -42.24 97.87 Favored 'General case' 0 C--N 1.36 1.034 0 O-C-N 123.294 0.371 . . . . 61.14 110.428 176.694 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 65.5 m -60.52 -45.45 93.79 Favored 'General case' 0 CA--C 1.538 0.498 0 O-C-N 123.468 0.48 . . . . 52.04 110.712 176.248 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 21' ' ' LEU . . . . . 0.668 HD22 ' HA ' ' A' ' 33' ' ' LEU . 69.6 mt -63.29 -33.54 75.73 Favored 'General case' 0 N--CA 1.476 0.839 0 C-N-CA 123.347 0.659 . . . . 75.2 110.696 -179.092 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.661 ' HA ' HD21 ' A' ' 78' ' ' LEU . 57.9 tp -67.56 -53.34 29.2 Favored 'General case' 0 CA--C 1.544 0.724 0 C-N-CA 123.183 0.593 . . . . 62.42 110.677 178.036 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 23' ' ' GLU . . . . . 0.413 ' O ' ' HG3' ' A' ' 27' ' ' ARG . 37.3 mt-10 -56.23 -47.87 77.62 Favored 'General case' 0 N--CA 1.481 1.093 0 C-N-CA 123.874 0.87 . . . . 54.12 110.556 179.035 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.496 HD22 HD12 ' A' ' 32' ' ' LEU . 87.6 mt -66.02 -35.34 80.3 Favored 'General case' 0 C--O 1.217 -0.653 0 CA-C-N 114.961 -1.018 . . . . 55.05 110.996 -177.138 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 25' ' ' ALA . . . . . 0.521 ' HB2' HD21 ' A' ' 33' ' ' LEU . . . -65.04 -38.97 92.61 Favored 'General case' 0 N--CA 1.482 1.154 0 CA-C-O 121.019 0.438 . . . . 63.31 111.27 175.397 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 96.7 mt-30 -70.94 -27.72 63.97 Favored 'General case' 0 N--CA 1.48 1.041 0 CA-C-N 115.323 -0.853 . . . . 75.1 111.333 177.456 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 27' ' ' ARG . . . . . 0.454 ' HD2' HD23 ' A' ' 24' ' ' LEU . 96.9 mtt180 -78.07 -26.85 48.43 Favored 'General case' 0 N--CA 1.478 0.97 0 C-N-CA 123.385 0.674 . . . . 64.23 110.469 172.469 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 95.54 13.95 49.17 Favored Glycine 0 C--N 1.346 1.121 0 CA-C-N 115.992 -0.549 . . . . 70.12 113.37 -177.534 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 29' ' ' GLU . . . . . 0.431 ' HG2' ' HB2' ' A' ' 27' ' ' ARG . 8.7 mm-40 -84.88 59.38 5.55 Favored 'General case' 0 CA--C 1.553 1.076 0 C-N-CA 123.961 0.904 . . . . 70.53 110.326 176.713 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 30' ' ' TRP . . . . . . . . . . . . . 95.2 m95 -65.4 -22.3 66.77 Favored 'General case' 0 N--CA 1.485 1.302 0 C-N-CA 123.875 0.87 . . . . 74.54 111.714 -177.734 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 11.9 m-20 -53.56 -53.27 54.13 Favored 'General case' 0 C--N 1.35 0.62 0 O-C-N 123.753 0.658 . . . . 60.23 109.919 171.354 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.496 HD12 HD22 ' A' ' 24' ' ' LEU . 78.5 mt -63.19 -27.25 69.24 Favored 'General case' 0 N--CA 1.475 0.788 0 O-C-N 124.082 0.864 . . . . 73.53 111.444 -175.198 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 33' ' ' LEU . . . . . 0.668 ' HA ' HD22 ' A' ' 21' ' ' LEU . 9.0 mp -69.2 -54.92 12.33 Favored 'General case' 0 N--CA 1.479 0.988 0 C-N-CA 122.551 0.34 . . . . 65.24 110.421 174.253 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 91.0 mt -63.96 -29.03 70.23 Favored 'General case' 0 N--CA 1.484 1.255 0 O-C-N 123.814 0.696 . . . . 45.11 112.017 -176.344 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 94.1 mt-30 -71.67 -43.32 66.24 Favored 'General case' 0 N--CA 1.476 0.87 0 C-N-CA 123.374 0.669 . . . . 72.34 110.7 176.889 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 81.9 mm-40 -85.56 -14.47 45.7 Favored 'General case' 0 N--CA 1.481 1.095 0 C-N-CA 123.166 0.586 . . . . 71.4 112.369 -178.219 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 41.2 tt0 -51.81 -55.79 17.82 Favored 'General case' 0 N--CA 1.479 1.004 0 C-N-CA 125.069 1.348 . . . . 72.34 112.54 -173.621 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 63.9 t -62.77 -44.61 99.63 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.895 0 C-N-CA 122.754 0.421 . . . . 54.2 111.101 -175.407 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 65.3 m -65.43 -38.62 90.45 Favored 'General case' 0 N--CA 1.481 1.086 0 C-N-CA 123.021 0.528 . . . . 63.13 111.029 -178.908 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 46.1 t80 -66.73 -54.46 22.66 Favored 'General case' 0 CA--C 1.539 0.554 0 CA-C-N 115.262 -0.881 . . . . 74.03 110.761 -178.924 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 41' ' ' LEU . . . . . 0.489 HD22 HD21 ' A' ' 92' ' ' LEU . 75.3 mt -62.11 -38.71 89.95 Favored 'General case' 0 N--CA 1.477 0.88 0 O-C-N 123.746 0.654 . . . . 72.34 110.375 -177.641 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 54.0 tt0 -53.53 -57.23 11.44 Favored 'General case' 0 C--O 1.247 0.925 0 C-N-CA 124.253 1.021 . . . . 63.41 110.329 174.682 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 43' ' ' SER . . . . . 0.537 ' O ' HG23 ' A' ' 47' ' ' VAL . 51.6 m -54.02 -60.65 3.05 Favored 'General case' 0 CA--C 1.544 0.713 0 O-C-N 124.56 1.163 . . . . 73.4 111.397 179.496 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 44' ' ' ILE . . . . . 0.463 HG13 HD13 ' A' ' 14' ' ' ILE . 19.0 tt -60.15 -40.82 84.6 Favored 'Isoleucine or valine' 0 C--O 1.257 1.493 0 C-N-CA 123.677 0.791 . . . . 62.21 112.974 -168.586 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 45' ' ' GLU . . . . . 0.438 ' HG2' ' O ' ' A' ' 41' ' ' LEU . 23.1 mm-40 -67.99 -45.55 73.79 Favored 'General case' 0 C--N 1.348 0.538 0 CA-C-N 116.521 -0.309 . . . . 75.22 110.189 178.036 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 41.4 m -62.25 -26.36 68.34 Favored 'General case' 0 CA--C 1.56 1.349 0 O-C-N 123.38 0.425 . . . . 42.32 112.031 178.66 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 47' ' ' VAL . . . . . 0.537 HG23 ' O ' ' A' ' 43' ' ' SER . 59.3 t -72.12 -46.57 58.06 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.434 0 C-N-CA 122.718 0.407 . . . . 72.1 110.502 175.933 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 48' ' ' MET . . . . . . . . . . . . . 71.6 mtm -67.74 -26.43 66.13 Favored 'General case' 0 N--CA 1.488 1.43 0 N-CA-C 111.77 0.285 . . . . 72.03 111.77 178.822 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 42.8 mt-10 -81.53 -20.6 39.69 Favored 'General case' 0 N--CA 1.479 0.987 0 C-N-CA 123.69 0.796 . . . . 70.14 111.192 175.451 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -75.8 136.44 40.24 Favored 'General case' 0 C--O 1.244 0.781 0 N-CA-C 109.291 -0.633 . . . . 72.34 109.291 -179.706 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 7.2 tt0 -61.86 113.85 3.01 Favored 'General case' 0 C--O 1.241 0.656 0 O-C-N 123.448 0.467 . . . . 64.15 110.007 178.73 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 52' ' ' THR . . . . . 0.441 HG21 ' O ' ' A' ' 114' ' ' LEU . 89.3 m -65.26 128.47 93.82 Favored Pre-proline 0 CA--C 1.553 1.064 0 CA-C-N 115.769 -0.65 . . . . 74.22 109.71 173.883 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 53' ' ' PRO . . . . . 0.503 ' HG3' ' HA ' ' A' ' 4' ' ' THR . 29.3 Cg_endo -60.27 153.52 58.86 Favored 'Trans proline' 0 C--N 1.375 1.948 0 C-N-CA 122.915 2.41 . . . . 62.21 112.608 178.93 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 54' ' ' PRO . . . . . 0.468 ' HD3' ' HA ' ' A' ' 53' ' ' PRO . 5.0 Cg_exo -81.63 -49.16 0.05 OUTLIER 'Trans proline' 0 C--N 1.369 1.627 0 C-N-CA 123.117 2.544 . . . . 71.24 112.973 179.479 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . -78.53 80.9 1.39 Allowed Glycine 0 C--N 1.348 1.22 0 CA-C-N 116.498 -0.319 . . . . 73.2 112.509 -175.208 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 56' ' ' ILE . . . . . 0.629 HG21 HD22 ' A' ' 114' ' ' LEU . 74.2 mt -121.83 144.0 32.51 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.786 0 C-N-CA 123.977 0.911 . . . . 71.03 109.428 -179.039 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 57' ' ' THR . . . . . 0.411 ' H ' HD12 ' A' ' 60' ' ' ILE . 66.0 p -99.88 170.25 8.65 Favored 'General case' 0 N--CA 1.479 1.014 0 C-N-CA 123.554 0.742 . . . . 72.21 111.005 177.466 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 13.3 tpt180 -64.65 -35.42 80.97 Favored 'General case' 0 C--N 1.357 0.897 0 C-N-CA 123.208 0.603 . . . . 64.21 111.439 178.164 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 20.4 m -59.9 -41.81 92.48 Favored 'General case' 0 N--CA 1.482 1.138 0 CA-C-O 121.175 0.512 . . . . 74.53 110.768 178.518 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 60' ' ' ILE . . . . . 0.411 HD12 ' H ' ' A' ' 57' ' ' THR . 83.3 mt -66.93 -39.26 83.1 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.603 0 CA-C-N 114.996 -1.002 . . . . 75.14 110.03 176.109 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 61' ' ' GLN . . . . . 0.539 HE21 ' HA ' ' A' ' 110' ' ' SER . 52.3 tt0 -60.89 -35.72 77.36 Favored 'General case' 0 N--CA 1.481 1.076 0 C-N-CA 123.727 0.811 . . . . 60.44 111.16 176.876 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 57.8 m-20 -73.84 -45.42 51.33 Favored 'General case' 0 N--CA 1.478 0.958 0 C-N-CA 123.073 0.549 . . . . 74.21 111.468 -179.57 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 63' ' ' MET . . . . . . . . . . . . . 67.1 mtm -66.05 -51.36 58.95 Favored 'General case' 0 N--CA 1.481 1.119 0 C-N-CA 122.708 0.403 . . . . 74.35 110.889 -179.888 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 64' ' ' VAL . . . . . 0.429 ' O ' HG13 ' A' ' 68' ' ' ILE . 77.3 t -63.13 -59.56 4.17 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.538 0 C-N-CA 123.356 0.662 . . . . 72.34 111.364 -179.871 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 65' ' ' ALA . . . . . 0.54 ' HB2' HD23 ' A' ' 109' ' ' LEU . . . -69.14 -22.47 63.94 Favored 'General case' 0 N--CA 1.485 1.313 0 CA-C-N 118.491 0.587 . . . . 74.24 111.326 -176.606 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -67.42 -38.98 91.45 Favored Glycine 0 C--N 1.348 1.195 0 N-CA-C 111.886 -0.485 . . . . 74.24 111.886 170.752 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 67' ' ' TYR . . . . . 0.417 ' O ' HG22 ' A' ' 71' ' ' THR . 1.8 m-30 -74.92 -32.32 61.75 Favored 'General case' 0 C--O 1.241 0.636 0 C-N-CA 123.405 0.682 . . . . 65.31 112.034 175.603 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 68' ' ' ILE . . . . . 0.535 HD12 HD22 ' A' ' 109' ' ' LEU . 19.5 mt -68.53 -38.79 79.65 Favored 'Isoleucine or valine' 0 C--N 1.357 0.894 0 N-CA-C 108.495 -0.928 . . . . 73.13 108.495 175.03 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 12.3 tmtt? -57.73 -48.81 78.55 Favored 'General case' 0 N--CA 1.48 1.034 0 C-N-CA 123.767 0.827 . . . . 73.42 108.791 175.63 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 70' ' ' GLN . . . . . 0.5 ' HG2' HD21 ' A' ' 74' ' ' ASN . 64.6 tt0 -53.58 -49.91 66.71 Favored 'General case' 0 CA--C 1.544 0.734 0 O-C-N 124.522 1.139 . . . . 64.24 110.718 178.652 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 71' ' ' THR . . . . . 0.417 HG22 ' O ' ' A' ' 67' ' ' TYR . 2.9 t -75.12 -21.56 58.78 Favored 'General case' 0 C--N 1.358 0.959 0 CA-C-O 119.293 -0.384 . . . . 63.32 111.925 -178.542 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 72' ' ' LEU . . . . . 0.486 ' HG ' ' O ' ' A' ' 68' ' ' ILE . 25.4 mt -61.36 -52.43 64.67 Favored 'General case' 0 N--CA 1.487 1.406 0 N-CA-C 108.852 -0.796 . . . . 62.22 108.852 173.064 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 5.3 m-20 -61.66 -57.39 12.19 Favored 'General case' 0 N--CA 1.475 0.785 0 O-C-N 124.064 0.853 . . . . 71.21 110.846 178.675 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 74' ' ' ASN . . . . . 0.5 HD21 ' HG2' ' A' ' 70' ' ' GLN . 79.9 m-20 -51.87 -54.43 29.27 Favored 'General case' 0 N--CA 1.484 1.247 0 C-N-CA 124.177 0.991 . . . . 73.33 111.434 -174.403 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 75' ' ' GLU . . . . . 0.599 ' O ' ' HG2' ' A' ' 79' ' ' LYS . 10.4 mm-40 -60.26 -57.16 13.98 Favored 'General case' 0 C--O 1.221 -0.427 0 CA-C-N 115.268 -0.878 . . . . 65.5 111.295 179.224 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 9.3 tt0 -62.61 -29.64 70.75 Favored 'General case' 0 N--CA 1.484 1.247 0 O-C-N 123.67 0.606 . . . . 65.51 112.182 -172.014 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 77.2 mt -72.23 -40.89 67.41 Favored 'General case' 0 N--CA 1.473 0.711 0 C-N-CA 123.613 0.765 . . . . 72.23 110.042 175.604 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 78' ' ' LEU . . . . . 0.661 HD21 ' HA ' ' A' ' 22' ' ' LEU . 71.9 mt -61.94 -36.9 82.78 Favored 'General case' 0 N--CA 1.488 1.435 0 C-N-CA 123.135 0.574 . . . . 63.53 111.559 173.158 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 79' ' ' LYS . . . . . 0.625 ' HD2' ' HA ' ' A' ' 88' ' ' GLU . 33.7 mmtm -69.21 -47.64 64.26 Favored 'General case' 0 N--CA 1.473 0.723 0 N-CA-C 109.18 -0.674 . . . . 72.41 109.18 -177.634 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -64.68 -29.09 74.28 Favored Glycine 0 C--N 1.35 1.315 0 CA-C-N 115.283 -0.872 . . . . 51.14 112.731 175.782 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 2.6 tt -69.82 -40.39 75.95 Favored 'General case' 0 CA--C 1.547 0.854 0 C-N-CA 123.724 0.81 . . . . 73.44 109.321 177.418 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 93.1 mt -70.75 -64.77 0.84 Allowed 'General case' 0 C--N 1.352 0.699 0 N-CA-C 109.468 -0.567 . . . . 74.32 109.468 179.196 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 16.6 mm100 -142.09 -72.85 0.32 Allowed 'General case' 0 CA--C 1.548 0.876 0 C-N-CA 123.905 0.882 . . . . 75.1 109.509 -179.792 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 80.7 mt-30 -138.32 160.1 40.35 Favored 'General case' 0 N--CA 1.488 1.466 0 C-N-CA 123.886 0.874 . . . . 73.32 109.725 -171.257 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 85' ' ' ARG . . . . . . . . . . . . . 16.5 ptm180 -62.68 -14.91 49.3 Favored 'General case' 0 N--CA 1.491 1.59 0 N-CA-C 113.339 0.866 . . . . 62.24 113.339 -172.276 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 84.8 mt -107.92 -12.76 15.11 Favored 'General case' 0 N--CA 1.484 1.237 0 C-N-CA 123.215 0.606 . . . . 64.33 112.524 177.145 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 19.2 t70 -67.78 97.74 0.66 Allowed 'General case' 0 N--CA 1.489 1.479 0 C-N-CA 123.553 0.741 . . . . 73.32 109.445 179.322 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 88' ' ' GLU . . . . . 0.625 ' HA ' ' HD2' ' A' ' 79' ' ' LYS . 50.4 mt-10 -68.16 159.28 31.35 Favored 'General case' 0 N--CA 1.476 0.846 0 C-N-CA 124.135 0.974 . . . . 64.14 112.184 -170.227 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 83.6 mt -55.85 -45.87 78.35 Favored 'General case' 0 N--CA 1.484 1.233 0 N-CA-C 108.862 -0.792 . . . . 71.33 108.862 173.046 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 46.8 t -154.96 146.33 22.99 Favored 'General case' 0 C--O 1.248 0.978 0 CA-C-N 113.869 -1.514 . . . . 70.24 107.287 169.1 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 52.6 m -61.04 111.18 1.58 Allowed 'General case' 0 N--CA 1.48 1.072 0 C-N-CA 123.204 0.602 . . . . 63.1 111.75 -173.248 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 92' ' ' LEU . . . . . 0.489 HD21 HD22 ' A' ' 41' ' ' LEU . 81.0 mt -59.1 -66.01 0.57 Allowed 'General case' 0 N--CA 1.481 1.087 0 C-N-CA 124.104 0.962 . . . . 71.01 111.112 -174.381 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 59.5 mt -98.42 -34.23 4.49 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.884 0 C-N-CA 123.52 0.728 . . . . 74.42 109.444 175.239 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 140.31 -28.0 2.49 Favored Glycine 0 C--N 1.337 0.627 0 N-CA-C 110.281 -1.127 . . . . 74.23 110.281 -173.309 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 21.6 mp0 -98.74 146.84 25.48 Favored 'General case' 0 C--O 1.245 0.85 0 N-CA-C 107.649 -1.241 . . . . 75.53 107.649 173.765 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 52.8 p -72.08 83.08 0.98 Allowed 'General case' 0 CA--C 1.545 0.753 0 CA-C-O 121.804 0.811 . . . . 62.33 110.249 179.516 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 7.1 t -107.17 3.46 25.69 Favored 'General case' 0 CA--C 1.541 0.621 0 CA-C-N 115.058 -0.974 . . . . 70.54 111.425 -171.078 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 98' ' ' ARG . . . . . 0.467 ' HG2' HD11 ' A' ' 92' ' ' LEU . 0.0 OUTLIER -59.93 -61.97 2.22 Favored 'General case' 0 N--CA 1.482 1.131 0 CA-C-N 117.959 0.345 . . . . 71.42 110.432 -170.384 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 1.4 tm0? -72.68 -41.12 65.69 Favored 'General case' 0 N--CA 1.467 0.378 0 CA-C-N 115.541 -0.754 . . . . 73.21 109.799 -174.478 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 40.3 ttmt -63.28 -55.08 27.73 Favored 'General case' 0 C--N 1.348 0.539 0 O-C-N 123.754 0.659 . . . . 73.42 111.26 -175.1 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 33.7 t -75.14 -28.48 60.17 Favored 'General case' 0 N--CA 1.476 0.845 0 C-N-CA 123.357 0.663 . . . . 65.05 111.733 -174.939 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 102' ' ' LEU . . . . . 0.418 HD12 ' HA ' ' A' ' 102' ' ' LEU . 10.5 tp -75.84 -35.57 59.91 Favored 'General case' 0 CA--C 1.549 0.937 0 CA-C-N 118.18 0.445 . . . . 75.13 110.657 178.526 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 5.0 t-20 -78.86 -26.48 44.04 Favored 'General case' 0 N--CA 1.481 1.089 0 C-N-CA 123.428 0.691 . . . . 74.33 110.248 176.58 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 3.5 t30 -67.53 -50.42 58.76 Favored 'General case' 0 N--CA 1.476 0.862 0 C-N-CA 123.927 0.891 . . . . 72.31 109.386 173.543 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 105' ' ' ALA . . . . . 0.452 ' O ' ' HB2' ' A' ' 109' ' ' LEU . . . -56.23 -46.62 79.47 Favored 'General case' 0 C--N 1.35 0.596 0 CA-C-N 115.096 -0.956 . . . . 51.23 110.244 175.959 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 106' ' ' TYR . . . . . . . . . . . . . 6.4 t80 -57.6 -43.06 84.41 Favored 'General case' 0 N--CA 1.478 0.931 0 C-N-CA 124.539 1.135 . . . . 65.14 110.705 176.215 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -62.33 -51.55 55.68 Favored Glycine 0 C--N 1.348 1.232 0 O-C-N 123.595 0.56 . . . . 53.44 113.094 -176.453 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.81 -33.13 74.2 Favored 'General case' 0 C--O 1.251 1.137 0 C-N-CA 122.548 0.339 . . . . 62.52 110.459 177.717 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 109' ' ' LEU . . . . . 0.761 ' HA ' ' HA ' ' A' ' 114' ' ' LEU . 4.6 tp -61.92 -55.1 33.07 Favored 'General case' 0 C--N 1.354 0.774 0 O-C-N 124.213 0.945 . . . . 70.11 110.596 -177.733 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 110' ' ' SER . . . . . 0.539 ' HA ' HE21 ' A' ' 61' ' ' GLN . 17.2 m -78.62 -18.05 55.1 Favored 'General case' 0 CA--C 1.542 0.65 0 CA-C-N 114.965 -1.016 . . . . 63.04 110.526 179.084 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . -73.01 -62.41 3.15 Favored Glycine 0 C--N 1.359 1.836 0 CA-C-O 118.571 -1.127 . . . . 73.44 114.74 -176.565 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 112' ' ' MET . . . . . 0.41 ' HG2' ' HA ' ' A' ' 119' ' ' PRO . 2.8 tmm? -94.5 -63.93 1.13 Allowed 'General case' 0 N--CA 1.503 2.213 0 CA-C-N 119.487 1.644 . . . . 71.41 111.162 -175.139 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 2.5 tm? 170.75 60.8 0.0 OUTLIER 'General case' 0 N--CA 1.48 1.041 0 N-CA-C 105.487 -2.042 . . . . 73.25 105.487 -177.649 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 114' ' ' LEU . . . . . 0.761 ' HA ' ' HA ' ' A' ' 109' ' ' LEU . 5.4 mp 66.92 -5.68 0.64 Allowed 'General case' 0 N--CA 1.475 0.82 0 CA-C-N 113.02 -1.9 . . . . 74.12 115.33 171.53 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 115' ' ' VAL . . . . . . . . . . . . . 27.5 m -78.54 144.53 65.65 Favored Pre-proline 0 CA--C 1.558 1.268 0 C-N-CA 123.538 0.735 . . . . 45.34 110.72 179.884 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 24.2 Cg_exo -65.05 -12.25 33.77 Favored 'Trans proline' 0 C--N 1.381 2.242 0 C-N-CA 122.927 2.418 . . . . 64.02 112.886 174.902 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 24.8 t70 -55.35 -30.81 61.02 Favored 'General case' 0 CA--C 1.55 0.97 0 C-N-CA 125.293 1.437 . . . . 65.23 113.246 -178.242 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . 77.79 156.43 0.15 Allowed Pre-proline 0 N--CA 1.493 1.716 0 C-N-CA 124.889 1.276 . . . . 71.03 111.636 -177.759 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 119' ' ' PRO . . . . . 0.41 ' HA ' ' HG2' ' A' ' 112' ' ' MET . 71.5 Cg_endo -73.91 30.83 0.32 Allowed 'Trans proline' 0 C--N 1.384 2.444 0 C-N-CA 122.96 2.44 . . . . 74.13 115.077 179.004 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . -71.31 -71.76 1.0 Allowed Glycine 0 C--N 1.348 1.21 0 N-CA-C 112.081 -0.408 . . . . 61.22 112.081 178.394 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . -93.02 80.16 4.57 Favored 'General case' 0 N--CA 1.478 0.95 0 C-N-CA 123.312 0.645 . . . . 73.52 110.109 178.498 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 122' ' ' SER . . . . . . . . . . . . . 39.6 m . . . . . 0 CA--C 1.558 1.275 0 CA-C-N 115.316 -0.856 . . . . 64.41 110.927 -179.39 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 20.2 ptt? . . . . . 0 N--CA 1.479 1.005 0 CA-C-O 121.293 0.568 . . . . 71.33 109.888 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 52.0 p -56.79 -33.12 66.35 Favored 'General case' 0 N--CA 1.482 1.16 0 C-N-CA 123.52 0.728 . . . . 63.45 111.971 -176.012 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 59.2 p -63.39 -43.41 97.65 Favored 'General case' 0 CA--C 1.549 0.92 0 C-N-CA 123.502 0.721 . . . . 35.11 110.995 175.098 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 27.6 m -69.63 -37.53 76.85 Favored 'General case' 0 N--CA 1.478 0.934 0 C-N-CA 123.581 0.752 . . . . 63.31 111.581 179.211 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 89.3 t -64.47 -47.16 90.52 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.819 0 C-N-CA 123.078 0.551 . . . . 72.34 109.858 179.664 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 16.7 mm-40 -60.26 -42.44 95.34 Favored 'General case' 0 C--O 1.218 -0.595 0 O-C-N 123.897 0.748 . . . . 64.33 110.563 173.495 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 35.7 t80 -59.19 -53.51 57.46 Favored 'General case' 0 CA--C 1.546 0.805 0 C-N-CA 123.626 0.77 . . . . 74.52 111.181 -176.851 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 52.0 mt -63.04 -45.89 97.62 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.033 0 C-N-CA 123.184 0.594 . . . . 73.24 110.311 179.226 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 3.4 t-20 -63.49 -32.99 74.6 Favored 'General case' 0 N--CA 1.48 1.028 0 C-N-CA 123.615 0.766 . . . . 64.33 111.454 -176.398 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 10' ' ' ARG . . . . . 0.477 ' O ' ' HB3' ' A' ' 13' ' ' ARG . 94.7 mtt180 -79.59 -29.39 41.16 Favored 'General case' 0 C--O 1.214 -0.775 0 CA-C-N 115.828 -0.624 . . . . 73.14 110.5 177.202 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 11' ' ' TRP . . . . . . . . . . . . . 79.3 m95 -76.6 -19.71 57.55 Favored 'General case' 0 N--CA 1.479 1.004 0 CA-C-O 119.186 -0.435 . . . . 73.3 111.053 171.362 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 51.3 mt-30 -68.73 -48.87 62.7 Favored 'General case' 0 N--CA 1.481 1.102 0 N-CA-C 108.196 -1.038 . . . . 75.04 108.196 168.265 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 13' ' ' ARG . . . . . 0.477 ' HB3' ' O ' ' A' ' 10' ' ' ARG . 17.6 tpt180 -48.25 -52.33 21.63 Favored 'General case' 0 CA--C 1.554 1.1 0 C-N-CA 124.939 1.296 . . . . 61.25 110.997 173.771 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 14' ' ' ILE . . . . . 0.465 HG13 ' O ' ' A' ' 10' ' ' ARG . 74.7 mt -69.08 -48.35 69.97 Favored 'Isoleucine or valine' 0 CA--C 1.558 1.267 0 C-N-CA 123.774 0.83 . . . . 54.42 111.267 -177.053 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -60.66 -48.4 81.93 Favored 'General case' 0 N--CA 1.487 1.424 0 C-N-CA 123.562 0.745 . . . . 54.45 111.964 -177.328 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 95.4 mt -69.26 -44.29 72.2 Favored 'General case' 0 CA--C 1.539 0.544 0 CA-C-N 115.079 -0.964 . . . . 61.04 111.046 -177.074 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.431 ' O ' ' HG ' ' A' ' 21' ' ' LEU . 42.3 mt -68.45 -32.41 72.41 Favored 'General case' 0 N--CA 1.482 1.171 0 CA-C-O 119.129 -0.463 . . . . 70.13 112.091 -179.502 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 78.7 p -68.38 -43.64 76.9 Favored 'General case' 0 N--CA 1.481 1.115 0 CA-C-N 118.181 0.446 . . . . 65.3 110.129 176.299 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 6.8 tp-100 -63.58 -37.56 87.77 Favored 'General case' 0 C--N 1.355 0.839 0 O-C-N 123.858 0.724 . . . . 74.11 110.789 176.841 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 52.5 m -62.52 -53.49 54.02 Favored 'General case' 0 C--N 1.348 0.542 0 CA-C-N 115.85 -0.614 . . . . 71.11 110.075 176.364 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 21' ' ' LEU . . . . . 0.545 HD22 ' HA ' ' A' ' 33' ' ' LEU . 57.9 mt -58.0 -35.6 71.46 Favored 'General case' 0 N--CA 1.477 0.916 0 O-C-N 123.833 0.708 . . . . 71.32 111.224 -178.569 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.652 HD22 ' HA ' ' A' ' 74' ' ' ASN . 53.5 tp -65.83 -57.25 8.39 Favored 'General case' 0 N--CA 1.475 0.817 0 O-C-N 123.364 0.415 . . . . 62.24 111.152 178.914 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 23' ' ' GLU . . . . . 0.451 ' O ' ' HG3' ' A' ' 27' ' ' ARG . 43.6 mt-10 -57.21 -50.76 71.85 Favored 'General case' 0 N--CA 1.481 1.076 0 O-C-N 123.628 0.58 . . . . 75.4 110.297 -179.366 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.462 HD23 ' HD2' ' A' ' 27' ' ' ARG . 95.0 mt -61.11 -33.49 73.45 Favored 'General case' 0 N--CA 1.474 0.768 0 C-N-CA 124.469 1.107 . . . . 74.31 111.735 -178.747 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 25' ' ' ALA . . . . . 0.547 ' HB2' HD21 ' A' ' 33' ' ' LEU . . . -61.62 -48.52 80.54 Favored 'General case' 0 N--CA 1.477 0.882 0 CA-C-O 120.957 0.408 . . . . 35.43 110.378 173.869 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 81.3 mt-30 -67.62 -22.43 65.34 Favored 'General case' 0 CA--C 1.551 0.99 0 CA-C-N 115.156 -0.929 . . . . 72.34 111.607 178.848 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 27' ' ' ARG . . . . . 0.462 ' HD2' HD23 ' A' ' 24' ' ' LEU . 73.3 mtt180 -85.72 -6.76 59.08 Favored 'General case' 0 N--CA 1.482 1.145 0 C-N-CA 124.062 0.945 . . . . 73.12 112.012 177.86 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 81.78 8.16 87.13 Favored Glycine 0 C--N 1.352 1.469 0 N-CA-C 113.612 0.205 . . . . 72.44 113.612 -178.397 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 36.8 mm-40 -82.26 60.98 5.26 Favored 'General case' 0 CA--C 1.545 0.757 0 C-N-CA 124.571 1.148 . . . . 60.01 111.404 179.912 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 30' ' ' TRP . . . . . 0.478 ' O ' ' HG ' ' A' ' 34' ' ' LEU . 45.9 m95 -65.99 -29.06 69.38 Favored 'General case' 0 N--CA 1.481 1.106 0 C-N-CA 122.992 0.517 . . . . 62.13 110.819 -177.154 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 -62.02 -46.96 86.9 Favored 'General case' 0 N--CA 1.475 0.791 0 C-N-CA 123.522 0.729 . . . . 71.43 109.771 177.295 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.431 ' HB3' HD13 ' A' ' 24' ' ' LEU . 61.1 mt -62.14 -28.77 69.88 Favored 'General case' 0 N--CA 1.476 0.873 0 C-N-CA 123.068 0.547 . . . . 72.44 111.385 176.722 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 33' ' ' LEU . . . . . 0.547 HD21 ' HB2' ' A' ' 25' ' ' ALA . 10.7 mp -68.86 -42.03 77.61 Favored 'General case' 0 C--N 1.357 0.897 0 CA-C-O 119.047 -0.501 . . . . 72.22 110.742 171.769 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.478 ' HG ' ' O ' ' A' ' 30' ' ' TRP . 83.8 mt -64.18 -43.54 94.79 Favored 'General case' 0 N--CA 1.487 1.387 0 C-N-CA 123.558 0.743 . . . . 71.41 111.565 -177.847 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 1.4 mp0 -65.43 -57.78 7.47 Favored 'General case' 0 N--CA 1.478 0.958 0 C-N-CA 123.137 0.575 . . . . 75.33 110.471 177.777 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 84.6 mm-40 -74.14 -11.31 60.27 Favored 'General case' 0 N--CA 1.479 0.99 0 C-N-CA 123.502 0.721 . . . . 74.43 112.723 -175.378 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 35.2 tt0 -53.65 -54.74 33.44 Favored 'General case' 0 N--CA 1.487 1.399 0 C-N-CA 123.876 0.87 . . . . 62.14 110.485 172.742 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 57.4 t -59.99 -47.94 89.77 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.514 0 O-C-N 124.248 0.968 . . . . 75.43 110.177 -179.344 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 16.3 m -55.6 -57.31 12.48 Favored 'General case' 0 CA--C 1.548 0.884 0 C-N-CA 124.037 0.935 . . . . 75.32 111.498 -179.265 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 28.5 t80 -63.87 -52.02 61.89 Favored 'General case' 0 CA--C 1.54 0.57 0 C-N-CA 124.97 1.308 . . . . 71.13 112.069 -173.73 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 41' ' ' LEU . . . . . 0.496 ' HA ' HG22 ' A' ' 44' ' ' ILE . 96.3 mt -72.22 -39.37 68.59 Favored 'General case' 0 N--CA 1.468 0.471 0 CA-C-N 115.969 -0.56 . . . . 71.24 111.659 -172.605 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 29.1 tt0 -60.0 -42.74 94.92 Favored 'General case' 0 CA--C 1.546 0.824 0 N-CA-C 109.68 -0.489 . . . . 73.11 109.68 173.866 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 43' ' ' SER . . . . . 0.436 ' O ' HG23 ' A' ' 47' ' ' VAL . 69.5 m -58.21 -54.84 42.48 Favored 'General case' 0 N--CA 1.483 1.189 0 C-N-CA 123.169 0.588 . . . . 73.12 112.151 176.892 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 44' ' ' ILE . . . . . 0.496 HG22 ' HA ' ' A' ' 41' ' ' LEU . 16.3 tt -62.83 -41.84 94.11 Favored 'Isoleucine or valine' 0 C--O 1.25 1.11 0 O-C-N 123.632 0.582 . . . . 71.33 111.146 -171.947 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 45' ' ' GLU . . . . . 0.496 ' O ' ' HG3' ' A' ' 49' ' ' GLU . 16.0 mm-40 -58.86 -51.02 71.82 Favored 'General case' 0 C--N 1.356 0.859 0 CA-C-N 115.801 -0.636 . . . . 62.43 110.166 174.812 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 46' ' ' THR . . . . . 0.514 ' O ' ' HD3' ' A' ' 50' ' ' LYS . 93.8 m -58.0 -36.31 72.48 Favored 'General case' 0 CA--C 1.55 0.976 0 O-C-N 124.319 1.012 . . . . 64.33 112.403 -178.115 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 47' ' ' VAL . . . . . 0.445 HG21 HD11 ' A' ' 14' ' ' ILE . 87.7 t -68.0 -45.42 83.69 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.063 0 C-N-CA 122.58 0.352 . . . . 63.41 110.167 177.721 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 48' ' ' MET . . . . . . . . . . . . . 65.8 mtm -76.0 -14.41 60.23 Favored 'General case' 0 N--CA 1.486 1.358 0 N-CA-C 112.989 0.737 . . . . 73.22 112.989 -177.799 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 49' ' ' GLU . . . . . 0.496 ' HG3' ' O ' ' A' ' 45' ' ' GLU . 69.0 mt-10 -70.53 -35.51 73.21 Favored 'General case' 0 N--CA 1.484 1.259 0 CA-C-O 120.839 0.352 . . . . 72.45 111.063 172.988 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 50' ' ' LYS . . . . . 0.514 ' HD3' ' O ' ' A' ' 46' ' ' THR . 13.4 mptt -90.21 166.84 13.13 Favored 'General case' 0 N--CA 1.477 0.915 0 C-N-CA 123.8 0.84 . . . . 61.04 110.65 -173.801 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 20.4 pt20 -71.92 146.78 47.59 Favored 'General case' 0 C--O 1.243 0.756 0 CA-C-N 115.431 -0.804 . . . . 72.23 110.635 -179.613 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 52' ' ' THR . . . . . 0.578 HG22 HD11 ' A' ' 56' ' ' ILE . 39.5 m -83.98 122.81 76.13 Favored Pre-proline 0 CA--C 1.546 0.807 0 N-CA-C 108.559 -0.904 . . . . 72.52 108.559 171.477 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 22.9 Cg_endo -57.38 157.06 23.32 Favored 'Trans proline' 0 C--N 1.379 2.149 0 C-N-CA 123.02 2.48 . . . . 51.13 113.411 -177.104 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 20.5 Cg_exo -68.22 -48.13 1.38 Allowed 'Trans proline' 0 C--N 1.371 1.755 0 C-N-CA 122.647 2.231 . . . . 71.12 112.354 174.394 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . -74.71 76.64 1.15 Allowed Glycine 0 C--N 1.351 1.378 0 CA-C-N 115.701 -0.681 . . . . 63.41 113.549 -175.97 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 56' ' ' ILE . . . . . 0.669 ' O ' ' HB ' ' A' ' 60' ' ' ILE . 26.6 mt -106.15 -14.14 9.26 Favored 'Isoleucine or valine' 0 C--O 1.202 -1.444 0 C-N-CA 123.583 0.753 . . . . 73.44 110.453 -179.989 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 73.6 p 38.82 -178.18 0.0 OUTLIER 'General case' 0 N--CA 1.506 2.338 0 N-CA-C 114.931 1.456 . . . . 73.13 114.931 -173.734 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 13.8 tpt85 -73.95 -37.04 64.67 Favored 'General case' 0 N--CA 1.476 0.854 0 O-C-N 120.482 -1.386 . . . . 74.5 108.378 171.194 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 33.4 m -62.51 -55.46 27.28 Favored 'General case' 0 C--O 1.246 0.875 0 C-N-CA 124.282 1.033 . . . . 73.1 111.93 -178.211 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 60' ' ' ILE . . . . . 0.669 ' HB ' ' O ' ' A' ' 56' ' ' ILE . 66.9 mt -75.03 -27.57 20.07 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.916 0 N-CA-C 109.046 -0.724 . . . . 75.23 109.046 -176.928 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 60.9 tt0 -57.23 -45.63 83.72 Favored 'General case' 0 C--N 1.376 1.732 0 CA-C-N 118.31 0.505 . . . . 65.24 110.862 171.915 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 65.9 m-20 -66.65 -41.78 87.7 Favored 'General case' 0 N--CA 1.472 0.666 0 O-C-N 123.591 0.557 . . . . 74.1 111.325 178.686 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 63' ' ' MET . . . . . . . . . . . . . 63.5 mtm -63.61 -54.78 30.53 Favored 'General case' 0 N--CA 1.486 1.343 0 O-C-N 123.318 0.386 . . . . 73.41 111.775 -179.455 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 64' ' ' VAL . . . . . 0.428 ' O ' HG13 ' A' ' 68' ' ' ILE . 73.5 t -59.04 -52.39 61.25 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.841 0 C-N-CA 123.719 0.808 . . . . 62.34 111.38 176.673 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 65' ' ' ALA . . . . . 0.465 ' HB2' HD23 ' A' ' 109' ' ' LEU . . . -64.46 -26.87 68.63 Favored 'General case' 0 N--CA 1.487 1.406 0 C-N-CA 122.534 0.333 . . . . 54.25 111.47 -179.836 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 66' ' ' GLY . . . . . 0.411 ' O ' ' HG3' ' A' ' 70' ' ' GLN . . . -68.1 -40.55 88.22 Favored Glycine 0 C--N 1.342 0.915 0 N-CA-C 111.296 -0.722 . . . . 73.4 111.296 174.357 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 67' ' ' TYR . . . . . 0.512 ' O ' HG23 ' A' ' 71' ' ' THR . 19.0 m-30 -67.06 -41.05 87.13 Favored 'General case' 0 N--CA 1.468 0.453 0 C-N-CA 123.533 0.733 . . . . 71.12 110.914 175.425 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 68' ' ' ILE . . . . . 0.584 ' O ' ' HG ' ' A' ' 72' ' ' LEU . 48.5 mt -61.09 -40.89 87.26 Favored 'Isoleucine or valine' 0 C--N 1.358 0.939 0 O-C-N 123.904 0.752 . . . . 63.24 109.001 174.665 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 69' ' ' LYS . . . . . 0.555 ' HA ' ' HE2' ' A' ' 69' ' ' LYS . 0.6 OUTLIER -58.72 -42.94 89.91 Favored 'General case' 0 N--CA 1.474 0.758 0 C-N-CA 123.305 0.642 . . . . 74.33 110.128 179.738 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 70' ' ' GLN . . . . . 0.411 ' HG3' ' O ' ' A' ' 66' ' ' GLY . 75.7 mt-30 -58.91 -45.92 89.18 Favored 'General case' 0 N--CA 1.476 0.84 0 O-C-N 124.176 0.922 . . . . 71.14 111.082 175.01 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 71' ' ' THR . . . . . 0.512 HG23 ' O ' ' A' ' 67' ' ' TYR . 10.0 p -60.59 -39.29 87.55 Favored 'General case' 0 N--CA 1.486 1.367 0 CA-C-O 120.862 0.363 . . . . 61.24 110.291 -178.63 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 72' ' ' LEU . . . . . 0.584 ' HG ' ' O ' ' A' ' 68' ' ' ILE . 52.7 mt -64.33 -54.59 30.7 Favored 'General case' 0 C--N 1.355 0.828 0 CA-C-N 115.144 -0.935 . . . . 74.43 109.812 -178.128 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 15.8 m-20 -58.7 -59.37 5.51 Favored 'General case' 0 N--CA 1.487 1.414 0 O-C-N 123.558 0.536 . . . . 74.14 111.243 178.542 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 74' ' ' ASN . . . . . 0.652 ' HA ' HD22 ' A' ' 22' ' ' LEU . 87.0 m-20 -56.71 -57.88 10.51 Favored 'General case' 0 N--CA 1.479 1.02 0 C-N-CA 124.471 1.108 . . . . 64.31 112.019 -173.59 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 75' ' ' GLU . . . . . 0.522 ' O ' ' HG2' ' A' ' 79' ' ' LYS . 61.8 tt0 -73.02 -29.25 62.87 Favored 'General case' 0 CA--C 1.545 0.78 0 CA-C-O 118.696 -0.668 . . . . 74.44 111.129 -172.694 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 52.2 tt0 -66.97 -38.43 86.07 Favored 'General case' 0 N--CA 1.491 1.578 0 CA-C-N 118.444 0.566 . . . . 70.44 110.763 173.536 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 92.6 mt -66.19 -30.56 71.05 Favored 'General case' 0 N--CA 1.471 0.583 0 N-CA-C 109.993 -0.373 . . . . 65.12 109.993 175.571 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 78' ' ' LEU . . . . . 0.609 HD21 ' HA ' ' A' ' 22' ' ' LEU . 85.3 mt -71.98 -35.01 69.37 Favored 'General case' 0 N--CA 1.479 1.019 0 C-N-CA 123.111 0.564 . . . . 65.02 111.912 170.437 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 79' ' ' LYS . . . . . 0.738 ' HD2' ' HA ' ' A' ' 86' ' ' LEU . 35.5 mmtm -60.7 -43.92 97.17 Favored 'General case' 0 N--CA 1.485 1.28 0 N-CA-C 109.19 -0.67 . . . . 65.13 109.19 174.997 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -75.23 -33.44 53.88 Favored Glycine 0 C--N 1.346 1.117 0 CA-C-N 114.674 -1.148 . . . . 52.33 113.643 -179.431 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 5.4 tt -73.24 -60.13 2.39 Favored 'General case' 0 N--CA 1.477 0.91 0 C-N-CA 123.367 0.667 . . . . 71.25 109.407 -178.247 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 74.3 mt -65.74 -49.4 68.56 Favored 'General case' 0 CA--C 1.544 0.738 0 CA-C-N 114.909 -1.041 . . . . 72.22 112.113 -171.018 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 19.5 tp60 -136.01 8.43 3.23 Favored 'General case' 0 N--CA 1.489 1.497 0 N-CA-C 112.705 0.632 . . . . 71.11 112.705 -169.845 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 94.9 mt-30 66.63 4.59 3.44 Favored 'General case' 0 N--CA 1.492 1.651 0 C-N-CA 124.412 1.085 . . . . 62.14 113.562 176.62 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 85' ' ' ARG . . . . . 0.602 ' HG3' ' H ' ' A' ' 86' ' ' LEU . 0.6 OUTLIER -167.17 -176.32 3.28 Favored 'General case' 0 CA--C 1.544 0.733 0 N-CA-C 109.007 -0.738 . . . . 71.35 109.007 -175.49 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 86' ' ' LEU . . . . . 0.738 ' HA ' ' HD2' ' A' ' 79' ' ' LYS . 72.9 mt -69.48 82.2 0.4 Allowed 'General case' 0 CA--C 1.55 0.951 0 C-N-CA 123.635 0.774 . . . . 72.02 112.813 -168.015 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 20.4 t70 -95.59 116.78 29.32 Favored 'General case' 0 C--O 1.24 0.573 0 C-N-CA 124.223 1.009 . . . . 75.15 109.031 174.475 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 33.4 mm-40 -85.48 11.94 9.48 Favored 'General case' 0 CA--C 1.544 0.712 0 C-N-CA 123.257 0.623 . . . . 64.13 112.457 -170.475 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 80.1 mt 56.7 -139.43 0.91 Allowed 'General case' 0 CA--C 1.558 1.278 0 C-N-CA 123.324 0.65 . . . . 73.23 110.154 -179.4 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 4.8 m -117.09 140.98 48.84 Favored 'General case' 0 N--CA 1.476 0.826 0 N-CA-C 109.108 -0.701 . . . . 64.43 109.108 173.524 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 34.7 t 77.68 41.09 0.14 Allowed 'General case' 0 N--CA 1.492 1.635 0 C-N-CA 125.066 1.346 . . . . 64.35 112.243 176.756 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 92' ' ' LEU . . . . . 0.499 HD22 HH12 ' A' ' 98' ' ' ARG . 33.0 mt -124.31 177.09 6.05 Favored 'General case' 0 N--CA 1.486 1.348 0 C-N-CA 123.792 0.837 . . . . 70.41 109.222 163.021 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 36.7 mt -68.71 145.52 13.38 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.943 0 C-N-CA 123.729 0.812 . . . . 71.53 109.617 176.473 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -64.64 138.63 40.41 Favored Glycine 0 C--N 1.348 1.2 0 O-C-N 123.551 0.532 . . . . 53.14 113.996 -175.881 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 51.3 tt0 61.56 88.19 0.09 Allowed 'General case' 0 CA--C 1.554 1.12 0 C-N-CA 125.127 1.371 . . . . 61.21 113.103 173.007 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 45.2 m 47.03 68.01 0.7 Allowed 'General case' 0 N--CA 1.486 1.337 0 C-N-CA 125.017 1.327 . . . . 70.33 114.114 163.922 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 12.0 t -96.48 -34.22 11.57 Favored 'General case' 0 N--CA 1.474 0.753 0 C-N-CA 122.49 0.316 . . . . 71.53 111.399 -177.25 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 98' ' ' ARG . . . . . 0.538 ' HA ' ' NE ' ' A' ' 98' ' ' ARG . 0.2 OUTLIER -62.61 -51.16 68.4 Favored 'General case' 0 C--N 1.353 0.752 0 O-C-N 123.584 0.552 . . . . 75.01 112.488 -161.486 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 22.7 tp60 -55.66 -55.58 30.53 Favored 'General case' 0 CA--C 1.545 0.765 0 O-C-N 124.159 0.912 . . . . 74.34 111.157 -176.519 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 24.1 tptp -70.88 -51.84 23.82 Favored 'General case' 0 CA--C 1.54 0.58 0 CA-C-N 115.585 -0.734 . . . . 71.2 111.153 -171.573 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 40.6 t -69.05 -38.36 79.08 Favored 'General case' 0 N--CA 1.474 0.748 0 C-N-CA 123.698 0.799 . . . . 71.52 112.353 -173.236 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 13.9 tp -83.5 -33.63 25.5 Favored 'General case' 0 N--CA 1.476 0.86 0 C-N-CA 122.485 0.314 . . . . 64.24 110.866 -174.405 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 27.9 t-20 -69.09 -34.23 74.79 Favored 'General case' 0 N--CA 1.482 1.158 0 N-CA-C 110.109 -0.33 . . . . 72.5 110.109 171.723 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 104' ' ' ASN . . . . . 0.453 ' O ' ' HG2' ' A' ' 108' ' ' ARG . 27.4 t-20 -60.88 -46.19 91.6 Favored 'General case' 0 N--CA 1.478 0.957 0 C-N-CA 123.16 0.584 . . . . 72.53 109.479 171.671 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -57.09 -42.79 81.38 Favored 'General case' 0 N--CA 1.477 0.887 0 O-C-N 124.018 0.824 . . . . 50.51 111.24 178.841 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 106' ' ' TYR . . . . . 0.402 ' HE2' ' HB2' ' A' ' 69' ' ' LYS . 9.1 t80 -58.47 -51.56 69.34 Favored 'General case' 0 CA--C 1.547 0.848 0 O-C-N 123.737 0.648 . . . . 74.02 110.276 175.384 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -65.79 -38.59 94.54 Favored Glycine 0 C--N 1.353 1.521 0 O-C-N 123.909 0.755 . . . . 72.1 113.232 -174.568 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 108' ' ' ARG . . . . . 0.453 ' HG2' ' O ' ' A' ' 104' ' ' ASN . 21.3 mmt180 -70.2 -35.62 74.03 Favored 'General case' 0 C--N 1.348 0.526 0 C-N-CA 122.998 0.519 . . . . 73.34 109.62 179.248 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 109' ' ' LEU . . . . . 0.465 HD23 ' HB2' ' A' ' 65' ' ' ALA . 53.2 tp -63.81 -52.69 59.07 Favored 'General case' 0 N--CA 1.48 1.058 0 C-N-CA 122.803 0.441 . . . . 73.13 110.216 175.782 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 16.2 t -62.91 -37.44 86.97 Favored 'General case' 0 CA--C 1.54 0.581 0 O-C-N 125.109 1.506 . . . . 71.24 111.03 -172.677 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . -91.05 -62.08 1.24 Allowed Glycine 0 C--N 1.35 1.326 0 CA-C-O 119.919 -0.378 . . . . 75.23 113.869 178.252 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 112' ' ' MET . . . . . . . . . . . . . 7.3 tpt -93.18 -65.81 0.97 Allowed 'General case' 0 N--CA 1.487 1.425 0 N-CA-C 113.167 0.802 . . . . 65.31 113.167 -168.213 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 113' ' ' LEU . . . . . 0.581 ' HB3' HG22 ' A' ' 115' ' ' VAL . 14.4 tp 168.08 16.75 0.0 OUTLIER 'General case' 0 N--CA 1.504 2.271 0 C-N-CA 124.336 1.055 . . . . 71.21 110.917 -173.911 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 114' ' ' LEU . . . . . 0.445 ' N ' ' HA ' ' A' ' 109' ' ' LEU . 0.7 OUTLIER 68.3 18.01 9.21 Favored 'General case' 0 N--CA 1.502 2.13 0 C-N-CA 125.158 1.383 . . . . 71.21 110.098 -171.633 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 115' ' ' VAL . . . . . 0.581 HG22 ' HB3' ' A' ' 113' ' ' LEU . 27.4 m -107.98 105.94 57.46 Favored Pre-proline 0 CA--C 1.557 1.242 0 N-CA-C 107.83 -1.174 . . . . 42.35 107.83 173.379 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 72.6 Cg_endo -80.8 88.86 1.35 Allowed 'Trans proline' 0 C--N 1.375 1.954 0 C-N-CA 122.336 2.024 . . . . 71.2 112.134 179.948 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 2.3 m-20 -66.34 -54.35 25.65 Favored 'General case' 0 N--CA 1.475 0.808 0 CA-C-N 114.995 -1.002 . . . . 72.31 110.322 174.94 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -155.95 134.91 7.68 Favored Pre-proline 0 CA--C 1.541 0.623 0 CA-C-N 114.854 -1.066 . . . . 64.11 109.662 -177.125 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 119' ' ' PRO . . . . . . . . . . . . . 49.3 Cg_exo -59.18 117.89 4.7 Favored 'Trans proline' 0 C--N 1.371 1.715 0 C-N-CA 122.583 2.189 . . . . 71.34 111.716 168.757 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . -79.11 -178.08 50.53 Favored Glycine 0 C--N 1.349 1.284 0 O-C-N 123.151 0.282 . . . . 60.44 113.2 179.955 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . -64.57 94.97 0.13 Allowed 'General case' 0 N--CA 1.478 0.945 0 C-N-CA 123.739 0.816 . . . . 64.35 111.574 -177.494 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 122' ' ' SER . . . . . . . . . . . . . 20.8 m . . . . . 0 C--O 1.248 0.983 0 C-N-CA 124.209 1.003 . . . . 73.31 109.269 176.23 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 23.4 ttt . . . . . 0 N--CA 1.48 1.027 0 CA-C-O 119.773 -0.156 . . . . 71.11 111.083 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 87.1 m -52.0 -49.16 63.85 Favored 'General case' 0 N--CA 1.484 1.228 0 C-N-CA 123.387 0.675 . . . . 73.14 111.865 -178.08 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 22.9 m -63.08 -35.37 80.04 Favored 'General case' 0 N--CA 1.471 0.596 0 C-N-CA 123.708 0.803 . . . . 52.32 111.479 -178.901 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 4' ' ' THR . . . . . 0.558 HG21 HD13 ' A' ' 60' ' ' ILE . 5.0 m -68.42 -47.9 66.06 Favored 'General case' 0 CA--C 1.544 0.732 0 C-N-CA 123.461 0.704 . . . . 71.15 110.875 179.37 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 76.5 t -65.23 -39.51 85.66 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.979 0 C-N-CA 123.595 0.758 . . . . 63.11 110.484 -178.2 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 39.0 mm-40 -59.73 -49.23 78.53 Favored 'General case' 0 C--N 1.35 0.615 0 C-N-CA 123.291 0.636 . . . . 72.54 110.218 172.479 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 29.3 t80 -59.35 -45.78 90.45 Favored 'General case' 0 CA--C 1.551 1.0 0 C-N-CA 124.296 1.038 . . . . 74.34 110.873 -176.188 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 8' ' ' ILE . . . . . 0.464 HD11 HG23 ' A' ' 60' ' ' ILE . 77.7 mt -66.8 -42.95 90.0 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.914 0 C-N-CA 123.943 0.897 . . . . 71.05 110.693 179.635 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 28.5 t-20 -66.64 -34.18 77.31 Favored 'General case' 0 N--CA 1.485 1.32 0 C-N-CA 123.531 0.732 . . . . 64.32 111.355 -178.16 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 75.9 mtt180 -68.57 -41.42 79.72 Favored 'General case' 0 CA--C 1.537 0.469 0 CA-C-N 115.601 -0.727 . . . . 74.43 109.383 174.521 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 11' ' ' TRP . . . . . 0.468 ' HH2' ' HG ' ' A' ' 102' ' ' LEU . 42.5 m95 -65.66 -29.26 69.8 Favored 'General case' 0 N--CA 1.477 0.884 0 O-C-N 123.458 0.474 . . . . 73.25 111.632 173.905 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 50.1 mt-30 -61.91 -50.08 73.61 Favored 'General case' 0 C--N 1.359 0.987 0 N-CA-C 108.568 -0.901 . . . . 63.54 108.568 172.506 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 14.6 tpt180 -57.67 -49.25 77.12 Favored 'General case' 0 CA--C 1.545 0.785 0 O-C-N 124.103 0.877 . . . . 74.32 111.411 -179.078 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 14' ' ' ILE . . . . . 0.458 HD11 HG21 ' A' ' 47' ' ' VAL . 65.6 mt -63.59 -48.34 87.28 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.359 0 C-N-CA 123.427 0.691 . . . . 72.04 111.051 -177.897 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 15' ' ' ALA . . . . . 0.463 ' HB1' ' OE1' ' A' ' 70' ' ' GLN . . . -60.72 -47.79 84.69 Favored 'General case' 0 N--CA 1.478 0.934 0 C-N-CA 124.296 1.038 . . . . 70.55 111.412 -177.813 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 96.3 mt -74.69 -34.13 62.59 Favored 'General case' 0 N--CA 1.481 1.11 0 CA-C-N 114.756 -1.111 . . . . 72.04 111.452 -176.531 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.495 ' O ' ' HG ' ' A' ' 21' ' ' LEU . 18.6 mt -63.95 -54.97 26.27 Favored 'General case' 0 C--N 1.36 1.058 0 N-CA-C 109.41 -0.589 . . . . 61.54 109.41 175.745 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 79.6 p -59.63 -35.38 74.28 Favored 'General case' 0 CA--C 1.544 0.749 0 O-C-N 123.894 0.746 . . . . 63.12 111.276 -178.568 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 23.7 tp60 -62.29 -49.16 76.76 Favored 'General case' 0 N--CA 1.478 0.932 0 C-N-CA 123.503 0.721 . . . . 61.42 110.907 174.673 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 57.1 m -60.58 -43.21 97.57 Favored 'General case' 0 N--CA 1.472 0.665 0 C-N-CA 123.33 0.652 . . . . 54.01 110.444 177.023 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 21' ' ' LEU . . . . . 0.693 HD22 ' HA ' ' A' ' 33' ' ' LEU . 77.2 mt -68.75 -28.81 67.14 Favored 'General case' 0 C--N 1.346 0.415 0 C-N-CA 123.959 0.904 . . . . 74.45 110.288 -177.015 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.597 ' HA ' HD21 ' A' ' 78' ' ' LEU . 35.8 tp -68.65 -51.26 43.9 Favored 'General case' 0 C--N 1.354 0.779 0 O-C-N 123.859 0.725 . . . . 53.42 109.652 175.928 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 76.2 mm-40 -51.87 -54.61 27.21 Favored 'General case' 0 N--CA 1.478 0.94 0 O-C-N 124.091 0.869 . . . . 74.22 110.526 175.799 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.553 ' HB3' ' HB2' ' A' ' 29' ' ' GLU . 95.5 mt -64.2 -37.27 86.87 Favored 'General case' 0 CA--C 1.545 0.768 0 CA-C-N 114.505 -1.225 . . . . 73.44 111.46 -174.196 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 25' ' ' ALA . . . . . 0.629 ' HB2' HD21 ' A' ' 33' ' ' LEU . . . -66.7 -38.12 86.09 Favored 'General case' 0 N--CA 1.489 1.511 0 C-N-CA 122.837 0.455 . . . . 71.3 111.378 177.73 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 87.1 mt-30 -67.01 -26.76 66.95 Favored 'General case' 0 N--CA 1.478 0.96 0 C-N-CA 123.84 0.856 . . . . 71.33 110.833 175.481 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 59.2 mtt180 -88.51 -15.19 35.89 Favored 'General case' 0 N--CA 1.481 1.091 0 C-N-CA 124.025 0.93 . . . . 74.32 111.874 175.086 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 81.44 35.77 22.15 Favored Glycine 0 C--N 1.352 1.443 0 C-N-CA 123.01 0.338 . . . . 60.43 113.285 178.999 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 29' ' ' GLU . . . . . 0.553 ' HB2' ' HB3' ' A' ' 24' ' ' LEU . 13.6 mm-40 -97.83 59.89 1.48 Allowed 'General case' 0 CA--C 1.545 0.774 0 C-N-CA 124.806 1.243 . . . . 74.24 109.527 -177.551 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 30' ' ' TRP . . . . . 0.401 ' O ' ' HG ' ' A' ' 34' ' ' LEU . 61.3 m95 -53.58 -38.71 64.17 Favored 'General case' 0 N--CA 1.485 1.319 0 C-N-CA 124.245 1.018 . . . . 71.52 112.028 -174.421 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 31' ' ' ASP . . . . . 0.43 ' O ' ' HG3' ' A' ' 35' ' ' GLN . 4.2 m-20 -58.0 -50.15 74.39 Favored 'General case' 0 N--CA 1.483 1.186 0 C-N-CA 123.743 0.817 . . . . 72.3 110.652 -179.272 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 95.7 mt -62.89 -31.52 72.58 Favored 'General case' 0 N--CA 1.479 0.993 0 C-N-CA 123.93 0.892 . . . . 61.51 111.755 -176.778 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 33' ' ' LEU . . . . . 0.693 ' HA ' HD22 ' A' ' 21' ' ' LEU . 11.2 mp -66.26 -45.78 79.35 Favored 'General case' 0 N--CA 1.478 0.956 0 C-N-CA 123.045 0.538 . . . . 74.23 110.54 173.131 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.401 ' HG ' ' O ' ' A' ' 30' ' ' TRP . 81.1 mt -69.31 -24.77 63.98 Favored 'General case' 0 CA--C 1.548 0.897 0 CA-C-N 115.84 -0.618 . . . . 75.15 111.712 179.43 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 35' ' ' GLN . . . . . 0.43 ' HG3' ' O ' ' A' ' 31' ' ' ASP . 95.1 mt-30 -77.84 -32.42 52.13 Favored 'General case' 0 N--CA 1.474 0.752 0 C-N-CA 122.822 0.449 . . . . 74.33 111.24 178.067 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 36' ' ' GLN . . . . . 0.569 ' HB2' HD21 ' A' ' 21' ' ' LEU . 87.0 mm-40 -90.67 -14.63 31.89 Favored 'General case' 0 N--CA 1.483 1.183 0 C-N-CA 123.101 0.56 . . . . 74.51 112.37 174.746 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 42.2 tt0 -47.83 -56.37 7.62 Favored 'General case' 0 N--CA 1.488 1.462 0 C-N-CA 124.104 0.962 . . . . 71.4 112.871 -176.998 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 91.9 t -60.88 -43.9 96.65 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.869 0 C-N-CA 123.057 0.543 . . . . 74.45 111.684 -175.3 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 44.7 p -68.47 -34.75 76.49 Favored 'General case' 0 N--CA 1.473 0.723 0 C-N-CA 122.903 0.481 . . . . 65.45 111.148 -178.725 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 66.2 t80 -69.02 -51.74 35.93 Favored 'General case' 0 CA--C 1.541 0.61 0 C-N-CA 123.707 0.803 . . . . 75.2 110.027 -179.478 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 72.7 mt -63.73 -43.46 96.45 Favored 'General case' 0 N--CA 1.473 0.71 0 O-C-N 124.254 0.972 . . . . 61.22 110.834 -179.284 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 53.3 tt0 -67.57 -45.81 74.52 Favored 'General case' 0 N--CA 1.476 0.837 0 C-N-CA 123.027 0.531 . . . . 74.3 111.102 -176.903 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 43' ' ' SER . . . . . 0.489 ' O ' HG23 ' A' ' 47' ' ' VAL . 68.7 m -65.74 -42.43 90.98 Favored 'General case' 0 N--CA 1.474 0.757 0 O-C-N 123.312 0.383 . . . . 61.44 111.457 -178.941 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 44' ' ' ILE . . . . . 0.423 HG13 HD13 ' A' ' 14' ' ' ILE . 15.7 tt -69.45 -35.74 68.25 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.019 0 O-C-N 123.077 0.235 . . . . 63.03 110.704 -178.147 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 9.6 mm-40 -59.12 -44.91 92.03 Favored 'General case' 0 C--N 1.359 1.019 0 C-N-CA 123.428 0.691 . . . . 73.5 110.527 171.726 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 90.0 m -58.61 -45.3 89.47 Favored 'General case' 0 CA--C 1.544 0.738 0 O-C-N 124.277 0.986 . . . . 74.13 111.261 178.604 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 47' ' ' VAL . . . . . 0.489 HG23 ' O ' ' A' ' 43' ' ' SER . 57.8 t -64.04 -47.85 88.53 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.172 0 C-N-CA 123.108 0.563 . . . . 70.32 111.443 -178.468 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 48' ' ' MET . . . . . . . . . . . . . 73.6 mtm -73.51 -24.02 60.1 Favored 'General case' 0 N--CA 1.48 1.034 0 CA-C-N 115.95 -0.568 . . . . 73.23 111.642 -177.397 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 9.8 tp10 -82.16 -35.33 28.52 Favored 'General case' 0 N--CA 1.475 0.777 0 C-N-CA 122.847 0.459 . . . . 72.51 110.396 178.169 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 12.3 mptt -84.62 151.46 24.48 Favored 'General case' 0 N--CA 1.479 0.991 0 C-N-CA 123.475 0.71 . . . . 62.15 110.874 -176.971 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 8.7 tt0 -76.23 132.9 40.18 Favored 'General case' 0 CA--C 1.543 0.707 0 CA-C-N 114.76 -1.109 . . . . 61.25 110.921 -175.131 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 24.1 m -74.46 125.65 89.58 Favored Pre-proline 0 CA--C 1.551 0.989 0 C-N-CA 123.712 0.805 . . . . 72.42 109.079 170.314 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 73.7 Cg_endo -72.45 152.05 54.19 Favored 'Trans proline' 0 C--N 1.373 1.864 0 C-N-CA 122.075 1.85 . . . . 62.04 112.777 -178.903 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 54' ' ' PRO . . . . . 0.533 ' HA ' HG21 ' A' ' 115' ' ' VAL . 52.8 Cg_exo -58.72 -44.94 32.43 Favored 'Trans proline' 0 C--N 1.378 2.099 0 C-N-CA 123.716 2.944 . . . . 72.55 113.583 176.427 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . -63.83 80.38 0.05 OUTLIER Glycine 0 C--N 1.351 1.409 0 O-C-N 124.342 1.027 . . . . 40.23 114.117 -176.849 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 72.5 mt -130.49 111.61 21.08 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.673 0 C-N-CA 124.804 1.242 . . . . 65.31 108.752 178.522 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 57' ' ' THR . . . . . 0.467 ' H ' HD12 ' A' ' 60' ' ' ILE . 74.2 p -80.23 175.14 10.91 Favored 'General case' 0 N--CA 1.471 0.577 0 C-N-CA 123.47 0.708 . . . . 73.54 109.454 172.544 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 26.3 tpt180 -63.94 -38.96 93.01 Favored 'General case' 0 CA--C 1.541 0.622 0 CA-C-O 119.428 -0.32 . . . . 72.53 110.398 177.538 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 21.9 m -59.41 -47.39 85.62 Favored 'General case' 0 CA--C 1.548 0.889 0 C-N-CA 122.987 0.515 . . . . 71.22 110.854 178.252 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 60' ' ' ILE . . . . . 0.558 HD13 HG21 ' A' ' 4' ' ' THR . 93.5 mt -61.09 -42.17 92.18 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.149 0 C-N-CA 123.623 0.769 . . . . 63.41 110.372 176.159 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 64.4 tt0 -62.54 -38.7 91.01 Favored 'General case' 0 CA--C 1.547 0.837 0 C-N-CA 124.024 0.929 . . . . 70.33 111.092 -179.171 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 63.9 m-20 -67.68 -43.52 80.0 Favored 'General case' 0 N--CA 1.48 1.028 0 C-N-CA 123.433 0.693 . . . . 73.14 110.79 177.686 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 63' ' ' MET . . . . . . . . . . . . . 72.3 mtm -64.46 -52.39 58.23 Favored 'General case' 0 N--CA 1.48 1.054 0 O-C-N 123.72 0.638 . . . . 62.2 111.447 -178.356 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 64' ' ' VAL . . . . . 0.465 ' O ' HG13 ' A' ' 68' ' ' ILE . 92.4 t -60.71 -50.42 80.53 Favored 'Isoleucine or valine' 0 C--N 1.353 0.739 0 C-N-CA 123.71 0.804 . . . . 72.14 110.372 -179.747 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 65' ' ' ALA . . . . . 0.404 ' HB2' HD23 ' A' ' 109' ' ' LEU . . . -61.91 -36.5 81.52 Favored 'General case' 0 N--CA 1.484 1.231 0 O-C-N 123.432 0.457 . . . . 72.31 111.327 179.78 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -64.25 -38.81 96.41 Favored Glycine 0 C--N 1.345 1.038 0 O-C-N 123.73 0.644 . . . . 33.4 112.402 178.41 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 67' ' ' TYR . . . . . 0.528 ' O ' HG22 ' A' ' 71' ' ' THR . 17.9 m-30 -72.58 -42.32 64.71 Favored 'General case' 0 N--CA 1.471 0.577 0 C-N-CA 123.277 0.631 . . . . 74.35 111.452 179.371 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 68' ' ' ILE . . . . . 0.522 ' O ' ' HG ' ' A' ' 72' ' ' LEU . 68.0 mt -56.49 -52.22 55.52 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.112 0 N-CA-C 108.652 -0.87 . . . . 75.51 108.652 175.207 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 69' ' ' LYS . . . . . 0.549 ' HB2' ' HE2' ' A' ' 106' ' ' TYR . 13.5 tmtt? -53.35 -45.8 69.3 Favored 'General case' 0 N--CA 1.476 0.842 0 C-N-CA 125.25 1.42 . . . . 71.42 110.345 179.125 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 70' ' ' GLN . . . . . 0.463 ' OE1' ' HB1' ' A' ' 15' ' ' ALA . 61.4 tt0 -61.39 -49.1 78.25 Favored 'General case' 0 C--N 1.349 0.557 0 CA-C-N 115.428 -0.806 . . . . 73.43 111.328 -176.158 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 71' ' ' THR . . . . . 0.528 HG22 ' O ' ' A' ' 67' ' ' TYR . 1.0 OUTLIER -73.18 -23.59 60.44 Favored 'General case' 0 N--CA 1.474 0.736 0 CA-C-O 119.469 -0.3 . . . . 64.15 110.874 -178.871 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 72' ' ' LEU . . . . . 0.522 ' HG ' ' O ' ' A' ' 68' ' ' ILE . 37.4 mt -61.21 -55.61 30.2 Favored 'General case' 0 C--N 1.363 1.16 0 N-CA-C 108.878 -0.786 . . . . 63.42 108.878 173.175 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 73' ' ' ASP . . . . . 0.427 ' O ' ' HG ' ' A' ' 77' ' ' LEU . 4.5 m-20 -55.09 -61.89 2.02 Favored 'General case' 0 N--CA 1.482 1.133 0 O-C-N 124.505 1.128 . . . . 75.32 111.001 177.373 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 74' ' ' ASN . . . . . 0.529 ' HA ' HD22 ' A' ' 22' ' ' LEU . 83.0 m-20 -53.5 -54.7 33.41 Favored 'General case' 0 N--CA 1.478 0.933 0 O-C-N 124.506 1.129 . . . . 74.23 112.294 -172.292 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 75' ' ' GLU . . . . . 0.41 ' HB3' ' NH2' ' A' ' 98' ' ' ARG . 5.4 tt0 -73.03 -32.77 65.31 Favored 'General case' 0 CA--C 1.547 0.832 0 O-C-N 123.211 0.32 . . . . 72.43 111.516 -174.634 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 60.8 tt0 -64.9 -37.15 86.69 Favored 'General case' 0 N--CA 1.484 1.266 0 CA-C-O 120.764 0.316 . . . . 73.3 110.197 175.43 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 77' ' ' LEU . . . . . 0.427 ' HG ' ' O ' ' A' ' 73' ' ' ASP . 96.8 mt -68.72 -34.92 76.45 Favored 'General case' 0 CA--C 1.539 0.539 0 CA-C-N 116.057 -0.52 . . . . 61.34 110.198 176.142 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 78' ' ' LEU . . . . . 0.597 HD21 ' HA ' ' A' ' 22' ' ' LEU . 57.3 mt -61.04 -39.88 91.47 Favored 'General case' 0 N--CA 1.483 1.193 0 C-N-CA 122.89 0.476 . . . . 73.12 111.03 171.675 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 79' ' ' LYS . . . . . 0.528 ' HD2' ' HA ' ' A' ' 86' ' ' LEU . 48.8 mmtm -65.01 -45.57 84.97 Favored 'General case' 0 C--O 1.22 -0.449 0 CA-C-N 116.416 -0.356 . . . . 74.02 110.334 178.224 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -71.32 -25.24 75.83 Favored Glycine 0 CA--C 1.531 1.081 0 O-C-N 124.104 0.877 . . . . 74.15 113.851 -179.294 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 6.4 tt -86.05 -64.26 1.18 Allowed 'General case' 0 N--CA 1.48 1.052 0 C-N-CA 123.312 0.645 . . . . 64.22 109.613 -178.002 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 25.6 mt -69.38 -48.87 59.87 Favored 'General case' 0 N--CA 1.479 1.008 0 C-N-CA 123.914 0.885 . . . . 71.3 112.167 -168.511 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 15.5 mm-40 -120.86 -2.43 9.79 Favored 'General case' 0 N--CA 1.488 1.457 0 N-CA-C 112.809 0.67 . . . . 70.44 112.809 -174.496 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 41.2 tt0 65.39 11.7 7.55 Favored 'General case' 0 CA--C 1.566 1.585 0 C-N-CA 124.796 1.238 . . . . 74.22 112.076 179.89 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 85' ' ' ARG . . . . . . . . . . . . . 48.7 ttt180 -175.05 162.93 3.13 Favored 'General case' 0 N--CA 1.486 1.336 0 C-N-CA 124.21 1.004 . . . . 75.54 109.762 -173.897 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 86' ' ' LEU . . . . . 0.528 ' HA ' ' HD2' ' A' ' 79' ' ' LYS . 92.0 mt -55.42 115.51 2.33 Favored 'General case' 0 C--N 1.358 0.948 0 C-N-CA 123.699 0.799 . . . . 60.21 109.916 166.255 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 35.0 t70 -154.39 -76.88 0.11 Allowed 'General case' 0 CA--C 1.543 0.675 0 N-CA-C 109.701 -0.481 . . . . 53.21 109.701 -177.133 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 48.2 mt-10 -112.96 167.42 10.53 Favored 'General case' 0 N--CA 1.485 1.298 0 C-N-CA 123.455 0.702 . . . . 75.31 111.102 178.745 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 87.3 mt 62.65 38.15 12.34 Favored 'General case' 0 N--CA 1.486 1.347 0 C-N-CA 125.119 1.368 . . . . 55.14 110.143 -168.326 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 32.3 p -159.41 15.1 0.15 Allowed 'General case' 0 N--CA 1.481 1.117 0 CA-C-N 115.58 -0.737 . . . . 52.34 112.029 -179.827 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 67.6 p -77.64 78.29 4.15 Favored 'General case' 0 CA--C 1.547 0.844 0 CA-C-O 121.757 0.789 . . . . 73.44 109.48 177.33 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 75.7 mt -87.95 -81.2 0.25 Allowed 'General case' 0 CA--C 1.54 0.582 0 CA-C-N 114.961 -1.018 . . . . 71.2 110.852 -175.277 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 62.6 mt -90.05 -40.01 12.57 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.69 0 N-CA-C 108.259 -1.015 . . . . 74.22 108.259 174.161 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 178.92 -56.67 0.09 OUTLIER Glycine 0 C--N 1.345 1.032 0 CA-C-N 114.446 -1.252 . . . . 75.33 110.176 177.037 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 13.8 pt20 -81.27 175.32 10.7 Favored 'General case' 0 C--O 1.244 0.784 0 C-N-CA 123.626 0.77 . . . . 63.42 110.764 176.811 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 35.0 p -83.99 51.67 2.11 Favored 'General case' 0 CA--C 1.552 1.042 0 C-N-CA 124.369 1.067 . . . . 65.11 110.666 177.937 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 15.2 t -67.56 -9.76 45.62 Favored 'General case' 0 N--CA 1.479 1.01 0 C-N-CA 124.189 0.996 . . . . 64.32 112.837 -174.325 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 98' ' ' ARG . . . . . 0.594 HH11 HD22 ' A' ' 102' ' ' LEU . 2.0 tmm_? -51.28 -50.34 59.47 Favored 'General case' 0 N--CA 1.479 1.003 0 C-N-CA 125.265 1.426 . . . . 74.41 111.506 -176.439 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 24.7 tm0? -57.26 -53.3 59.71 Favored 'General case' 0 N--CA 1.474 0.752 0 C-N-CA 124.025 0.93 . . . . 74.43 110.053 -176.887 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 61.5 tttp -65.02 -49.16 71.25 Favored 'General case' 0 C--O 1.218 -0.567 0 O-C-N 124.016 0.823 . . . . 74.3 111.425 -176.589 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 51.1 m -60.27 -43.98 95.72 Favored 'General case' 0 CA--C 1.542 0.649 0 C-N-CA 123.587 0.755 . . . . 71.21 111.584 -173.877 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 102' ' ' LEU . . . . . 0.594 HD22 HH11 ' A' ' 98' ' ' ARG . 10.8 mp -78.45 -35.64 46.48 Favored 'General case' 0 N--CA 1.48 1.026 0 N-CA-C 112.306 0.484 . . . . 71.21 112.306 -179.08 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 26.9 t-20 -69.41 -37.84 77.65 Favored 'General case' 0 N--CA 1.484 1.254 0 CA-C-O 121.035 0.445 . . . . 63.45 110.392 179.727 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -73.72 -36.51 65.21 Favored 'General case' 0 N--CA 1.47 0.561 0 CA-C-N 115.615 -0.721 . . . . 74.24 109.164 176.768 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -61.56 -36.76 81.53 Favored 'General case' 0 C--N 1.358 0.937 0 O-C-N 123.605 0.566 . . . . 73.53 110.892 173.715 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 106' ' ' TYR . . . . . 0.549 ' HE2' ' HB2' ' A' ' 69' ' ' LYS . 2.3 t80 -67.45 -42.03 83.75 Favored 'General case' 0 CA--C 1.541 0.614 0 N-CA-C 108.964 -0.754 . . . . 73.42 108.964 176.762 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -67.01 -31.79 78.97 Favored Glycine 0 CA--C 1.535 1.283 0 O-C-N 123.59 0.556 . . . . 54.24 113.449 177.809 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 52.6 mtp180 -71.7 -41.59 68.43 Favored 'General case' 0 N--CA 1.474 0.759 0 C-N-CA 123.694 0.798 . . . . 75.25 109.643 176.668 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 109' ' ' LEU . . . . . 0.404 HD23 ' HB2' ' A' ' 65' ' ' ALA . 34.8 tp -66.73 -46.59 75.01 Favored 'General case' 0 C--N 1.351 0.635 0 O-C-N 124.248 0.968 . . . . 71.15 110.021 -179.471 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 33.8 t -66.07 -36.16 82.45 Favored 'General case' 0 CA--C 1.536 0.439 0 C-N-CA 124.221 1.008 . . . . 73.52 110.548 177.556 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . -77.84 -66.18 1.8 Allowed Glycine 0 C--N 1.36 1.878 0 C-N-CA 120.692 -0.766 . . . . 73.25 112.702 -176.728 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 112' ' ' MET . . . . . . . . . . . . . 41.7 mmm -99.13 -72.89 0.64 Allowed 'General case' 0 N--CA 1.481 1.101 0 CA-C-N 118.315 1.057 . . . . 72.32 111.647 172.524 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 113' ' ' LEU . . . . . 0.403 HD13 HG23 ' A' ' 115' ' ' VAL . 0.3 OUTLIER 171.4 33.27 0.0 OUTLIER 'General case' 0 N--CA 1.487 1.415 0 C-N-CA 125.85 1.66 . . . . 75.55 109.666 -178.66 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 11.5 tp 75.76 -10.99 1.18 Allowed 'General case' 0 N--CA 1.491 1.604 0 C-N-CA 125.242 1.417 . . . . 73.21 113.941 170.011 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 115' ' ' VAL . . . . . 0.533 HG21 ' HA ' ' A' ' 54' ' ' PRO . 60.8 t -73.49 -55.7 3.42 Favored Pre-proline 0 N--CA 1.486 1.368 0 CA-C-O 118.555 -0.736 . . . . 74.54 110.246 -177.347 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 116' ' ' PRO . . . . . 0.451 ' HD3' ' HB ' ' A' ' 115' ' ' VAL . 89.0 Cg_endo -85.67 161.57 10.75 Favored 'Trans proline' 0 C--N 1.38 2.207 0 CA-C-N 120.911 1.361 . . . . 63.23 111.225 169.925 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 5.3 p-10 -79.9 -30.16 40.02 Favored 'General case' 0 N--CA 1.475 0.803 0 CA-C-N 116.136 -0.484 . . . . 74.41 109.988 176.42 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -74.31 143.75 80.32 Favored Pre-proline 0 CA--C 1.552 1.027 0 C-N-CA 123.518 0.727 . . . . 42.14 110.524 176.919 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 119' ' ' PRO . . . . . . . . . . . . . 84.8 Cg_endo -76.87 -179.23 5.19 Favored 'Trans proline' 0 C--N 1.374 1.911 0 C-N-CA 122.714 2.276 . . . . 71.42 111.879 176.268 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . -174.01 -126.84 0.95 Allowed Glycine 0 C--N 1.336 0.565 0 N-CA-C 110.325 -1.11 . . . . 62.22 110.325 -178.97 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . -159.77 145.65 15.79 Favored 'General case' 0 N--CA 1.477 0.903 0 C-N-CA 123.541 0.736 . . . . 74.11 109.508 174.892 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 122' ' ' SER . . . . . . . . . . . . . 40.3 t . . . . . 0 CA--C 1.546 0.798 0 N-CA-C 107.957 -1.127 . . . . 62.02 107.957 -178.058 . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 25.0 ptm . . . . . 0 N--CA 1.485 1.28 0 N-CA-C 111.936 0.347 . . . . 71.42 111.936 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 28.6 m -62.69 -40.19 96.36 Favored 'General case' 0 N--CA 1.482 1.127 0 C-N-CA 122.931 0.492 . . . . 74.15 111.531 -176.111 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 14.3 m -65.59 -35.99 82.44 Favored 'General case' 0 N--CA 1.476 0.871 0 C-N-CA 122.964 0.505 . . . . 72.5 110.467 176.331 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 4' ' ' THR . . . . . 0.555 ' HA ' ' HG2' ' A' ' 53' ' ' PRO . 33.5 m -66.4 -50.0 64.93 Favored 'General case' 0 C--N 1.361 1.086 0 C-N-CA 123.602 0.761 . . . . 74.1 111.3 179.241 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 59.0 t -60.45 -40.02 82.91 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.084 0 C-N-CA 123.401 0.68 . . . . 73.34 110.022 179.173 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 6' ' ' GLU . . . . . 0.478 ' O ' ' HG3' ' A' ' 10' ' ' ARG . 0.2 OUTLIER -63.68 -41.42 98.15 Favored 'General case' 0 CA--C 1.548 0.895 0 CA-C-N 115.326 -0.852 . . . . 62.42 110.293 176.823 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 7' ' ' PHE . . . . . 0.598 ' HD1' HH11 ' A' ' 10' ' ' ARG . 39.4 t80 -69.44 -40.71 77.04 Favored 'General case' 0 N--CA 1.483 1.198 0 C-N-CA 123.968 0.907 . . . . 73.23 111.316 -176.665 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 8' ' ' ILE . . . . . 0.465 ' O ' ' HG3' ' A' ' 12' ' ' GLN . 76.7 mt -60.73 -42.48 92.26 Favored 'Isoleucine or valine' 0 C--N 1.353 0.733 0 N-CA-C 108.593 -0.892 . . . . 73.21 108.593 172.863 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 66.0 t30 -66.46 -27.62 67.95 Favored 'General case' 0 N--CA 1.475 0.823 0 O-C-N 124.354 1.034 . . . . 72.52 111.426 -179.835 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 10' ' ' ARG . . . . . 0.633 ' HB3' HG22 ' A' ' 47' ' ' VAL . 53.8 mtt180 -71.36 -39.02 71.54 Favored 'General case' 0 N--CA 1.475 0.802 0 C-N-CA 123.442 0.697 . . . . 74.23 110.764 174.465 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 11' ' ' TRP . . . . . 0.452 ' CD1' HG13 ' A' ' 64' ' ' VAL . 92.1 m95 -75.17 -24.18 57.84 Favored 'General case' 0 N--CA 1.477 0.875 0 CA-C-N 116.25 -0.432 . . . . 71.54 111.654 173.871 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 12' ' ' GLN . . . . . 0.504 ' HG2' ' CE2' ' A' ' 67' ' ' TYR . 55.7 mt-30 -68.59 -39.74 80.81 Favored 'General case' 0 N--CA 1.473 0.692 0 N-CA-C 108.743 -0.836 . . . . 65.52 108.743 170.11 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 22.4 tpt180 -60.19 -53.51 56.84 Favored 'General case' 0 CA--C 1.545 0.759 0 C-N-CA 124.174 0.99 . . . . 75.21 110.658 178.748 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 14' ' ' ILE . . . . . 0.477 HG22 ' OG1' ' A' ' 71' ' ' THR . 49.1 mt -66.32 -42.74 91.22 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.006 0 O-C-N 123.338 0.399 . . . . 71.54 110.45 -178.466 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 15' ' ' ALA . . . . . 0.598 ' HA ' ' HB ' ' A' ' 71' ' ' THR . . . -60.34 -48.04 83.46 Favored 'General case' 0 N--CA 1.486 1.337 0 C-N-CA 123.249 0.619 . . . . 43.12 112.1 -178.776 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 92.1 mt -70.11 -44.36 69.14 Favored 'General case' 0 N--CA 1.481 1.098 0 O-C-N 124.304 1.003 . . . . 72.32 110.856 -175.985 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.495 ' O ' ' HG ' ' A' ' 21' ' ' LEU . 49.3 mt -62.62 -53.43 54.68 Favored 'General case' 0 C--N 1.354 0.799 0 O-C-N 123.606 0.566 . . . . 72.22 110.527 179.982 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 94.9 p -60.8 -37.84 83.31 Favored 'General case' 0 N--CA 1.479 0.975 0 C-N-CA 123.338 0.655 . . . . 44.15 111.432 -178.51 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 29.8 tp60 -62.65 -48.11 80.78 Favored 'General case' 0 C--N 1.36 1.025 0 O-C-N 123.939 0.775 . . . . 71.45 110.348 177.699 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 20' ' ' SER . . . . . 0.407 ' O ' ' HG ' ' A' ' 24' ' ' LEU . 65.2 m -58.91 -49.04 79.29 Favored 'General case' 0 C--O 1.213 -0.855 0 O-C-N 123.944 0.777 . . . . 41.4 110.3 176.405 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 21' ' ' LEU . . . . . 0.587 HD22 ' HA ' ' A' ' 33' ' ' LEU . 79.7 mt -64.43 -31.33 72.5 Favored 'General case' 0 N--CA 1.475 0.807 0 C-N-CA 123.93 0.892 . . . . 71.24 111.28 -176.471 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.603 ' HA ' HD21 ' A' ' 78' ' ' LEU . 69.9 tp -67.42 -55.42 13.74 Favored 'General case' 0 C--N 1.353 0.738 0 C-N-CA 123.191 0.596 . . . . 54.43 109.766 176.996 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 45.5 mt-10 -55.05 -50.69 68.47 Favored 'General case' 0 C--N 1.352 0.689 0 O-C-N 124.635 1.209 . . . . 70.3 110.549 179.933 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.487 ' HB3' ' HB2' ' A' ' 29' ' ' GLU . 93.7 mt -63.38 -36.22 82.98 Favored 'General case' 0 CA--C 1.544 0.736 0 C-N-CA 124.508 1.123 . . . . 71.33 111.251 -177.46 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -63.9 -41.16 97.77 Favored 'General case' 0 N--CA 1.485 1.277 0 C-N-CA 122.87 0.468 . . . . 73.24 111.279 174.948 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 86.3 mt-30 -71.41 -23.38 61.86 Favored 'General case' 0 N--CA 1.483 1.195 0 C-N-CA 123.892 0.877 . . . . 73.32 111.289 177.958 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 89.0 mtt180 -91.98 -11.59 35.66 Favored 'General case' 0 N--CA 1.481 1.113 0 C-N-CA 123.943 0.897 . . . . 75.32 111.685 176.649 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 88.21 6.98 73.95 Favored Glycine 0 C--N 1.349 1.284 0 CA-C-O 119.924 -0.375 . . . . 73.11 113.941 178.549 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 29' ' ' GLU . . . . . 0.487 ' HB2' ' HB3' ' A' ' 24' ' ' LEU . 44.2 mm-40 -79.01 55.91 1.87 Allowed 'General case' 0 N--CA 1.484 1.23 0 C-N-CA 124.805 1.242 . . . . 65.42 111.643 176.424 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 30' ' ' TRP . . . . . 0.624 ' HH2' HD22 ' A' ' 81' ' ' LEU . 93.8 m95 -64.17 -27.51 69.12 Favored 'General case' 0 N--CA 1.481 1.08 0 C-N-CA 124.162 0.985 . . . . 54.32 111.904 -177.492 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 4.9 m-20 -56.94 -47.86 79.67 Favored 'General case' 0 CA--C 1.539 0.536 0 C-N-CA 124.12 0.968 . . . . 70.02 110.353 176.275 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 98.4 mt -64.84 -26.8 68.49 Favored 'General case' 0 CA--C 1.546 0.826 0 CA-C-N 115.574 -0.739 . . . . 74.41 111.204 179.983 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 33' ' ' LEU . . . . . 0.587 ' HA ' HD22 ' A' ' 21' ' ' LEU . 9.8 mp -68.93 -39.63 79.5 Favored 'General case' 0 N--CA 1.484 1.249 0 C-N-CA 122.465 0.306 . . . . 73.0 110.458 171.34 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.42 ' HG ' ' O ' ' A' ' 30' ' ' TRP . 75.7 mt -66.69 -37.92 85.71 Favored 'General case' 0 N--CA 1.487 1.385 0 O-C-N 123.585 0.553 . . . . 65.24 111.975 -179.681 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 1.3 mp0 -71.67 -49.19 42.0 Favored 'General case' 0 N--CA 1.485 1.315 0 C-N-CA 122.638 0.375 . . . . 74.34 110.957 177.598 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 36' ' ' GLN . . . . . 0.476 ' HB2' HD21 ' A' ' 21' ' ' LEU . 87.4 mm-40 -74.42 -13.44 60.72 Favored 'General case' 0 N--CA 1.478 0.955 0 C-N-CA 123.22 0.608 . . . . 72.23 111.96 -179.563 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 37' ' ' GLU . . . . . 0.512 ' O ' ' HG ' ' A' ' 41' ' ' LEU . 32.4 tt0 -48.51 -61.14 2.17 Favored 'General case' 0 N--CA 1.486 1.332 0 C-N-CA 124.672 1.189 . . . . 72.42 111.885 177.584 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 66.0 t -53.55 -46.27 59.91 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.346 0 O-C-N 124.322 1.014 . . . . 73.23 111.235 -176.517 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 44.6 m -65.66 -38.51 89.51 Favored 'General case' 0 CA--C 1.544 0.748 0 CA-C-N 114.99 -1.005 . . . . 54.45 111.727 179.818 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 40' ' ' TYR . . . . . 0.414 ' O ' HG22 ' A' ' 44' ' ' ILE . 40.0 t80 -69.29 -46.08 68.04 Favored 'General case' 0 N--CA 1.476 0.87 0 C-N-CA 123.056 0.542 . . . . 73.21 110.564 -177.758 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 41' ' ' LEU . . . . . 0.512 ' HG ' ' O ' ' A' ' 37' ' ' GLU . 49.9 mt -55.75 -51.79 66.15 Favored 'General case' 0 C--N 1.355 0.829 0 O-C-N 124.673 1.233 . . . . 63.2 109.81 177.382 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 50.1 tt0 -54.54 -48.02 72.48 Favored 'General case' 0 C--N 1.355 0.812 0 CA-C-N 114.62 -1.173 . . . . 45.23 111.017 179.404 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 43' ' ' SER . . . . . 0.54 ' O ' HG23 ' A' ' 47' ' ' VAL . 67.5 m -59.03 -62.18 2.08 Favored 'General case' 0 C--N 1.349 0.552 0 O-C-N 124.057 0.848 . . . . 74.35 111.307 -177.721 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 44' ' ' ILE . . . . . 0.414 HG22 ' O ' ' A' ' 40' ' ' TYR . 14.6 tt -64.52 -34.78 71.84 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.955 0 O-C-N 123.571 0.544 . . . . 72.0 111.628 -171.46 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 45' ' ' GLU . . . . . 0.538 ' HG2' HD22 ' A' ' 92' ' ' LEU . 17.6 mm-40 -58.93 -53.02 63.15 Favored 'General case' 0 N--CA 1.484 1.237 0 C-N-CA 122.663 0.385 . . . . 70.03 110.539 171.947 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 87.2 m -56.43 -40.31 74.54 Favored 'General case' 0 C--N 1.358 0.949 0 C-N-CA 123.502 0.721 . . . . 71.01 111.486 -178.654 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 47' ' ' VAL . . . . . 0.633 HG22 ' HB3' ' A' ' 10' ' ' ARG . 44.9 t -70.36 -41.22 78.43 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.078 0 C-N-CA 123.406 0.682 . . . . 73.33 111.293 -177.055 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 48' ' ' MET . . . . . . . . . . . . . 77.3 mtm -71.34 -30.8 66.62 Favored 'General case' 0 N--CA 1.486 1.361 0 C-N-CA 122.505 0.322 . . . . 75.32 111.667 179.519 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 62.3 mt-10 -82.57 -8.3 59.61 Favored 'General case' 0 N--CA 1.482 1.167 0 C-N-CA 123.314 0.646 . . . . 73.33 111.334 176.332 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -90.41 139.9 30.23 Favored 'General case' 0 N--CA 1.469 0.502 0 C-N-CA 123.002 0.521 . . . . 72.24 110.407 -176.002 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 7.7 tt0 -68.78 140.97 55.31 Favored 'General case' 0 CA--C 1.537 0.477 0 C-N-CA 124.172 0.989 . . . . 74.21 109.893 174.784 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 52' ' ' THR . . . . . 0.433 ' HA ' ' HD3' ' A' ' 53' ' ' PRO . 25.2 m -83.76 128.18 64.5 Favored Pre-proline 0 CA--C 1.547 0.844 0 N-CA-C 109.548 -0.538 . . . . 63.4 109.548 174.709 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 53' ' ' PRO . . . . . 0.555 ' HG2' ' HA ' ' A' ' 4' ' ' THR . 25.7 Cg_exo -65.57 155.07 70.89 Favored 'Trans proline' 0 C--N 1.376 1.99 0 C-N-CA 123.086 2.524 . . . . 52.02 113.548 -179.422 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 54' ' ' PRO . . . . . 0.485 ' HA ' HD11 ' A' ' 113' ' ' LEU . 37.9 Cg_endo -66.1 -47.46 3.47 Favored 'Trans proline' 0 C--N 1.382 2.292 0 C-N-CA 123.165 2.577 . . . . 73.43 112.687 176.736 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . -75.34 78.89 1.09 Allowed Glycine 0 C--N 1.343 0.938 0 O-C-N 123.748 0.655 . . . . 72.2 113.882 -172.824 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 65.4 mt -116.88 117.16 54.49 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.651 0 N-CA-C 108.134 -1.062 . . . . 72.14 108.134 173.99 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 62.8 p -95.92 -168.05 1.69 Allowed 'General case' 0 N--CA 1.476 0.866 0 C-N-CA 123.663 0.785 . . . . 75.11 110.024 179.11 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 32.5 tpt180 -58.82 -63.76 1.18 Allowed 'General case' 0 C--N 1.355 0.819 0 C-N-CA 124.025 0.93 . . . . 72.21 110.271 175.355 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 13.1 m -59.84 -38.04 80.94 Favored 'General case' 0 C--N 1.353 0.73 0 O-C-N 123.989 0.805 . . . . 53.42 111.655 -175.111 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 60' ' ' ILE . . . . . 0.485 HD13 HG21 ' A' ' 4' ' ' THR . 94.5 mt -61.62 -48.79 87.11 Favored 'Isoleucine or valine' 0 C--N 1.357 0.923 0 O-C-N 123.833 0.708 . . . . 75.44 110.28 176.71 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 49.8 tt0 -59.26 -41.69 89.41 Favored 'General case' 0 N--CA 1.479 1.022 0 C-N-CA 123.259 0.623 . . . . 75.34 111.261 -179.211 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 23.6 m-20 -74.04 -32.81 63.5 Favored 'General case' 0 N--CA 1.476 0.833 0 N-CA-C 112.297 0.48 . . . . 63.44 112.297 -178.54 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 63' ' ' MET . . . . . . . . . . . . . 67.8 mtm -71.51 -43.55 66.29 Favored 'General case' 0 N--CA 1.486 1.374 0 CA-C-N 118.194 0.452 . . . . 74.21 110.432 177.408 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 64' ' ' VAL . . . . . 0.483 ' O ' HG13 ' A' ' 68' ' ' ILE . 78.9 t -63.65 -61.64 1.58 Allowed 'Isoleucine or valine' 0 CA--C 1.54 0.576 0 O-C-N 123.936 0.772 . . . . 73.42 109.443 177.68 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -63.26 -26.45 68.79 Favored 'General case' 0 N--CA 1.485 1.287 0 C-N-CA 123.433 0.693 . . . . 31.31 112.442 -179.201 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -66.17 -46.69 78.11 Favored Glycine 0 C--N 1.343 0.958 0 N-CA-C 111.581 -0.607 . . . . 40.43 111.581 174.797 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 67' ' ' TYR . . . . . 0.504 ' CE2' ' HG2' ' A' ' 12' ' ' GLN . 12.6 m-30 -77.15 -23.17 51.67 Favored 'General case' 0 N--CA 1.468 0.446 0 CA-C-O 118.8 -0.619 . . . . 65.24 112.12 178.095 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 68' ' ' ILE . . . . . 0.483 HG13 ' O ' ' A' ' 64' ' ' VAL . 49.4 mt -68.96 -53.68 24.72 Favored 'Isoleucine or valine' 0 C--N 1.363 1.156 0 N-CA-C 108.04 -1.096 . . . . 73.24 108.04 172.472 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 69' ' ' LYS . . . . . 0.511 ' HB2' ' HE2' ' A' ' 106' ' ' TYR . 49.9 tptt -54.14 -46.18 72.15 Favored 'General case' 0 N--CA 1.487 1.394 0 C-N-CA 123.641 0.776 . . . . 75.43 110.962 178.106 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 62.9 tt0 -57.84 -50.2 74.09 Favored 'General case' 0 CA--C 1.537 0.456 0 O-C-N 124.3 1.0 . . . . 72.35 109.99 179.532 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 71' ' ' THR . . . . . 0.598 ' HB ' ' HA ' ' A' ' 15' ' ' ALA . 11.5 t -74.16 -20.44 60.22 Favored 'General case' 0 C--O 1.207 -1.179 0 CA-C-O 118.539 -0.743 . . . . 71.3 111.632 -178.818 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 72' ' ' LEU . . . . . 0.56 HD21 ' HB3' ' A' ' 102' ' ' LEU . 17.9 mt -70.15 -40.04 74.98 Favored 'General case' 0 N--CA 1.484 1.237 0 CA-C-N 118.622 0.646 . . . . 73.22 109.436 175.464 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 71.5 m-20 -66.88 -52.54 42.17 Favored 'General case' 0 C--N 1.342 0.266 0 O-C-N 123.898 0.749 . . . . 62.23 109.799 178.808 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 74' ' ' ASN . . . . . 0.518 ' HA ' HD22 ' A' ' 22' ' ' LEU . 53.9 m-20 -58.04 -50.45 73.39 Favored 'General case' 0 N--CA 1.479 1.025 0 C-N-CA 123.661 0.785 . . . . 73.24 110.932 -179.523 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 75' ' ' GLU . . . . . 0.495 ' O ' ' HG2' ' A' ' 79' ' ' LYS . 4.8 tp10 -57.35 -60.2 3.99 Favored 'General case' 0 N--CA 1.473 0.724 0 C-N-CA 124.162 0.985 . . . . 72.32 110.564 179.674 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 7.8 tt0 -61.29 -35.48 77.45 Favored 'General case' 0 N--CA 1.479 1.002 0 C-N-CA 123.985 0.914 . . . . 71.21 111.658 -171.525 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 77' ' ' LEU . . . . . 0.418 ' O ' ' HB2' ' A' ' 81' ' ' LEU . 63.5 mt -60.35 -51.29 70.13 Favored 'General case' 0 C--N 1.357 0.902 0 O-C-N 123.862 0.726 . . . . 74.14 109.426 173.579 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 78' ' ' LEU . . . . . 0.603 HD21 ' HA ' ' A' ' 22' ' ' LEU . 75.6 mt -59.03 -39.4 81.83 Favored 'General case' 0 N--CA 1.484 1.246 0 O-C-N 123.765 0.666 . . . . 74.24 112.45 177.952 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 79' ' ' LYS . . . . . 0.495 ' HG2' ' O ' ' A' ' 75' ' ' GLU . 7.8 mmpt? -65.5 -40.19 92.76 Favored 'General case' 0 CA--C 1.546 0.802 0 N-CA-C 109.618 -0.512 . . . . 70.24 109.618 -178.079 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -85.5 -8.87 79.99 Favored Glycine 0 C--N 1.349 1.257 0 CA-C-N 115.347 -0.842 . . . . 61.22 113.586 176.291 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 81' ' ' LEU . . . . . 0.624 HD22 ' HH2' ' A' ' 30' ' ' TRP . 2.5 tt -81.99 -41.85 20.18 Favored 'General case' 0 N--CA 1.479 0.996 0 C-N-CA 123.114 0.565 . . . . 72.55 109.635 178.693 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 82' ' ' LEU . . . . . 0.452 ' HB2' ' HB2' ' A' ' 87' ' ' ASP . 97.1 mt -57.78 -63.33 1.28 Allowed 'General case' 0 N--CA 1.482 1.144 0 N-CA-C 112.68 0.622 . . . . 70.23 112.68 -173.976 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 43.0 mt-30 -135.59 29.83 3.21 Favored 'General case' 0 N--CA 1.496 1.838 0 C-N-CA 122.663 0.385 . . . . 74.45 111.0 -179.625 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 6.1 tp-100 71.17 16.28 6.3 Favored 'General case' 0 N--CA 1.492 1.654 0 C-N-CA 124.328 1.051 . . . . 74.51 113.05 169.499 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 85' ' ' ARG . . . . . . . . . . . . . 65.8 mtp85 -129.25 -120.61 0.23 Allowed 'General case' 0 N--CA 1.487 1.396 0 O-C-N 121.593 -0.692 . . . . 72.41 110.595 -178.02 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 91.2 mt -133.81 55.37 1.9 Allowed 'General case' 0 N--CA 1.478 0.949 0 N-CA-C 107.676 -1.231 . . . . 64.42 107.676 178.797 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 87' ' ' ASP . . . . . 0.452 ' HB2' ' HB2' ' A' ' 82' ' ' LEU . 6.2 m-20 -78.93 167.64 20.84 Favored 'General case' 0 N--CA 1.472 0.65 0 CA-C-N 113.36 -1.746 . . . . 70.43 111.19 -173.736 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 88' ' ' GLU . . . . . 0.42 ' HG3' ' H ' ' A' ' 90' ' ' SER . 14.4 tp10 -136.48 147.18 47.03 Favored 'General case' 0 N--CA 1.485 1.324 0 N-CA-C 109.315 -0.624 . . . . 65.32 109.315 179.556 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 98.1 mt -55.02 -38.86 68.46 Favored 'General case' 0 C--N 1.358 0.954 0 O-C-N 124.248 0.967 . . . . 74.33 110.688 177.611 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 90' ' ' SER . . . . . 0.42 ' H ' ' HG3' ' A' ' 88' ' ' GLU . 23.0 t -137.39 -124.01 0.14 Allowed 'General case' 0 CA--C 1.549 0.938 0 N-CA-C 107.738 -1.208 . . . . 64.5 107.738 175.599 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 71.1 m -145.31 141.53 28.62 Favored 'General case' 0 N--CA 1.473 0.717 0 CA-C-N 119.263 0.938 . . . . 75.32 109.637 170.963 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 92' ' ' LEU . . . . . 0.538 HD22 ' HG2' ' A' ' 45' ' ' GLU . 20.8 mt -97.91 -134.03 0.24 Allowed 'General case' 0 N--CA 1.474 0.767 0 C-N-CA 123.808 0.843 . . . . 71.43 109.003 173.55 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 65.3 mt -42.52 -48.24 1.1 Allowed 'Isoleucine or valine' 0 C--N 1.367 1.368 0 C-N-CA 124.151 0.98 . . . . 65.22 110.341 167.915 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 169.87 -133.97 3.0 Favored Glycine 0 C--N 1.344 1.009 0 CA-C-N 115.534 -0.757 . . . . 23.21 111.424 171.211 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -69.91 154.72 41.59 Favored 'General case' 0 CA--C 1.548 0.871 0 C-N-CA 123.077 0.551 . . . . 70.53 110.919 173.493 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 19.6 m 66.12 -82.91 0.03 OUTLIER 'General case' 0 N--CA 1.48 1.068 0 C-N-CA 125.15 1.38 . . . . 73.34 110.749 -175.766 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 97' ' ' THR . . . . . 0.462 ' HB ' ' HD3' ' A' ' 98' ' ' ARG . 28.6 m 47.02 -82.35 0.01 OUTLIER 'General case' 0 CA--C 1.553 1.072 0 C-N-CA 126.23 1.812 . . . . 55.2 114.795 175.676 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 98' ' ' ARG . . . . . 0.606 ' H ' ' HD3' ' A' ' 98' ' ' ARG . 0.8 OUTLIER -57.48 -56.44 21.79 Favored 'General case' 0 N--CA 1.477 0.919 0 C-N-CA 124.593 1.157 . . . . 74.41 111.539 -164.993 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 51.3 tt0 -61.28 -54.89 38.27 Favored 'General case' 0 CA--C 1.539 0.547 0 CA-C-N 114.672 -1.149 . . . . 64.21 110.596 -174.142 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 87.9 tttt -64.99 -53.65 42.85 Favored 'General case' 0 N--CA 1.476 0.854 0 O-C-N 123.719 0.637 . . . . 73.22 111.704 -176.034 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 44.8 t -57.48 -49.26 76.87 Favored 'General case' 0 N--CA 1.478 0.938 0 C-N-CA 123.773 0.829 . . . . 72.33 111.772 -174.747 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 102' ' ' LEU . . . . . 0.56 ' HB3' HD21 ' A' ' 72' ' ' LEU . 9.4 mp -77.49 -27.03 51.78 Favored 'General case' 0 CA--C 1.556 1.187 0 O-C-N 123.586 0.554 . . . . 62.55 111.55 -176.203 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 24.9 t-20 -70.1 -41.35 74.12 Favored 'General case' 0 N--CA 1.49 1.574 0 C-N-CA 122.64 0.376 . . . . 74.12 111.119 173.946 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 3.8 m-20 -68.89 -41.22 78.59 Favored 'General case' 0 N--CA 1.476 0.871 0 C-N-CA 123.536 0.734 . . . . 71.3 109.194 178.035 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -60.08 -40.11 88.42 Favored 'General case' 0 C--N 1.352 0.694 0 O-C-N 124.07 0.856 . . . . 40.4 110.478 176.284 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 106' ' ' TYR . . . . . 0.511 ' HE2' ' HB2' ' A' ' 69' ' ' LYS . 4.6 t80 -64.2 -49.5 71.76 Favored 'General case' 0 N--CA 1.475 0.784 0 C-N-CA 123.695 0.798 . . . . 73.24 110.596 178.278 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -63.96 -40.49 98.31 Favored Glycine 0 C--N 1.353 1.513 0 O-C-N 123.431 0.457 . . . . 31.44 113.019 -175.65 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 93.8 mtt180 -74.49 -30.22 61.74 Favored 'General case' 0 N--CA 1.469 0.49 0 C-N-CA 123.446 0.698 . . . . 72.4 110.603 178.239 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 52.4 tp -64.17 -45.06 90.09 Favored 'General case' 0 N--CA 1.484 1.238 0 C-N-CA 123.368 0.667 . . . . 75.21 110.272 173.895 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 39.8 t -63.0 -48.75 77.47 Favored 'General case' 0 CA--C 1.538 0.484 0 O-C-N 124.558 1.161 . . . . 63.35 110.149 -179.521 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . -81.22 -61.45 2.1 Favored Glycine 0 C--N 1.349 1.295 0 C-N-CA 121.243 -0.503 . . . . 62.03 113.515 -176.565 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 112' ' ' MET . . . . . . . . . . . . . 64.6 mmm -93.44 -65.72 0.97 Allowed 'General case' 0 N--CA 1.484 1.271 0 N-CA-C 114.127 1.158 . . . . 72.04 114.127 -173.351 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 113' ' ' LEU . . . . . 0.485 HD11 ' HA ' ' A' ' 54' ' ' PRO . 5.8 tt 179.94 -36.29 0.01 OUTLIER 'General case' 0 N--CA 1.474 0.771 0 C-N-CA 124.099 0.96 . . . . 74.11 108.517 -168.947 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 114' ' ' LEU . . . . . 0.442 ' HB2' ' O ' ' A' ' 113' ' ' LEU . 3.5 tt 147.84 -16.08 0.0 OUTLIER 'General case' 0 N--CA 1.498 1.936 0 C-N-CA 129.263 3.025 . . . . 63.12 106.367 178.284 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 115' ' ' VAL . . . . . . . . . . . . . 23.6 m -74.32 137.96 75.03 Favored Pre-proline 0 CA--C 1.551 1.012 0 CA-C-N 115.247 -0.888 . . . . 75.44 110.423 179.231 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 3.4 Cg_exo -74.81 122.53 7.35 Favored 'Trans proline' 0 C--N 1.377 2.047 0 C-N-CA 122.557 2.171 . . . . 62.41 110.828 176.428 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 14.1 t70 -133.92 -68.56 0.56 Allowed 'General case' 0 N--CA 1.475 0.802 0 N-CA-C 107.383 -1.34 . . . . 61.05 107.383 -179.826 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -116.24 115.35 40.4 Favored Pre-proline 0 C--O 1.239 0.541 0 N-CA-C 107.766 -1.198 . . . . 71.52 107.766 169.822 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 119' ' ' PRO . . . . . . . . . . . . . 31.2 Cg_endo -62.3 -29.92 80.51 Favored 'Trans proline' 0 C--N 1.372 1.804 0 C-N-CA 122.45 2.1 . . . . 75.01 112.102 173.605 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . 167.9 165.85 25.99 Favored Glycine 0 C--N 1.348 1.216 0 N-CA-C 111.848 -0.501 . . . . 72.2 111.848 177.287 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . -156.9 100.58 1.9 Allowed 'General case' 0 N--CA 1.475 0.8 0 C-N-CA 123.733 0.813 . . . . 73.45 109.807 178.759 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 122' ' ' SER . . . . . . . . . . . . . 29.3 t . . . . . 0 CA--C 1.553 1.079 0 N-CA-C 108.396 -0.964 . . . . 73.31 108.396 176.625 . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 22.1 ttt . . . . . 0 N--CA 1.485 1.313 0 CA-C-O 119.628 -0.225 . . . . 65.42 110.777 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 36.8 p -52.36 -45.84 65.91 Favored 'General case' 0 N--CA 1.487 1.378 0 C-N-CA 123.736 0.815 . . . . 75.34 112.394 -175.221 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 17.4 m -67.81 -33.47 74.87 Favored 'General case' 0 CA--C 1.552 1.051 0 C-N-CA 123.46 0.704 . . . . 73.1 111.497 -178.547 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 4' ' ' THR . . . . . 0.545 HG21 HD13 ' A' ' 60' ' ' ILE . 60.2 m -70.94 -41.18 71.49 Favored 'General case' 0 N--CA 1.475 0.793 0 C-N-CA 123.705 0.802 . . . . 23.31 110.739 177.536 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 95.5 t -66.67 -37.56 79.78 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.835 0 C-N-CA 123.353 0.661 . . . . 70.21 109.62 -179.168 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 6' ' ' GLU . . . . . 0.401 ' O ' ' HG3' ' A' ' 10' ' ' ARG . 57.2 mt-10 -62.49 -48.69 78.46 Favored 'General case' 0 C--N 1.356 0.861 0 O-C-N 123.727 0.642 . . . . 43.41 110.242 171.344 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 30.4 t80 -61.34 -46.17 91.36 Favored 'General case' 0 N--CA 1.481 1.102 0 C-N-CA 124.268 1.027 . . . . 63.21 111.249 -174.086 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 82.9 mt -65.57 -41.31 90.49 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.785 0 C-N-CA 123.789 0.835 . . . . 70.41 109.741 176.208 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 3.7 t-20 -65.6 -28.17 68.94 Favored 'General case' 0 N--CA 1.484 1.26 0 C-N-CA 123.02 0.528 . . . . 61.41 111.426 179.452 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 10' ' ' ARG . . . . . 0.425 ' HD3' HG22 ' A' ' 47' ' ' VAL . 62.4 mtt85 -70.11 -46.9 63.84 Favored 'General case' 0 C--O 1.224 -0.244 0 N-CA-C 109.168 -0.679 . . . . 74.0 109.168 174.504 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 11' ' ' TRP . . . . . 0.432 ' CD1' HG13 ' A' ' 64' ' ' VAL . 91.1 m95 -68.86 -20.96 64.29 Favored 'General case' 0 N--CA 1.478 0.935 0 O-C-N 123.385 0.428 . . . . 62.0 111.818 175.731 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 53.9 mt-30 -65.97 -52.19 51.72 Favored 'General case' 0 N--CA 1.477 0.921 0 N-CA-C 108.016 -1.105 . . . . 73.41 108.016 169.323 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 14.8 tpt180 -55.61 -44.86 77.44 Favored 'General case' 0 CA--C 1.547 0.856 0 O-C-N 124.267 0.98 . . . . 73.13 111.224 -179.368 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 14' ' ' ILE . . . . . 0.634 HD11 HG21 ' A' ' 47' ' ' VAL . 77.8 mt -70.41 -50.25 47.3 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.81 0 C-N-CA 123.775 0.83 . . . . 72.45 111.096 -177.011 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -58.54 -44.57 89.66 Favored 'General case' 0 N--CA 1.485 1.275 0 C-N-CA 123.688 0.795 . . . . 73.14 111.263 -178.8 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 95.1 mt -71.92 -43.58 65.09 Favored 'General case' 0 N--CA 1.475 0.821 0 CA-C-N 114.514 -1.221 . . . . 63.14 110.918 -177.879 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.427 ' O ' ' HG ' ' A' ' 21' ' ' LEU . 17.7 mt -63.1 -44.59 95.26 Favored 'General case' 0 N--CA 1.487 1.396 0 CA-C-O 119.227 -0.416 . . . . 64.45 110.992 178.772 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 81.0 p -65.08 -39.58 93.41 Favored 'General case' 0 N--CA 1.474 0.773 0 C-N-CA 123.006 0.522 . . . . 54.03 110.667 -178.961 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 24.7 tp60 -59.66 -47.98 83.46 Favored 'General case' 0 C--N 1.359 1.014 0 O-C-N 123.894 0.746 . . . . 73.21 110.33 174.47 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 68.1 m -58.37 -52.94 63.51 Favored 'General case' 0 C--O 1.208 -1.116 0 CA-C-N 115.456 -0.793 . . . . 61.2 110.481 177.701 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 21' ' ' LEU . . . . . 0.566 HD22 ' HA ' ' A' ' 33' ' ' LEU . 89.1 mt -65.92 -24.71 66.88 Favored 'General case' 0 N--CA 1.474 0.736 0 C-N-CA 124.197 0.999 . . . . 60.11 111.486 -175.145 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.691 ' HA ' HD21 ' A' ' 78' ' ' LEU . 57.4 tp -69.88 -53.81 16.34 Favored 'General case' 0 C--N 1.356 0.873 0 N-CA-C 109.814 -0.439 . . . . 75.43 109.814 174.357 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 23' ' ' GLU . . . . . 0.408 ' O ' ' HG3' ' A' ' 27' ' ' ARG . 40.8 mt-10 -57.27 -49.94 74.47 Favored 'General case' 0 N--CA 1.48 1.067 0 O-C-N 123.968 0.792 . . . . 74.11 110.161 178.628 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.53 ' HB3' ' HB2' ' A' ' 29' ' ' GLU . 95.0 mt -59.4 -42.23 91.27 Favored 'General case' 0 CA--C 1.536 0.438 0 C-N-CA 125.244 1.418 . . . . 71.22 110.878 -178.218 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 25' ' ' ALA . . . . . 0.64 ' HB2' HD21 ' A' ' 33' ' ' LEU . . . -58.73 -48.62 80.52 Favored 'General case' 0 N--CA 1.48 1.032 0 C-N-CA 122.613 0.365 . . . . 64.11 110.753 175.78 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 96.1 mt-30 -63.04 -30.25 71.45 Favored 'General case' 0 CA--C 1.55 0.945 0 O-C-N 124.063 0.852 . . . . 61.23 111.407 -179.591 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 27' ' ' ARG . . . . . 0.408 ' HG3' ' O ' ' A' ' 23' ' ' GLU . 90.4 mtt180 -78.83 -28.05 44.36 Favored 'General case' 0 N--CA 1.483 1.207 0 C-N-CA 123.688 0.795 . . . . 74.22 111.082 178.216 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 98.73 22.53 13.66 Favored Glycine 0 C--N 1.352 1.436 0 C-N-CA 123.117 0.389 . . . . 44.11 113.603 -176.493 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 29' ' ' GLU . . . . . 0.53 ' HB2' ' HB3' ' A' ' 24' ' ' LEU . 14.8 mm-40 -86.52 54.27 3.1 Favored 'General case' 0 CA--C 1.552 1.044 0 C-N-CA 125.04 1.336 . . . . 74.44 110.396 177.72 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 30' ' ' TRP . . . . . 0.517 ' HH2' HD21 ' A' ' 81' ' ' LEU . 57.2 m95 -59.49 -33.84 71.84 Favored 'General case' 0 N--CA 1.486 1.34 0 C-N-CA 124.257 1.023 . . . . 71.22 112.009 -171.952 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 3.7 m-20 -58.62 -41.42 85.88 Favored 'General case' 0 N--CA 1.474 0.736 0 C-N-CA 124.462 1.105 . . . . 75.24 110.697 -178.407 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 86.0 mt -69.78 -31.83 69.99 Favored 'General case' 0 N--CA 1.472 0.647 0 CA-C-N 115.141 -0.936 . . . . 63.13 110.955 -177.369 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 33' ' ' LEU . . . . . 0.64 HD21 ' HB2' ' A' ' 25' ' ' ALA . 10.1 mp -67.71 -43.94 78.85 Favored 'General case' 0 N--CA 1.482 1.146 0 C-N-CA 122.934 0.494 . . . . 75.24 110.466 174.35 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.421 ' HG ' ' O ' ' A' ' 30' ' ' TRP . 73.1 mt -67.07 -37.58 84.25 Favored 'General case' 0 N--CA 1.484 1.238 0 O-C-N 123.606 0.566 . . . . 61.32 111.767 -177.53 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 98.5 mt-30 -70.91 -54.1 12.64 Favored 'General case' 0 N--CA 1.477 0.889 0 C-N-CA 123.025 0.53 . . . . 53.51 110.172 177.969 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 83.6 mm-40 -68.34 -16.45 63.94 Favored 'General case' 0 N--CA 1.474 0.741 0 CA-C-O 118.484 -0.769 . . . . 74.13 112.382 -178.622 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 33.3 tt0 -50.39 -46.3 56.01 Favored 'General case' 0 N--CA 1.48 1.068 0 C-N-CA 123.306 0.642 . . . . 74.51 111.348 176.947 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 60.5 t -62.32 -55.67 22.51 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.752 0 C-N-CA 123.336 0.655 . . . . 55.2 111.403 -176.022 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 29.4 p -68.52 -39.62 81.11 Favored 'General case' 0 N--CA 1.478 0.95 0 C-N-CA 123.614 0.766 . . . . 63.01 111.675 -175.957 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 45.6 t80 -64.83 -49.31 71.12 Favored 'General case' 0 N--CA 1.477 0.92 0 C-N-CA 124.189 0.996 . . . . 72.34 111.063 -177.412 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 41' ' ' LEU . . . . . 0.562 ' HA ' HG22 ' A' ' 44' ' ' ILE . 86.8 mt -72.77 -34.09 66.73 Favored 'General case' 0 C--O 1.243 0.76 0 O-C-N 123.721 0.638 . . . . 71.33 111.066 -178.566 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 53.2 tt0 -57.36 -51.85 67.72 Favored 'General case' 0 C--N 1.353 0.736 0 O-C-N 123.666 0.604 . . . . 73.34 109.513 173.625 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 43' ' ' SER . . . . . 0.594 ' O ' HG23 ' A' ' 47' ' ' VAL . 69.0 m -56.94 -56.39 22.31 Favored 'General case' 0 C--N 1.351 0.664 0 O-C-N 124.479 1.112 . . . . 63.15 110.423 179.865 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 44' ' ' ILE . . . . . 0.607 HG13 HD13 ' A' ' 14' ' ' ILE . 14.3 tt -62.61 -38.54 81.78 Favored 'Isoleucine or valine' 0 C--O 1.252 1.236 0 C-N-CA 123.553 0.741 . . . . 54.03 112.205 -168.687 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 31.9 mm-40 -69.62 -37.78 76.97 Favored 'General case' 0 C--N 1.359 0.993 0 O-C-N 123.114 0.258 . . . . 62.24 110.508 174.819 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 87.6 m -65.46 -28.4 69.19 Favored 'General case' 0 CA--C 1.557 1.214 0 C-N-CA 123.44 0.696 . . . . 61.42 111.762 176.166 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 47' ' ' VAL . . . . . 0.634 HG21 HD11 ' A' ' 14' ' ' ILE . 12.9 t -77.23 -42.45 31.09 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.396 0 O-C-N 122.086 -0.384 . . . . 75.05 110.074 179.123 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 48' ' ' MET . . . . . . . . . . . . . 74.3 mtm -74.43 -13.63 60.74 Favored 'General case' 0 N--CA 1.482 1.135 0 CA-C-N 116.294 -0.412 . . . . 73.53 110.936 173.927 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 15.8 tp10 -80.47 -35.21 35.18 Favored 'General case' 0 N--CA 1.477 0.877 0 C-N-CA 123.457 0.703 . . . . 53.25 109.649 169.171 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 13.9 mptt -70.52 123.58 22.15 Favored 'General case' 0 N--CA 1.472 0.649 0 N-CA-C 109.156 -0.683 . . . . 64.2 109.156 175.611 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 8.8 tt0 -62.71 150.46 41.07 Favored 'General case' 0 C--O 1.242 0.672 0 CA-C-N 115.049 -0.978 . . . . 72.31 110.289 178.316 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 52' ' ' THR . . . . . 0.424 HG21 ' HG ' ' A' ' 113' ' ' LEU . 11.3 m -58.56 116.23 14.45 Favored Pre-proline 0 CA--C 1.552 1.037 0 N-CA-C 109.737 -0.468 . . . . 64.33 109.737 174.452 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 46.5 Cg_endo -64.93 156.08 64.34 Favored 'Trans proline' 0 C--N 1.373 1.848 0 C-N-CA 122.378 2.052 . . . . 75.51 112.414 -177.196 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 46.8 Cg_exo -57.49 -46.4 27.73 Favored 'Trans proline' 0 C--N 1.378 2.102 0 C-N-CA 123.249 2.632 . . . . 54.55 112.875 179.167 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . -77.47 71.13 2.34 Favored Glycine 0 C--N 1.348 1.206 0 CA-C-N 115.597 -0.728 . . . . 34.2 114.343 -175.511 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 19.8 mm -103.56 108.39 24.39 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.6 0 N-CA-C 107.93 -1.137 . . . . 52.44 107.93 170.595 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 57' ' ' THR . . . . . 0.443 ' H ' HD12 ' A' ' 60' ' ' ILE . 64.5 p -89.67 176.31 6.91 Favored 'General case' 0 C--O 1.247 0.946 0 N-CA-C 108.349 -0.982 . . . . 43.33 108.349 167.725 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 34.2 tpt85 -61.5 -50.67 71.8 Favored 'General case' 0 CA--C 1.543 0.702 0 N-CA-C 109.747 -0.464 . . . . 72.23 109.747 179.813 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 37.4 m -58.02 -39.94 79.6 Favored 'General case' 0 CA--C 1.543 0.71 0 O-C-N 124.083 0.865 . . . . 51.43 111.64 179.207 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 60' ' ' ILE . . . . . 0.545 HD13 HG21 ' A' ' 4' ' ' THR . 81.2 mt -63.02 -46.48 96.16 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.094 0 C-N-CA 123.664 0.786 . . . . 62.22 110.784 178.387 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 56.6 tt0 -57.18 -42.71 81.66 Favored 'General case' 0 N--CA 1.478 0.947 0 C-N-CA 123.541 0.736 . . . . 61.13 110.918 177.573 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 44.3 m-20 -70.61 -38.99 74.03 Favored 'General case' 0 N--CA 1.48 1.033 0 CA-C-N 116.025 -0.534 . . . . 63.23 112.151 179.571 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 63' ' ' MET . . . . . . . . . . . . . 72.6 mtm -69.67 -42.37 74.25 Favored 'General case' 0 N--CA 1.485 1.318 0 C-N-CA 122.509 0.324 . . . . 62.22 110.774 -177.816 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 64' ' ' VAL . . . . . 0.522 ' O ' HG13 ' A' ' 68' ' ' ILE . 79.4 t -64.07 -56.7 15.08 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.519 0 O-C-N 123.994 0.809 . . . . 64.42 109.421 177.499 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 65' ' ' ALA . . . . . 0.407 ' HB2' HD23 ' A' ' 109' ' ' LEU . . . -63.33 -29.58 70.87 Favored 'General case' 0 N--CA 1.486 1.339 0 C-N-CA 122.871 0.468 . . . . 73.32 112.012 -179.158 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -67.16 -40.85 92.64 Favored Glycine 0 C--N 1.347 1.168 0 N-CA-C 111.659 -0.576 . . . . 74.24 111.659 175.84 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 67' ' ' TYR . . . . . 0.478 ' O ' HG22 ' A' ' 71' ' ' THR . 15.4 m-30 -69.21 -39.85 78.34 Favored 'General case' 0 C--O 1.241 0.639 0 C-N-CA 123.425 0.69 . . . . 61.31 110.999 175.943 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 68' ' ' ILE . . . . . 0.542 ' O ' ' HG ' ' A' ' 72' ' ' LEU . 36.9 mt -60.11 -44.71 95.67 Favored 'Isoleucine or valine' 0 C--N 1.365 1.256 0 N-CA-C 108.286 -1.005 . . . . 73.21 108.286 176.152 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 69' ' ' LYS . . . . . 0.477 ' HB2' ' HE2' ' A' ' 106' ' ' TYR . 51.5 tptt -58.07 -45.26 87.38 Favored 'General case' 0 N--CA 1.476 0.856 0 C-N-CA 123.82 0.848 . . . . 73.24 110.683 179.166 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 70' ' ' GLN . . . . . 0.428 ' HG2' ' ND2' ' A' ' 74' ' ' ASN . 60.5 tt0 -60.02 -45.97 91.02 Favored 'General case' 0 C--N 1.352 0.688 0 O-C-N 123.798 0.687 . . . . 74.11 110.413 -179.676 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 71' ' ' THR . . . . . 0.478 HG22 ' O ' ' A' ' 67' ' ' TYR . 1.8 t -75.57 -22.74 56.71 Favored 'General case' 0 C--N 1.355 0.814 0 CA-C-O 119.196 -0.431 . . . . 71.33 111.259 -178.584 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 72' ' ' LEU . . . . . 0.542 ' HG ' ' O ' ' A' ' 68' ' ' ILE . 34.2 mt -64.03 -53.33 51.69 Favored 'General case' 0 C--N 1.361 1.101 0 N-CA-C 108.794 -0.817 . . . . 75.12 108.794 173.871 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 66.9 m-20 -64.39 -52.92 55.83 Favored 'General case' 0 N--CA 1.475 0.779 0 O-C-N 123.906 0.754 . . . . 74.35 111.24 -177.077 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 74' ' ' ASN . . . . . 0.428 ' ND2' ' HG2' ' A' ' 70' ' ' GLN . 90.3 m-20 -55.58 -54.0 49.44 Favored 'General case' 0 N--CA 1.482 1.17 0 O-C-N 124.164 0.915 . . . . 75.5 111.188 -177.964 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 75' ' ' GLU . . . . . 0.444 ' HG2' ' HE2' ' A' ' 79' ' ' LYS . 13.8 tt0 -73.31 -30.09 63.14 Favored 'General case' 0 CA--C 1.553 1.077 0 CA-C-N 115.723 -0.672 . . . . 72.42 110.857 -173.225 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 10.1 tt0 -69.1 -39.08 79.19 Favored 'General case' 0 N--CA 1.488 1.472 0 C-N-CA 123.458 0.703 . . . . 75.2 110.568 177.284 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 90.4 mt -63.37 -40.08 96.28 Favored 'General case' 0 C--N 1.351 0.671 0 CA-C-N 115.516 -0.766 . . . . 63.12 109.251 172.478 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 78' ' ' LEU . . . . . 0.691 HD21 ' HA ' ' A' ' 22' ' ' LEU . 50.2 mt -60.56 -37.07 80.08 Favored 'General case' 0 N--CA 1.478 0.958 0 O-C-N 123.904 0.752 . . . . 75.44 112.12 175.112 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 79' ' ' LYS . . . . . 0.444 ' HE2' ' HG2' ' A' ' 75' ' ' GLU . 66.4 mmtt -63.99 -54.79 28.82 Favored 'General case' 0 N--CA 1.476 0.853 0 N-CA-C 108.747 -0.835 . . . . 74.35 108.747 176.493 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -59.87 -26.95 63.67 Favored Glycine 0 C--N 1.358 1.764 0 O-C-N 124.214 0.946 . . . . 53.41 113.72 -179.767 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 81' ' ' LEU . . . . . 0.517 HD21 ' HH2' ' A' ' 30' ' ' TRP . 8.5 tt -77.91 -40.71 38.94 Favored 'General case' 0 CA--C 1.545 0.76 0 C-N-CA 124.258 1.023 . . . . 25.44 109.755 179.711 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 58.1 mt -76.11 -63.35 1.34 Allowed 'General case' 0 N--CA 1.478 0.968 0 C-N-CA 122.447 0.299 . . . . 61.11 111.435 -178.624 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 7.4 tt0 -155.94 7.59 0.22 Allowed 'General case' 0 N--CA 1.485 1.324 0 N-CA-C 111.978 0.362 . . . . 54.13 111.978 -172.247 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 47.2 mt-30 61.91 13.06 5.25 Favored 'General case' 0 N--CA 1.49 1.536 0 C-N-CA 124.769 1.228 . . . . 75.35 112.618 -170.845 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 85' ' ' ARG . . . . . . . . . . . . . 51.3 mtt180 -134.25 167.08 21.34 Favored 'General case' 0 N--CA 1.479 0.984 0 C-N-CA 123.562 0.745 . . . . 72.2 110.912 -169.784 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 86' ' ' LEU . . . . . 0.489 HD12 ' HA ' ' A' ' 96' ' ' SER . 81.8 mt -100.01 44.57 1.01 Allowed 'General case' 0 CA--C 1.547 0.836 0 C-N-CA 124.322 1.049 . . . . 73.25 111.514 -173.375 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 4.2 m-20 -78.56 -73.31 0.33 Allowed 'General case' 0 N--CA 1.479 0.991 0 N-CA-C 109.306 -0.628 . . . . 72.12 109.306 172.235 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 52.3 mt-10 -92.07 155.07 18.33 Favored 'General case' 0 N--CA 1.476 0.858 0 C-N-CA 123.945 0.898 . . . . 74.24 110.765 -178.395 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 89' ' ' LEU . . . . . 0.524 HD11 HD23 ' A' ' 33' ' ' LEU . 86.7 mt 58.41 26.13 13.76 Favored 'General case' 0 N--CA 1.484 1.242 0 C-N-CA 125.074 1.349 . . . . 75.2 110.572 -170.559 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 90' ' ' SER . . . . . 0.406 ' HA ' ' HD2' ' A' ' 98' ' ' ARG . 36.9 t -147.86 18.73 1.14 Allowed 'General case' 0 CA--C 1.551 0.993 0 C-N-CA 124.153 0.981 . . . . 72.42 110.636 -176.093 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 10.9 m -72.58 94.53 1.72 Allowed 'General case' 0 CA--C 1.549 0.919 0 N-CA-C 108.937 -0.764 . . . . 53.54 108.937 171.862 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 92' ' ' LEU . . . . . 0.549 HD11 ' HE ' ' A' ' 98' ' ' ARG . 11.2 mt -125.32 -83.61 0.64 Allowed 'General case' 0 N--CA 1.483 1.191 0 CA-C-O 121.505 0.669 . . . . 72.03 110.437 -176.244 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 93' ' ' ILE . . . . . 0.413 ' H ' ' HB2' ' A' ' 92' ' ' LEU . 65.5 mt -148.87 -51.46 0.08 OUTLIER 'Isoleucine or valine' 0 N--CA 1.476 0.839 0 N-CA-C 106.179 -1.785 . . . . 54.12 106.179 -164.93 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -131.63 -175.74 14.12 Favored Glycine 0 C--N 1.352 1.426 0 CA-C-N 114.032 -1.44 . . . . 63.04 112.568 -178.627 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 34.9 tt0 -74.15 -71.25 0.34 Allowed 'General case' 0 N--CA 1.473 0.719 0 C-N-CA 125.145 1.378 . . . . 72.51 111.708 -170.829 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 96' ' ' SER . . . . . 0.489 ' HA ' HD12 ' A' ' 86' ' ' LEU . 33.4 p -94.66 10.78 33.58 Favored 'General case' 0 C--O 1.241 0.609 0 C-N-CA 123.428 0.691 . . . . 70.43 111.63 -173.869 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 88.4 m -52.59 -39.51 61.67 Favored 'General case' 0 C--N 1.361 1.071 0 C-N-CA 124.544 1.138 . . . . 51.3 111.976 177.833 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 98' ' ' ARG . . . . . 0.924 HH12 HD22 ' A' ' 102' ' ' LEU . 4.0 tpm_? -56.89 -61.68 2.27 Favored 'General case' 0 N--CA 1.469 0.515 0 C-N-CA 123.275 0.63 . . . . 70.04 112.039 -168.145 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 49.5 tt0 -83.66 -42.57 16.52 Favored 'General case' 0 CA--C 1.534 0.362 0 CA-C-N 115.063 -0.972 . . . . 71.52 110.28 -169.526 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 8.0 tmtm? -62.81 -55.61 24.8 Favored 'General case' 0 N--CA 1.476 0.835 0 O-C-N 124.106 0.879 . . . . 73.43 109.529 -177.332 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 46.6 t -72.79 -35.37 67.38 Favored 'General case' 0 N--CA 1.478 0.931 0 CA-C-O 118.622 -0.704 . . . . 74.34 111.916 -174.896 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 102' ' ' LEU . . . . . 0.924 HD22 HH12 ' A' ' 98' ' ' ARG . 21.6 tp -67.96 -47.35 68.87 Favored 'General case' 0 C--N 1.368 1.402 0 CA-C-N 118.93 0.786 . . . . 75.34 111.212 179.748 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 59.7 t30 -74.08 -24.35 59.48 Favored 'General case' 0 N--CA 1.478 0.93 0 CA-C-N 115.796 -0.638 . . . . 74.12 110.792 -178.754 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 104' ' ' ASN . . . . . 0.421 ' O ' ' HG2' ' A' ' 108' ' ' ARG . 7.7 t30 -71.13 -39.16 72.16 Favored 'General case' 0 N--CA 1.479 1.016 0 C-N-CA 122.531 0.332 . . . . 75.21 110.223 170.781 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -63.09 -37.92 89.13 Favored 'General case' 0 N--CA 1.483 1.2 0 C-N-CA 123.047 0.539 . . . . 54.52 110.306 178.204 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 106' ' ' TYR . . . . . 0.477 ' HE2' ' HB2' ' A' ' 69' ' ' LYS . 3.5 t80 -57.93 -52.07 67.01 Favored 'General case' 0 C--N 1.356 0.876 0 CA-C-N 114.941 -1.027 . . . . 64.35 108.973 168.85 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -60.51 -31.95 76.29 Favored Glycine 0 C--N 1.352 1.423 0 O-C-N 124.056 0.848 . . . . 62.34 113.673 -176.235 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 108' ' ' ARG . . . . . 0.421 ' HG2' ' O ' ' A' ' 104' ' ' ASN . 5.1 mmp_? -76.69 -36.42 57.26 Favored 'General case' 0 C--N 1.344 0.344 0 N-CA-C 109.259 -0.645 . . . . 73.31 109.259 177.871 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 109' ' ' LEU . . . . . 0.41 HD13 ' HB2' ' A' ' 114' ' ' LEU . 42.1 tp -68.75 -30.69 69.35 Favored 'General case' 0 N--CA 1.489 1.489 0 C-N-CA 123.015 0.526 . . . . 44.42 111.152 177.235 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 38.5 t -77.66 -39.04 46.34 Favored 'General case' 0 CA--C 1.543 0.699 0 CA-C-N 115.014 -0.994 . . . . 71.1 109.584 178.105 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . -90.07 -64.03 1.25 Allowed Glycine 0 C--N 1.36 1.904 0 CA-C-O 119.571 -0.572 . . . . 72.11 114.272 -177.36 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 112' ' ' MET . . . . . 0.435 ' HG2' ' O ' ' A' ' 116' ' ' PRO . 11.2 tpt -96.79 -70.56 0.71 Allowed 'General case' 0 N--CA 1.489 1.501 0 CA-C-N 118.104 0.952 . . . . 74.51 113.272 -178.548 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 113' ' ' LEU . . . . . 0.424 ' HG ' HG21 ' A' ' 52' ' ' THR . 22.0 tp 170.11 41.69 0.0 OUTLIER 'General case' 0 N--CA 1.495 1.822 0 C-N-CA 124.195 0.998 . . . . 75.44 109.389 -177.125 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 114' ' ' LEU . . . . . 0.41 ' HB2' HD13 ' A' ' 109' ' ' LEU . 5.3 tt 75.66 -21.49 0.3 Allowed 'General case' 0 N--CA 1.504 2.248 0 C-N-CA 126.36 1.864 . . . . 73.1 111.575 179.668 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 115' ' ' VAL . . . . . . . . . . . . . 28.7 m -83.57 163.39 49.76 Favored Pre-proline 0 CA--C 1.562 1.415 0 C-N-CA 124.263 1.025 . . . . 70.13 108.561 170.555 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 116' ' ' PRO . . . . . 0.435 ' O ' ' HG2' ' A' ' 112' ' ' MET . 37.5 Cg_endo -63.29 179.46 0.86 Allowed 'Trans proline' 0 C--N 1.377 2.045 0 C-N-CA 122.2 1.933 . . . . 73.24 112.559 174.786 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 18.1 t70 -49.5 -66.02 0.47 Allowed 'General case' 0 N--CA 1.487 1.417 0 C-N-CA 124.892 1.277 . . . . 70.35 112.525 -172.56 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -127.07 84.12 64.29 Favored Pre-proline 0 N--CA 1.477 0.88 0 C-N-CA 123.595 0.758 . . . . 65.22 110.077 177.956 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 119' ' ' PRO . . . . . 0.411 ' HB3' ' HG2' ' A' ' 116' ' ' PRO . 45.5 Cg_endo -85.36 -11.36 7.27 Favored 'Trans proline' 0 C--N 1.378 2.102 0 C-N-CA 123.093 2.529 . . . . 61.04 112.742 177.815 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . 78.9 1.63 84.99 Favored Glycine 0 C--N 1.352 1.447 0 CA-C-N 116.141 -0.481 . . . . 71.21 113.829 -177.449 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . -70.04 100.06 1.55 Allowed 'General case' 0 CA--C 1.544 0.715 0 C-N-CA 123.308 0.643 . . . . 70.2 110.634 -177.696 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 122' ' ' SER . . . . . . . . . . . . . 29.8 p . . . . . 0 C--O 1.252 1.185 0 C-N-CA 123.44 0.696 . . . . 74.41 110.205 179.113 . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 25.5 ptm . . . . . 0 N--CA 1.482 1.167 0 N-CA-C 110.621 -0.14 . . . . 72.33 110.621 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 40.3 p -57.06 -46.32 82.54 Favored 'General case' 0 N--CA 1.479 0.996 0 C-N-CA 123.802 0.841 . . . . 71.1 112.356 -175.784 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 23.5 m -70.79 -25.42 62.87 Favored 'General case' 0 N--CA 1.473 0.724 0 C-N-CA 123.265 0.626 . . . . 60.42 111.331 -179.518 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 4' ' ' THR . . . . . 0.411 ' HA ' ' HG3' ' A' ' 53' ' ' PRO . 25.5 m -75.56 -40.63 56.48 Favored 'General case' 0 C--N 1.35 0.602 0 C-N-CA 123.426 0.691 . . . . 53.2 110.839 178.1 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 92.8 t -67.85 -34.9 70.15 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.849 0 C-N-CA 123.543 0.737 . . . . 72.11 109.538 175.285 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 6' ' ' GLU . . . . . 0.521 ' O ' ' HG3' ' A' ' 10' ' ' ARG . 10.5 tm-20 -71.91 -32.32 67.27 Favored 'General case' 0 N--CA 1.472 0.668 0 C-N-CA 124.179 0.992 . . . . 72.11 110.226 176.504 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 7' ' ' PHE . . . . . 0.413 ' O ' ' HB2' ' A' ' 10' ' ' ARG . 62.3 t80 -70.68 -43.48 69.0 Favored 'General case' 0 N--CA 1.48 1.03 0 C-N-CA 123.871 0.868 . . . . 64.5 110.72 177.47 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 8' ' ' ILE . . . . . 0.539 HD11 HG23 ' A' ' 60' ' ' ILE . 84.5 mt -62.34 -39.21 83.38 Favored 'Isoleucine or valine' 0 C--O 1.212 -0.898 0 N-CA-C 109.178 -0.675 . . . . 75.14 109.178 173.326 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 3.3 t-20 -61.09 -38.03 84.81 Favored 'General case' 0 N--CA 1.483 1.177 0 C-N-CA 124.043 0.937 . . . . 73.21 111.086 175.866 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 10' ' ' ARG . . . . . 0.531 ' HB3' HG22 ' A' ' 47' ' ' VAL . 73.4 mtt180 -56.77 -53.77 53.94 Favored 'General case' 0 N--CA 1.475 0.811 0 O-C-N 123.82 0.7 . . . . 72.32 109.925 174.625 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 11' ' ' TRP . . . . . 0.424 ' CD1' HG13 ' A' ' 64' ' ' VAL . 99.7 m95 -75.59 -23.27 56.45 Favored 'General case' 0 N--CA 1.471 0.58 0 CA-C-N 114.918 -1.037 . . . . 75.54 113.107 -176.062 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 51.4 mt-30 -62.88 -46.7 86.6 Favored 'General case' 0 N--CA 1.47 0.556 0 N-CA-C 108.134 -1.061 . . . . 75.53 108.134 169.841 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 10.9 tpt180 -63.99 -48.39 76.58 Favored 'General case' 0 CA--C 1.54 0.59 0 CA-C-N 114.695 -1.139 . . . . 73.25 111.226 -175.721 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 14' ' ' ILE . . . . . 0.55 HD13 HG13 ' A' ' 44' ' ' ILE . 48.2 mt -64.62 -48.91 82.83 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.316 0 O-C-N 123.194 0.309 . . . . 61.44 110.287 -179.978 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 15' ' ' ALA . . . . . 0.567 ' HA ' ' HB ' ' A' ' 71' ' ' THR . . . -54.41 -45.56 72.97 Favored 'General case' 0 C--N 1.36 1.046 0 O-C-N 123.983 0.802 . . . . 74.3 111.163 -178.969 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 84.4 mt -78.73 -36.52 43.11 Favored 'General case' 0 N--CA 1.476 0.858 0 CA-C-N 114.989 -1.005 . . . . 55.34 112.124 -174.311 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.451 ' O ' ' HG ' ' A' ' 21' ' ' LEU . 64.3 mt -67.54 -45.36 75.91 Favored 'General case' 0 N--CA 1.487 1.375 0 CA-C-N 118.057 0.39 . . . . 64.04 110.395 179.813 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 77.8 p -67.49 -37.25 82.58 Favored 'General case' 0 N--CA 1.477 0.901 0 C-N-CA 123.211 0.604 . . . . 71.13 110.79 176.794 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 30.7 tp60 -61.13 -42.29 98.27 Favored 'General case' 0 C--N 1.357 0.906 0 O-C-N 123.701 0.626 . . . . 70.32 110.612 175.407 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 69.2 m -60.31 -49.5 77.36 Favored 'General case' 0 C--N 1.347 0.461 0 O-C-N 124.069 0.856 . . . . 73.42 109.686 176.37 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 21' ' ' LEU . . . . . 0.719 HD22 ' HA ' ' A' ' 33' ' ' LEU . 26.2 mt -61.36 -33.36 73.5 Favored 'General case' 0 CA--C 1.547 0.85 0 O-C-N 124.014 0.821 . . . . 60.33 110.917 -178.919 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.741 ' HA ' HD21 ' A' ' 78' ' ' LEU . 56.0 tp -67.29 -54.01 24.62 Favored 'General case' 0 N--CA 1.482 1.139 0 C-N-CA 123.271 0.629 . . . . 73.41 110.692 179.74 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 42.5 mt-10 -56.53 -49.6 74.32 Favored 'General case' 0 N--CA 1.474 0.752 0 C-N-CA 124.335 1.054 . . . . 72.13 110.735 178.95 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.407 HD22 HD12 ' A' ' 32' ' ' LEU . 91.5 mt -67.24 -33.74 75.98 Favored 'General case' 0 C--O 1.217 -0.62 0 CA-C-N 114.987 -1.006 . . . . 75.31 111.21 -176.133 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 25' ' ' ALA . . . . . 0.542 ' HB2' HD21 ' A' ' 33' ' ' LEU . . . -67.65 -42.62 81.92 Favored 'General case' 0 N--CA 1.483 1.208 0 C-N-CA 122.867 0.467 . . . . 74.42 111.594 177.699 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 97.1 mt-30 -70.97 -23.86 62.3 Favored 'General case' 0 N--CA 1.475 0.812 0 CA-C-N 115.532 -0.758 . . . . 73.3 111.069 176.678 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 79.0 mtt180 -78.68 -21.13 48.67 Favored 'General case' 0 N--CA 1.479 0.999 0 C-N-CA 123.562 0.745 . . . . 73.13 110.588 170.71 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 91.77 9.55 62.52 Favored Glycine 0 C--N 1.348 1.216 0 C-N-CA 123.05 0.357 . . . . 72.34 113.332 179.485 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 18.6 mm-40 -82.81 61.27 5.78 Favored 'General case' 0 CA--C 1.547 0.828 0 C-N-CA 124.622 1.169 . . . . 72.32 110.687 177.775 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 30' ' ' TRP . . . . . 0.41 ' O ' ' HG ' ' A' ' 34' ' ' LEU . 59.6 m95 -63.91 -29.71 70.86 Favored 'General case' 0 N--CA 1.484 1.25 0 C-N-CA 123.863 0.865 . . . . 74.21 110.999 -176.788 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 -56.21 -47.31 78.65 Favored 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 124.265 1.026 . . . . 64.31 110.287 175.718 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.407 HD12 HD22 ' A' ' 24' ' ' LEU . 35.5 mt -64.59 -31.03 72.07 Favored 'General case' 0 N--CA 1.474 0.733 0 CA-C-N 115.16 -0.927 . . . . 72.0 110.927 -179.0 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 33' ' ' LEU . . . . . 0.719 ' HA ' HD22 ' A' ' 21' ' ' LEU . 10.5 mp -62.42 -49.01 77.19 Favored 'General case' 0 N--CA 1.477 0.884 0 N-CA-C 109.76 -0.459 . . . . 71.33 109.76 171.554 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.41 ' HG ' ' O ' ' A' ' 30' ' ' TRP . 80.5 mt -58.01 -41.47 83.19 Favored 'General case' 0 N--CA 1.484 1.257 0 O-C-N 123.856 0.722 . . . . 65.31 112.397 -177.195 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 1.4 mp0 -73.81 -56.55 4.84 Favored 'General case' 0 N--CA 1.488 1.438 0 C-N-CA 122.859 0.464 . . . . 73.31 111.778 178.572 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 84.7 mm-40 -66.04 -19.71 65.94 Favored 'General case' 0 N--CA 1.488 1.46 0 C-N-CA 122.965 0.506 . . . . 74.55 111.793 -175.205 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 37' ' ' GLU . . . . . 0.473 ' O ' ' HG ' ' A' ' 41' ' ' LEU . 22.7 tt0 -60.02 -36.98 78.43 Favored 'General case' 0 C--N 1.358 0.969 0 C-N-CA 123.291 0.636 . . . . 73.1 111.277 179.578 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 62.2 t -53.1 -48.95 52.62 Favored 'Isoleucine or valine' 0 CA--C 1.556 1.182 0 C-N-CA 123.341 0.656 . . . . 71.11 110.764 -179.24 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 70.9 m -72.65 -33.2 66.43 Favored 'General case' 0 CA--C 1.537 0.444 0 CA-C-N 115.129 -0.941 . . . . 64.54 111.617 177.618 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 33.2 t80 -62.12 -40.75 96.97 Favored 'General case' 0 N--CA 1.481 1.08 0 C-N-CA 122.786 0.434 . . . . 73.15 110.984 176.24 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 41' ' ' LEU . . . . . 0.473 ' HG ' ' O ' ' A' ' 37' ' ' GLU . 56.0 mt -69.74 -52.78 22.43 Favored 'General case' 0 C--O 1.245 0.857 0 C-N-CA 123.953 0.901 . . . . 63.15 109.859 -178.28 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 53.2 tt0 -55.81 -49.97 71.8 Favored 'General case' 0 C--N 1.358 0.954 0 CA-C-N 114.882 -1.054 . . . . 72.24 110.832 -179.112 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 43' ' ' SER . . . . . 0.535 ' O ' HG23 ' A' ' 47' ' ' VAL . 66.1 m -60.94 -56.28 22.93 Favored 'General case' 0 C--N 1.348 0.541 0 O-C-N 123.991 0.807 . . . . 53.2 111.055 -178.78 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 44' ' ' ILE . . . . . 0.55 HG13 HD13 ' A' ' 14' ' ' ILE . 11.9 tt -58.97 -42.77 87.09 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.192 0 O-C-N 123.692 0.62 . . . . 74.34 111.558 -171.806 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 45' ' ' GLU . . . . . 0.484 ' HG2' HD22 ' A' ' 92' ' ' LEU . 54.9 mm-40 -63.65 -44.96 92.3 Favored 'General case' 0 C--N 1.359 0.99 0 C-N-CA 122.705 0.402 . . . . 75.11 111.039 177.263 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 99.2 m -55.93 -42.58 76.33 Favored 'General case' 0 N--CA 1.479 1.003 0 O-C-N 123.638 0.586 . . . . 75.53 111.248 177.55 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 47' ' ' VAL . . . . . 0.535 HG23 ' O ' ' A' ' 43' ' ' SER . 96.2 t -63.67 -46.45 94.69 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.701 0 C-N-CA 124.018 0.927 . . . . 73.43 111.074 -179.579 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 48' ' ' MET . . . . . 0.565 ' SD ' HD13 ' A' ' 102' ' ' LEU . 77.2 mtm -71.52 -25.89 62.43 Favored 'General case' 0 N--CA 1.478 0.939 0 CA-C-N 115.432 -0.804 . . . . 72.12 112.469 -176.55 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 54.9 mt-10 -94.3 -18.79 21.28 Favored 'General case' 0 N--CA 1.485 1.284 0 N-CA-C 112.544 0.572 . . . . 72.31 112.544 179.605 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 1.3 mptm? -91.38 146.33 23.9 Favored 'General case' 0 N--CA 1.483 1.213 0 C-N-CA 122.981 0.512 . . . . 75.14 109.861 179.387 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 4.9 pt20 -70.75 143.54 51.21 Favored 'General case' 0 CA--C 1.537 0.479 0 C-N-CA 123.503 0.721 . . . . 74.24 112.806 -167.888 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 95.2 m -80.16 118.26 71.58 Favored Pre-proline 0 CA--C 1.55 0.949 0 C-N-CA 124.413 1.085 . . . . 64.2 108.735 172.007 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 53' ' ' PRO . . . . . 0.411 ' HG3' ' HA ' ' A' ' 4' ' ' THR . 31.8 Cg_endo -61.99 153.37 69.18 Favored 'Trans proline' 0 C--N 1.374 1.884 0 C-N-CA 122.28 1.987 . . . . 74.32 112.14 -179.266 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 45.6 Cg_endo -68.27 -46.86 1.88 Allowed 'Trans proline' 0 C--N 1.371 1.757 0 C-N-CA 122.612 2.208 . . . . 52.22 112.216 179.236 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . -74.24 79.4 0.91 Allowed Glycine 0 C--N 1.349 1.28 0 O-C-N 123.591 0.557 . . . . 63.21 113.23 -176.571 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 56' ' ' ILE . . . . . 0.455 ' HB ' HD21 ' A' ' 113' ' ' LEU . 66.9 mt -128.49 107.84 16.56 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.79 0 C-N-CA 124.858 1.263 . . . . 74.24 107.704 175.554 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 57' ' ' THR . . . . . 0.408 ' H ' HD12 ' A' ' 60' ' ' ILE . 38.4 p -82.4 -178.44 7.05 Favored 'General case' 0 CA--C 1.542 0.662 0 C-N-CA 123.506 0.722 . . . . 64.42 110.989 -179.678 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 25.1 tpt180 -53.71 -55.61 24.6 Favored 'General case' 0 N--CA 1.475 0.802 0 C-N-CA 124.892 1.277 . . . . 72.44 111.884 -177.329 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 17.5 m -59.6 -40.31 87.06 Favored 'General case' 0 N--CA 1.478 0.954 0 O-C-N 123.782 0.676 . . . . 74.43 112.107 -177.542 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 60' ' ' ILE . . . . . 0.539 HG23 HD11 ' A' ' 8' ' ' ILE . 66.4 mt -66.42 -40.8 87.52 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.75 0 O-C-N 123.941 0.775 . . . . 74.44 110.61 178.625 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 61.1 tt0 -64.17 -38.62 91.73 Favored 'General case' 0 CA--C 1.543 0.711 0 C-N-CA 124.288 1.035 . . . . 75.12 110.524 -179.049 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 43.4 m-20 -72.8 -38.14 67.32 Favored 'General case' 0 N--CA 1.476 0.868 0 CA-C-N 115.661 -0.699 . . . . 71.44 111.731 177.815 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 63' ' ' MET . . . . . . . . . . . . . 74.1 mtm -65.23 -48.23 74.04 Favored 'General case' 0 N--CA 1.486 1.327 0 C-N-CA 122.291 0.236 . . . . 72.44 110.963 177.841 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 64' ' ' VAL . . . . . 0.51 ' O ' HG13 ' A' ' 68' ' ' ILE . 75.7 t -61.87 -55.93 21.06 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.589 0 C-N-CA 123.554 0.742 . . . . 65.01 110.729 179.188 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -63.59 -27.36 69.19 Favored 'General case' 0 N--CA 1.485 1.32 0 C-N-CA 122.416 0.286 . . . . 74.54 111.368 -179.396 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -67.23 -40.11 92.28 Favored Glycine 0 C--N 1.349 1.271 0 O-C-N 123.66 0.6 . . . . 51.42 112.063 174.677 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 18.6 m-30 -71.39 -35.44 71.04 Favored 'General case' 0 N--CA 1.472 0.656 0 C-N-CA 123.499 0.72 . . . . 73.23 111.624 176.866 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 68' ' ' ILE . . . . . 0.528 ' O ' ' HG ' ' A' ' 72' ' ' LEU . 20.3 mt -63.55 -48.92 84.72 Favored 'Isoleucine or valine' 0 C--N 1.358 0.947 0 N-CA-C 108.162 -1.051 . . . . 74.02 108.162 176.541 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 69' ' ' LYS . . . . . 0.554 ' HB2' ' HE2' ' A' ' 106' ' ' TYR . 46.6 tptt -53.74 -47.71 70.36 Favored 'General case' 0 N--CA 1.481 1.079 0 C-N-CA 124.239 1.016 . . . . 71.45 110.879 176.76 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 62.4 tt0 -60.99 -46.04 92.37 Favored 'General case' 0 CA--C 1.535 0.39 0 O-C-N 124.094 0.871 . . . . 73.12 110.97 -177.638 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 71' ' ' THR . . . . . 0.567 ' HB ' ' HA ' ' A' ' 15' ' ' ALA . 13.1 t -79.16 -21.29 46.66 Favored 'General case' 0 C--N 1.352 0.683 0 CA-C-O 118.904 -0.57 . . . . 62.13 111.45 -176.017 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 72' ' ' LEU . . . . . 0.528 ' HG ' ' O ' ' A' ' 68' ' ' ILE . 25.2 mt -75.98 -31.72 59.13 Favored 'General case' 0 N--CA 1.486 1.354 0 N-CA-C 109.802 -0.444 . . . . 64.25 109.802 173.385 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 97.8 m-20 -70.33 -51.12 32.44 Favored 'General case' 0 N--CA 1.469 0.491 0 O-C-N 123.744 0.652 . . . . 73.42 109.842 174.723 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 67.4 m-20 -57.35 -42.96 83.0 Favored 'General case' 0 N--CA 1.479 0.997 0 O-C-N 123.96 0.788 . . . . 73.33 109.912 178.314 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 53.5 tp10 -58.54 -56.37 23.03 Favored 'General case' 0 N--CA 1.473 0.68 0 C-N-CA 124.494 1.117 . . . . 53.23 110.712 177.202 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 10.1 tt0 -65.67 -39.05 90.91 Favored 'General case' 0 N--CA 1.477 0.897 0 C-N-CA 122.724 0.41 . . . . 72.51 111.786 -174.441 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 92.9 mt -64.58 -47.74 77.55 Favored 'General case' 0 N--CA 1.478 0.934 0 C-N-CA 123.349 0.66 . . . . 75.22 110.524 179.881 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 78' ' ' LEU . . . . . 0.741 HD21 ' HA ' ' A' ' 22' ' ' LEU . 42.5 mt -61.01 -61.86 2.27 Favored 'General case' 0 N--CA 1.482 1.128 0 C-N-CA 123.968 0.907 . . . . 73.21 111.985 178.68 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 79' ' ' LYS . . . . . 0.554 ' HB3' ' H ' ' A' ' 87' ' ' ASP . 43.9 mmtm -67.17 -38.04 84.75 Favored 'General case' 0 CA--C 1.543 0.679 0 CA-C-N 113.872 -1.513 . . . . 74.4 110.356 -171.563 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -68.94 -29.69 72.44 Favored Glycine 0 C--N 1.343 0.939 0 CA-C-N 115.822 -0.626 . . . . 60.45 113.037 175.957 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 8.5 tt -63.14 -44.79 94.56 Favored 'General case' 0 N--CA 1.475 0.81 0 N-CA-C 109.044 -0.725 . . . . 63.3 109.044 171.016 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 82' ' ' LEU . . . . . 0.437 ' HG ' ' O ' ' A' ' 78' ' ' LEU . 67.4 mt -66.3 -66.39 0.56 Allowed 'General case' 0 N--CA 1.477 0.875 0 O-C-N 123.663 0.602 . . . . 72.1 110.497 -178.411 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 75.7 mt-30 -148.8 -62.93 0.24 Allowed 'General case' 0 N--CA 1.482 1.171 0 C-N-CA 124.335 1.054 . . . . 65.13 110.447 179.508 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 10.8 pt20 -135.58 151.78 50.61 Favored 'General case' 0 N--CA 1.492 1.667 0 C-N-CA 123.273 0.629 . . . . 72.21 111.27 -169.497 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 85' ' ' ARG . . . . . . . . . . . . . 7.3 ptp85 -48.86 -31.38 7.07 Favored 'General case' 0 N--CA 1.497 1.918 0 C-N-CA 125.288 1.435 . . . . 72.54 114.064 -172.212 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 85.4 mt -126.7 79.28 1.86 Allowed 'General case' 0 N--CA 1.472 0.632 0 N-CA-C 107.631 -1.248 . . . . 71.23 107.631 174.807 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 87' ' ' ASP . . . . . 0.554 ' H ' ' HB3' ' A' ' 79' ' ' LYS . 23.2 t70 -94.85 152.01 18.75 Favored 'General case' 0 N--CA 1.475 0.809 0 C-N-CA 124.581 1.152 . . . . 74.22 110.46 -174.769 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 8.0 mp0 -94.84 95.62 8.8 Favored 'General case' 0 C--O 1.242 0.665 0 CA-C-N 115.523 -0.762 . . . . 64.25 109.857 -175.454 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 75.2 mt -64.49 -66.24 0.57 Allowed 'General case' 0 N--CA 1.48 1.029 0 N-CA-C 107.437 -1.32 . . . . 71.11 107.437 165.604 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 40.2 m -126.34 0.23 7.01 Favored 'General case' 0 N--CA 1.481 1.082 0 C-N-CA 124.372 1.069 . . . . 70.43 110.145 167.218 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 11.9 t 68.16 -179.63 0.22 Allowed 'General case' 0 N--CA 1.483 1.186 0 C-N-CA 125.2 1.4 . . . . 75.02 112.13 178.77 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 92' ' ' LEU . . . . . 0.484 HD22 ' HG2' ' A' ' 45' ' ' GLU . 40.5 mt -123.85 -72.45 0.68 Allowed 'General case' 0 N--CA 1.478 0.944 0 C-N-CA 123.83 0.852 . . . . 71.33 109.598 176.158 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 93' ' ' ILE . . . . . 0.47 ' HB ' ' HA ' ' A' ' 97' ' ' THR . 35.2 mt -120.44 146.39 25.38 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.06 0 C-N-CA 124.093 0.957 . . . . 70.11 109.072 -177.755 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -64.46 126.7 33.46 Favored Glycine 0 C--N 1.344 0.988 0 O-C-N 123.316 0.385 . . . . 23.33 112.585 177.09 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 87.7 mt-30 66.18 -85.76 0.03 OUTLIER 'General case' 0 N--CA 1.477 0.905 0 C-N-CA 125.038 1.335 . . . . 71.44 111.584 179.247 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 22.7 m -92.39 102.94 15.42 Favored 'General case' 0 N--CA 1.467 0.384 0 C-N-CA 123.547 0.739 . . . . 61.02 109.624 -177.908 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 97' ' ' THR . . . . . 0.624 HG22 ' H ' ' A' ' 99' ' ' GLN . 97.1 m -93.16 155.64 17.34 Favored 'General case' 0 CA--C 1.55 0.949 0 C-N-CA 123.869 0.868 . . . . 75.13 109.916 173.036 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 30.7 mmt180 -58.16 -13.26 4.56 Favored 'General case' 0 CA--C 1.556 1.181 0 C-N-CA 125.291 1.436 . . . . 72.21 113.016 175.554 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 99' ' ' GLN . . . . . 0.624 ' H ' HG22 ' A' ' 97' ' ' THR . 12.5 pt20 -57.89 -29.8 65.34 Favored 'General case' 0 N--CA 1.491 1.601 0 C-N-CA 124.34 1.056 . . . . 71.15 112.069 176.444 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 27.5 ttpp -68.3 -46.47 70.21 Favored 'General case' 0 N--CA 1.478 0.944 0 N-CA-C 109.061 -0.718 . . . . 71.53 109.061 173.65 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 101' ' ' SER . . . . . 0.406 ' HA ' ' HB3' ' A' ' 104' ' ' ASN . 48.7 m -72.1 -12.68 61.31 Favored 'General case' 0 N--CA 1.479 1.011 0 C-N-CA 124.307 1.043 . . . . 70.3 111.941 174.897 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 102' ' ' LEU . . . . . 0.565 HD13 ' SD ' ' A' ' 48' ' ' MET . 24.7 tp -76.49 -48.26 20.11 Favored 'General case' 0 N--CA 1.483 1.188 0 C-N-CA 124.751 1.22 . . . . 52.34 109.19 177.098 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 9.2 t30 -65.53 -37.87 87.99 Favored 'General case' 0 CA--C 1.553 1.087 0 CA-C-N 114.672 -1.149 . . . . 72.25 110.536 173.433 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 104' ' ' ASN . . . . . 0.406 ' HB3' ' HA ' ' A' ' 101' ' ' SER . 24.5 t-20 -70.03 -32.54 70.74 Favored 'General case' 0 N--CA 1.478 0.947 0 CA-C-N 115.611 -0.722 . . . . 63.41 110.936 175.952 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -63.69 -40.23 96.29 Favored 'General case' 0 N--CA 1.48 1.072 0 C-N-CA 123.572 0.749 . . . . 71.42 110.165 175.853 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 106' ' ' TYR . . . . . 0.554 ' HE2' ' HB2' ' A' ' 69' ' ' LYS . 2.9 t80 -57.34 -51.97 67.24 Favored 'General case' 0 C--N 1.353 0.758 0 O-C-N 124.274 0.983 . . . . 64.34 109.443 172.016 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -53.19 -55.01 26.4 Favored Glycine 0 C--N 1.353 1.49 0 O-C-N 124.133 0.896 . . . . 42.51 114.204 -177.179 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 108' ' ' ARG . . . . . 0.638 ' HG3' ' HA ' ' A' ' 114' ' ' LEU . 17.2 ptp180 -66.6 -31.43 72.12 Favored 'General case' 0 CA--C 1.548 0.897 0 C-N-CA 123.295 0.638 . . . . 74.4 111.905 178.983 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 109' ' ' LEU . . . . . 0.543 ' HA ' ' H ' ' A' ' 114' ' ' LEU . 56.4 tp -68.05 -45.81 72.87 Favored 'General case' 0 N--CA 1.484 1.247 0 C-N-CA 122.645 0.378 . . . . 74.33 111.096 176.505 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 11.6 t -72.23 -29.54 64.04 Favored 'General case' 0 CA--C 1.54 0.595 0 CA-C-N 115.344 -0.843 . . . . 42.13 109.84 -174.659 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . -88.03 -62.96 1.4 Allowed Glycine 0 C--N 1.36 1.905 0 CA-C-O 119.364 -0.687 . . . . 72.42 113.844 -179.928 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 112' ' ' MET . . . . . 0.591 ' HG3' ' HB3' ' A' ' 117' ' ' ASP . 1.0 OUTLIER -98.99 -69.92 0.75 Allowed 'General case' 0 N--CA 1.485 1.31 0 CA-C-N 118.622 1.211 . . . . 71.52 112.065 177.576 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 113' ' ' LEU . . . . . 0.455 HD21 ' HB ' ' A' ' 56' ' ' ILE . 0.9 OUTLIER 163.29 51.2 0.0 OUTLIER 'General case' 0 N--CA 1.497 1.899 0 C-N-CA 125.746 1.618 . . . . 42.24 108.228 -174.322 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 114' ' ' LEU . . . . . 0.638 ' HA ' ' HG3' ' A' ' 108' ' ' ARG . 0.3 OUTLIER 69.31 11.52 8.15 Favored 'General case' 0 N--CA 1.487 1.414 0 C-N-CA 125.574 1.55 . . . . 73.13 112.934 171.221 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 115' ' ' VAL . . . . . . . . . . . . . 25.0 m -127.19 140.67 38.5 Favored Pre-proline 0 CA--C 1.552 1.022 0 C-N-CA 123.499 0.72 . . . . 74.34 109.102 171.499 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 24.3 Cg_exo -63.79 99.83 0.28 Allowed 'Trans proline' 0 C--N 1.378 2.1 0 C-N-CA 122.766 2.31 . . . . 75.23 111.219 174.347 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 117' ' ' ASP . . . . . 0.591 ' HB3' ' HG3' ' A' ' 112' ' ' MET . 32.4 t70 -167.09 21.82 0.03 OUTLIER 'General case' 0 N--CA 1.483 1.192 0 C-N-CA 124.007 0.923 . . . . 74.52 109.487 -175.662 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -63.26 137.45 97.07 Favored Pre-proline 0 N--CA 1.482 1.146 0 C-N-CA 123.465 0.706 . . . . 55.42 112.314 -172.735 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 119' ' ' PRO . . . . . . . . . . . . . 23.1 Cg_exo -64.91 147.71 89.43 Favored 'Trans proline' 0 C--N 1.38 2.194 0 C-N-CA 123.187 2.591 . . . . 72.4 112.68 -179.691 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . -73.61 -13.61 80.16 Favored Glycine 0 CA--C 1.529 0.932 0 CA-C-N 115.889 -0.596 . . . . 62.22 113.016 175.18 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . -135.13 112.02 10.18 Favored 'General case' 0 CA--C 1.536 0.44 0 C-N-CA 124.594 1.158 . . . . 62.55 108.731 175.606 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 122' ' ' SER . . . . . . . . . . . . . 22.8 m . . . . . 0 C--O 1.25 1.106 0 N-CA-C 107.876 -1.157 . . . . 71.2 107.876 176.447 . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 23.5 ttt . . . . . 0 N--CA 1.488 1.439 0 CA-C-O 119.475 -0.298 . . . . 73.25 111.326 . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 27.2 p -47.13 -39.02 12.61 Favored 'General case' 0 N--CA 1.497 1.885 0 N-CA-C 113.634 0.975 . . . . 72.24 113.634 -174.25 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 16.6 m -65.19 -45.35 85.16 Favored 'General case' 0 N--CA 1.478 0.932 0 C-N-CA 123.249 0.62 . . . . 73.11 111.464 178.384 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 4' ' ' THR . . . . . 0.53 ' HA ' ' HG3' ' A' ' 53' ' ' PRO . 5.2 m -70.96 -37.21 72.78 Favored 'General case' 0 N--CA 1.476 0.863 0 C-N-CA 123.351 0.66 . . . . 65.32 111.822 179.947 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 69.9 t -62.1 -47.58 92.48 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.84 0 C-N-CA 123.258 0.623 . . . . 74.31 109.758 178.529 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 44.9 mm-40 -57.27 -51.72 68.21 Favored 'General case' 0 N--CA 1.473 0.718 0 CA-C-N 115.778 -0.646 . . . . 53.51 110.927 172.205 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 40.7 t80 -57.32 -50.3 73.36 Favored 'General case' 0 CA--C 1.552 1.024 0 C-N-CA 124.197 0.999 . . . . 72.52 111.849 -173.853 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 8' ' ' ILE . . . . . 0.432 HD11 HG23 ' A' ' 60' ' ' ILE . 83.6 mt -62.38 -46.25 96.87 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.065 0 C-N-CA 123.977 0.911 . . . . 71.35 110.237 177.337 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 25.1 t-20 -67.09 -27.69 67.57 Favored 'General case' 0 N--CA 1.486 1.351 0 C-N-CA 123.781 0.833 . . . . 73.12 112.032 -176.441 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 10' ' ' ARG . . . . . 0.465 ' O ' HG13 ' A' ' 14' ' ' ILE . 96.5 mtt180 -76.23 -38.41 56.39 Favored 'General case' 0 N--CA 1.469 0.484 0 N-CA-C 109.041 -0.726 . . . . 64.32 109.041 175.325 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 11' ' ' TRP . . . . . 0.514 ' HH2' ' HG ' ' A' ' 102' ' ' LEU . 57.0 m95 -67.42 -29.65 69.19 Favored 'General case' 0 N--CA 1.484 1.274 0 C-N-CA 123.055 0.542 . . . . 75.12 111.696 172.152 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 12' ' ' GLN . . . . . 0.413 ' HG3' ' O ' ' A' ' 8' ' ' ILE . 52.7 mt-30 -64.08 -49.45 72.2 Favored 'General case' 0 N--CA 1.472 0.65 0 N-CA-C 107.671 -1.233 . . . . 44.25 107.671 171.773 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 53.5 ttt180 -60.85 -43.25 98.59 Favored 'General case' 0 CA--C 1.548 0.898 0 CA-C-N 114.996 -1.002 . . . . 74.01 111.382 -176.303 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 14' ' ' ILE . . . . . 0.465 HG13 ' O ' ' A' ' 10' ' ' ARG . 64.2 mt -66.52 -47.41 83.74 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.388 0 C-N-CA 122.731 0.412 . . . . 62.13 109.899 178.782 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 15' ' ' ALA . . . . . 0.572 ' HA ' ' HB ' ' A' ' 71' ' ' THR . . . -58.63 -43.71 89.8 Favored 'General case' 0 N--CA 1.486 1.343 0 C-N-CA 123.888 0.875 . . . . 60.54 111.824 -179.53 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 96.4 mt -81.83 -34.55 30.13 Favored 'General case' 0 N--CA 1.483 1.176 0 CA-C-N 114.613 -1.176 . . . . 55.42 111.112 -173.591 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.475 ' O ' ' HG ' ' A' ' 21' ' ' LEU . 25.3 mt -65.18 -51.76 59.06 Favored 'General case' 0 N--CA 1.486 1.352 0 N-CA-C 109.589 -0.523 . . . . 75.23 109.589 176.0 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 80.9 p -63.6 -37.32 86.9 Favored 'General case' 0 N--CA 1.48 1.028 0 C-N-CA 123.389 0.675 . . . . 70.33 111.557 -179.484 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 6.4 tp-100 -58.58 -50.14 74.91 Favored 'General case' 0 N--CA 1.476 0.866 0 O-C-N 123.613 0.57 . . . . 75.42 110.582 173.685 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 70.9 m -58.0 -49.91 75.21 Favored 'General case' 0 C--O 1.207 -1.161 0 CA-C-N 115.167 -0.924 . . . . 63.33 110.18 176.923 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 21' ' ' LEU . . . . . 0.595 HD22 ' HA ' ' A' ' 33' ' ' LEU . 92.4 mt -63.21 -29.88 71.14 Favored 'General case' 0 N--CA 1.474 0.772 0 C-N-CA 123.783 0.833 . . . . 73.05 111.393 -175.627 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.575 ' HA ' HD21 ' A' ' 78' ' ' LEU . 58.9 tp -68.56 -53.95 19.69 Favored 'General case' 0 C--O 1.252 1.19 0 C-N-CA 123.063 0.545 . . . . 62.03 110.221 176.903 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 23' ' ' GLU . . . . . 0.585 ' HB3' ' HE ' ' A' ' 27' ' ' ARG . 46.1 mt-10 -55.37 -51.2 67.58 Favored 'General case' 0 N--CA 1.475 0.798 0 CA-C-N 114.775 -1.102 . . . . 75.33 110.024 177.749 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.425 HD22 HD12 ' A' ' 32' ' ' LEU . 95.4 mt -60.6 -39.73 89.21 Favored 'General case' 0 N--CA 1.476 0.873 0 C-N-CA 125.382 1.473 . . . . 72.1 111.589 -176.683 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 25' ' ' ALA . . . . . 0.58 ' HB2' HD21 ' A' ' 33' ' ' LEU . . . -59.76 -48.87 79.95 Favored 'General case' 0 N--CA 1.481 1.106 0 C-N-CA 123.097 0.559 . . . . 43.54 110.823 176.168 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 95.6 mt-30 -66.63 -30.38 70.64 Favored 'General case' 0 CA--C 1.552 1.049 0 CA-C-N 114.901 -1.045 . . . . 65.4 111.633 178.919 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 27' ' ' ARG . . . . . 0.585 ' HE ' ' HB3' ' A' ' 23' ' ' GLU . 44.5 mtt-85 -76.28 -25.45 54.92 Favored 'General case' 0 N--CA 1.488 1.448 0 C-N-CA 123.473 0.709 . . . . 74.22 110.846 176.856 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 98.18 9.54 53.49 Favored Glycine 0 C--N 1.348 1.221 0 CA-C-N 116.364 -0.38 . . . . 54.42 113.244 -177.825 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 29' ' ' GLU . . . . . 0.415 ' HB2' ' HB3' ' A' ' 24' ' ' LEU . 12.8 mm-40 -80.13 57.41 2.69 Favored 'General case' 0 CA--C 1.55 0.976 0 C-N-CA 124.508 1.123 . . . . 72.42 110.482 174.985 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 30' ' ' TRP . . . . . 0.447 ' O ' ' HG ' ' A' ' 34' ' ' LEU . 89.2 m95 -62.0 -35.29 78.08 Favored 'General case' 0 N--CA 1.482 1.169 0 C-N-CA 124.218 1.007 . . . . 73.25 111.51 -175.892 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 6.2 m-20 -54.23 -40.01 67.28 Favored 'General case' 0 N--CA 1.476 0.871 0 C-N-CA 124.766 1.226 . . . . 71.43 111.51 179.619 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.425 HD12 HD22 ' A' ' 24' ' ' LEU . 87.9 mt -69.1 -31.23 69.8 Favored 'General case' 0 CA--C 1.543 0.685 0 CA-C-N 115.096 -0.956 . . . . 51.34 110.981 179.112 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 33' ' ' LEU . . . . . 0.595 ' HA ' HD22 ' A' ' 21' ' ' LEU . 8.5 mp -70.48 -40.3 73.72 Favored 'General case' 0 N--CA 1.491 1.604 0 C-N-CA 122.252 0.221 . . . . 64.53 110.57 173.051 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.447 ' HG ' ' O ' ' A' ' 30' ' ' TRP . 82.6 mt -65.1 -40.65 94.87 Favored 'General case' 0 N--CA 1.479 0.986 0 C-N-CA 123.648 0.779 . . . . 52.4 111.364 -176.916 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 1.6 mp0 -80.32 -55.76 4.67 Favored 'General case' 0 N--CA 1.473 0.72 0 C-N-CA 123.429 0.692 . . . . 70.31 111.197 178.541 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 36' ' ' GLN . . . . . 0.435 ' HB2' HD21 ' A' ' 21' ' ' LEU . 84.1 mm-40 -64.44 -13.08 49.55 Favored 'General case' 0 N--CA 1.494 1.768 0 N-CA-C 113.088 0.773 . . . . 71.54 113.088 -178.935 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 37' ' ' GLU . . . . . 0.471 ' O ' ' HG ' ' A' ' 41' ' ' LEU . 43.4 tt0 -47.55 -49.43 26.42 Favored 'General case' 0 N--CA 1.478 0.952 0 C-N-CA 122.914 0.486 . . . . 73.02 110.454 169.296 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 40.9 t -57.1 -53.75 39.18 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.088 0 O-C-N 124.061 0.851 . . . . 74.44 111.897 -176.906 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 46.4 p -69.09 -34.17 74.67 Favored 'General case' 0 N--CA 1.483 1.179 0 C-N-CA 122.801 0.44 . . . . 71.34 111.926 -177.399 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 40.9 t80 -64.9 -42.88 94.4 Favored 'General case' 0 N--CA 1.475 0.815 0 C-N-CA 123.513 0.725 . . . . 73.34 110.064 176.836 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 41' ' ' LEU . . . . . 0.471 ' HG ' ' O ' ' A' ' 37' ' ' GLU . 96.6 mt -60.81 -44.35 96.97 Favored 'General case' 0 C--N 1.35 0.627 0 O-C-N 124.192 0.932 . . . . 64.51 109.856 175.117 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 47.6 tt0 -63.86 -42.6 97.5 Favored 'General case' 0 N--CA 1.473 0.724 0 O-C-N 123.269 0.356 . . . . 74.02 110.761 -179.246 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 30.9 m -59.82 -53.76 54.2 Favored 'General case' 0 N--CA 1.482 1.156 0 C-N-CA 123.157 0.583 . . . . 61.45 111.355 -179.047 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 11.5 tt -66.1 -33.99 67.27 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.054 0 CA-C-N 115.072 -0.967 . . . . 63.44 111.054 -176.706 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 10.1 mm-40 -64.15 -44.93 90.64 Favored 'General case' 0 N--CA 1.484 1.251 0 C-N-CA 123.119 0.568 . . . . 73.13 111.307 172.774 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 46' ' ' THR . . . . . 0.422 ' O ' ' HB2' ' A' ' 50' ' ' LYS . 67.7 m -62.8 -34.06 76.49 Favored 'General case' 0 N--CA 1.478 0.932 0 C-N-CA 122.65 0.38 . . . . 75.42 110.969 -177.882 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 47' ' ' VAL . . . . . . . . . . . . . 58.3 t -71.46 -51.82 30.68 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.021 0 N-CA-C 111.615 0.228 . . . . 64.24 111.615 175.518 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 48' ' ' MET . . . . . . . . . . . . . 75.6 mtm -67.85 -32.84 73.64 Favored 'General case' 0 N--CA 1.488 1.473 0 N-CA-C 112.899 0.703 . . . . 72.42 112.899 -172.777 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 49.6 mt-10 -84.02 -34.42 24.29 Favored 'General case' 0 N--CA 1.483 1.198 0 C-N-CA 123.371 0.668 . . . . 64.51 111.626 -178.632 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 50' ' ' LYS . . . . . 0.422 ' HB2' ' O ' ' A' ' 46' ' ' THR . 13.8 mptt -79.86 164.08 23.86 Favored 'General case' 0 N--CA 1.483 1.186 0 CA-C-O 121.181 0.515 . . . . 75.25 110.699 -179.677 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 8.9 tt0 -82.83 138.39 33.97 Favored 'General case' 0 C--O 1.241 0.61 0 CA-C-N 115.046 -0.979 . . . . 42.32 110.65 -172.361 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 52' ' ' THR . . . . . 0.693 HG21 ' HB3' ' A' ' 114' ' ' LEU . 39.1 m -72.29 123.59 89.69 Favored Pre-proline 0 CA--C 1.556 1.187 0 N-CA-C 109.178 -0.675 . . . . 61.12 109.178 171.914 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 53' ' ' PRO . . . . . 0.53 ' HG3' ' HA ' ' A' ' 4' ' ' THR . 61.7 Cg_endo -69.3 155.46 67.39 Favored 'Trans proline' 0 C--N 1.376 2.01 0 C-N-CA 123.162 2.575 . . . . 74.53 112.675 -176.664 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 43.9 Cg_endo -67.98 -47.29 1.86 Allowed 'Trans proline' 0 C--N 1.377 2.063 0 C-N-CA 122.367 2.045 . . . . 72.4 112.258 175.004 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . -69.97 80.1 0.36 Allowed Glycine 0 C--N 1.352 1.46 0 O-C-N 123.566 0.541 . . . . 60.41 113.656 -175.796 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 77.7 mt -125.86 98.4 4.96 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.526 0 N-CA-C 107.91 -1.144 . . . . 65.04 107.91 175.085 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 57' ' ' THR . . . . . 0.401 ' H ' HD12 ' A' ' 60' ' ' ILE . 78.5 p -74.45 -179.65 4.12 Favored 'General case' 0 N--CA 1.473 0.712 0 C-N-CA 122.867 0.467 . . . . 72.4 109.917 175.373 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 21.1 tpt180 -64.99 -40.03 94.35 Favored 'General case' 0 N--CA 1.476 0.828 0 N-CA-C 110.371 -0.233 . . . . 64.14 110.371 177.79 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 51.9 m -60.25 -45.24 93.94 Favored 'General case' 0 N--CA 1.478 0.953 0 C-N-CA 123.309 0.644 . . . . 62.1 111.4 177.005 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 60' ' ' ILE . . . . . 0.432 HG23 HD11 ' A' ' 8' ' ' ILE . 80.1 mt -64.8 -39.13 84.61 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.971 0 CA-C-N 115.479 -0.782 . . . . 61.44 110.377 177.272 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 63.2 tt0 -63.18 -41.95 99.28 Favored 'General case' 0 N--CA 1.482 1.143 0 C-N-CA 124.012 0.925 . . . . 73.11 111.131 179.525 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 52.3 m-20 -69.4 -41.54 76.28 Favored 'General case' 0 N--CA 1.477 0.91 0 C-N-CA 123.163 0.585 . . . . 73.42 111.503 179.78 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 63' ' ' MET . . . . . . . . . . . . . 64.9 mtm -65.88 -52.3 51.41 Favored 'General case' 0 N--CA 1.485 1.295 0 C-N-CA 122.351 0.26 . . . . 73.54 111.311 178.477 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 64' ' ' VAL . . . . . 0.533 ' O ' HG13 ' A' ' 68' ' ' ILE . 71.4 t -60.99 -55.84 21.99 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.998 0 C-N-CA 123.456 0.702 . . . . 70.53 110.563 -178.957 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 65' ' ' ALA . . . . . 0.555 ' HB2' HD23 ' A' ' 109' ' ' LEU . . . -61.33 -37.8 84.61 Favored 'General case' 0 N--CA 1.488 1.455 0 O-C-N 123.478 0.486 . . . . 54.5 111.406 179.715 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -60.98 -37.17 93.41 Favored Glycine 0 C--N 1.346 1.109 0 CA-C-N 116.413 -0.358 . . . . 74.13 112.383 176.521 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 19.3 m-30 -75.86 -34.23 60.04 Favored 'General case' 0 N--CA 1.476 0.846 0 C-N-CA 123.137 0.575 . . . . 72.43 111.622 177.018 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 68' ' ' ILE . . . . . 0.533 HG13 ' O ' ' A' ' 64' ' ' VAL . 61.5 mt -59.69 -53.57 46.48 Favored 'Isoleucine or valine' 0 C--N 1.357 0.923 0 N-CA-C 108.808 -0.812 . . . . 63.51 108.808 175.812 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 69' ' ' LYS . . . . . 0.535 ' HB2' ' HE2' ' A' ' 106' ' ' TYR . 0.6 OUTLIER -59.77 -46.28 89.67 Favored 'General case' 0 C--N 1.348 0.507 0 CA-C-N 115.359 -0.837 . . . . 74.23 110.274 179.919 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 63.3 tt0 -57.08 -45.86 82.98 Favored 'General case' 0 C--N 1.352 0.675 0 O-C-N 124.564 1.165 . . . . 65.12 111.398 -178.589 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 71' ' ' THR . . . . . 0.572 ' HB ' ' HA ' ' A' ' 15' ' ' ALA . 15.1 t -79.66 -21.94 44.13 Favored 'General case' 0 C--O 1.216 -0.684 0 CA-C-O 119.188 -0.434 . . . . 71.44 110.559 -174.657 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 72' ' ' LEU . . . . . 0.524 ' HG ' ' O ' ' A' ' 68' ' ' ILE . 44.0 mt -74.62 -31.84 62.12 Favored 'General case' 0 N--CA 1.483 1.207 0 O-C-N 123.321 0.388 . . . . 72.21 110.521 172.122 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 73' ' ' ASP . . . . . 0.429 ' O ' ' HG ' ' A' ' 77' ' ' LEU . 48.5 m-20 -64.1 -60.17 3.55 Favored 'General case' 0 C--N 1.351 0.654 0 N-CA-C 108.627 -0.879 . . . . 74.35 108.627 172.702 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 48.4 m-20 -55.48 -41.35 72.86 Favored 'General case' 0 N--CA 1.483 1.21 0 C-N-CA 124.354 1.062 . . . . 74.5 111.335 -178.309 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 75' ' ' GLU . . . . . 0.543 ' O ' ' HG2' ' A' ' 79' ' ' LYS . 5.3 tp10 -58.88 -59.03 6.1 Favored 'General case' 0 N--CA 1.476 0.851 0 C-N-CA 124.348 1.059 . . . . 71.3 109.879 178.447 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 9.4 tt0 -72.45 -26.1 61.7 Favored 'General case' 0 CA--C 1.548 0.891 0 O-C-N 124.128 0.892 . . . . 75.21 111.851 -171.999 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 77' ' ' LEU . . . . . 0.429 ' HG ' ' O ' ' A' ' 73' ' ' ASP . 97.4 mt -67.61 -43.25 80.9 Favored 'General case' 0 N--CA 1.481 1.08 0 N-CA-C 109.246 -0.65 . . . . 72.03 109.246 174.165 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 78' ' ' LEU . . . . . 0.575 HD21 ' HA ' ' A' ' 22' ' ' LEU . 28.9 mt -57.3 -46.05 83.54 Favored 'General case' 0 N--CA 1.48 1.032 0 O-C-N 123.726 0.641 . . . . 74.21 111.196 169.55 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 79' ' ' LYS . . . . . 0.544 ' HB3' ' HA ' ' A' ' 85' ' ' ARG . 36.2 mmtm -64.67 -38.13 89.93 Favored 'General case' 0 N--CA 1.478 0.955 0 C-N-CA 123.408 0.683 . . . . 61.31 112.316 -175.764 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -71.25 -30.6 67.05 Favored Glycine 0 C--N 1.342 0.906 0 CA-C-N 115.936 -0.574 . . . . 63.31 112.002 174.534 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 4.8 tt -68.8 -43.83 74.8 Favored 'General case' 0 CA--C 1.557 1.225 0 C-N-CA 123.488 0.715 . . . . 70.41 109.728 173.302 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 82' ' ' LEU . . . . . 0.495 HD13 ' HG2' ' A' ' 88' ' ' GLU . 57.7 mt -71.93 -65.98 0.7 Allowed 'General case' 0 N--CA 1.478 0.947 0 C-N-CA 123.413 0.685 . . . . 74.24 110.201 -170.652 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 22.6 tp60 -179.9 -53.68 0.01 OUTLIER 'General case' 0 N--CA 1.483 1.193 0 C-N-CA 123.386 0.675 . . . . 75.14 110.322 177.578 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 48.5 mt-30 -119.95 158.08 27.47 Favored 'General case' 0 N--CA 1.484 1.239 0 C-N-CA 123.765 0.826 . . . . 71.01 109.931 -174.314 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 85' ' ' ARG . . . . . 0.544 ' HA ' ' HB3' ' A' ' 79' ' ' LYS . 76.6 mtp180 -64.77 -16.77 63.47 Favored 'General case' 0 N--CA 1.485 1.306 0 O-C-N 123.843 0.714 . . . . 65.24 112.141 177.176 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 62.4 mt -140.72 -161.76 1.26 Allowed 'General case' 0 C--O 1.243 0.746 0 C-N-CA 125.356 1.462 . . . . 54.2 108.577 179.229 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 11.4 t70 61.86 62.61 1.23 Allowed 'General case' 0 N--CA 1.483 1.208 0 C-N-CA 124.013 0.925 . . . . 75.55 111.441 167.635 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 88' ' ' GLU . . . . . 0.495 ' HG2' HD13 ' A' ' 82' ' ' LEU . 12.5 tp10 -174.44 -75.35 0.01 OUTLIER 'General case' 0 N--CA 1.474 0.747 0 C-N-CA 123.799 0.839 . . . . 63.44 108.901 177.427 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 89' ' ' LEU . . . . . 0.445 HD12 ' NZ ' ' A' ' 79' ' ' LYS . 89.3 mt -90.6 24.14 2.77 Favored 'General case' 0 N--CA 1.476 0.875 0 C-N-CA 123.272 0.629 . . . . 74.12 110.438 -177.863 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 10.9 p -116.82 87.32 2.67 Favored 'General case' 0 CA--C 1.55 0.965 0 C-N-CA 123.579 0.752 . . . . 52.4 112.317 -169.715 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 91' ' ' SER . . . . . 0.452 ' HB2' HD13 ' A' ' 41' ' ' LEU . 49.3 m -127.44 91.03 3.23 Favored 'General case' 0 N--CA 1.476 0.862 0 N-CA-C 107.373 -1.343 . . . . 62.25 107.373 164.632 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 64.4 mt -129.56 -155.38 0.69 Allowed 'General case' 0 N--CA 1.481 1.121 0 C-N-CA 124.103 0.961 . . . . 73.25 110.93 -170.066 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 76.4 mt -41.31 -41.05 0.68 Allowed 'Isoleucine or valine' 0 N--CA 1.488 1.467 0 C-N-CA 125.224 1.41 . . . . 72.23 111.018 167.967 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -163.31 -151.67 6.53 Favored Glycine 0 C--O 1.242 0.641 0 N-CA-C 110.497 -1.041 . . . . 64.5 110.497 169.049 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 3.9 pt20 -73.92 167.32 21.71 Favored 'General case' 0 CA--C 1.547 0.828 0 N-CA-C 109.128 -0.693 . . . . 73.15 109.128 168.825 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 78.1 p 49.98 -88.21 0.01 OUTLIER 'General case' 0 CA--C 1.555 1.142 0 C-N-CA 125.051 1.34 . . . . 73.03 111.842 -170.469 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 28.2 m 55.64 -78.38 0.01 OUTLIER 'General case' 0 CA--C 1.559 1.303 0 C-N-CA 125.379 1.472 . . . . 73.45 113.27 176.652 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 4.9 ptm180 -45.98 -48.63 16.48 Favored 'General case' 0 N--CA 1.485 1.293 0 C-N-CA 125.699 1.599 . . . . 71.32 114.665 -169.274 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 60.2 tp60 -67.99 -52.02 40.58 Favored 'General case' 0 N--CA 1.471 0.602 0 N-CA-C 109.842 -0.429 . . . . 64.52 109.842 -176.976 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 87.3 tttt -60.68 -45.41 94.28 Favored 'General case' 0 N--CA 1.475 0.791 0 CA-C-N 115.797 -0.638 . . . . 74.34 111.3 -179.231 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 23.0 t -73.63 -46.83 44.5 Favored 'General case' 0 N--CA 1.468 0.432 0 C-N-CA 124.058 0.943 . . . . 73.04 110.983 -168.835 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 102' ' ' LEU . . . . . 0.514 ' HG ' ' HH2' ' A' ' 11' ' ' TRP . 9.4 mp -78.29 -35.51 47.86 Favored 'General case' 0 N--CA 1.473 0.718 0 O-C-N 123.347 0.404 . . . . 63.35 111.427 -176.538 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 60.6 t30 -70.85 -35.73 72.54 Favored 'General case' 0 N--CA 1.488 1.466 0 N-CA-C 109.732 -0.47 . . . . 72.14 109.732 177.874 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 104' ' ' ASN . . . . . 0.441 ' O ' ' HG2' ' A' ' 108' ' ' ARG . 24.4 t-20 -67.0 -43.68 82.29 Favored 'General case' 0 N--CA 1.479 0.998 0 N-CA-C 109.423 -0.584 . . . . 74.43 109.423 172.57 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -60.49 -34.88 74.69 Favored 'General case' 0 N--CA 1.484 1.236 0 C-N-CA 123.407 0.683 . . . . 73.3 111.698 178.703 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 106' ' ' TYR . . . . . 0.535 ' HE2' ' HB2' ' A' ' 69' ' ' LYS . 13.6 t80 -65.56 -52.89 48.97 Favored 'General case' 0 CA--C 1.539 0.536 0 N-CA-C 109.03 -0.729 . . . . 73.41 109.03 175.699 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -62.3 -35.69 91.99 Favored Glycine 0 C--N 1.353 1.508 0 O-C-N 124.095 0.872 . . . . 73.03 112.673 -177.78 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 108' ' ' ARG . . . . . 0.441 ' HG2' ' O ' ' A' ' 104' ' ' ASN . 21.4 mmt180 -75.21 -34.59 61.5 Favored 'General case' 0 N--CA 1.468 0.446 0 C-N-CA 122.879 0.471 . . . . 72.44 110.544 179.16 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 109' ' ' LEU . . . . . 0.555 HD23 ' HB2' ' A' ' 65' ' ' ALA . 41.9 tp -67.13 -41.71 85.67 Favored 'General case' 0 N--CA 1.487 1.412 0 CA-C-O 121.311 0.577 . . . . 70.34 109.857 177.447 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 33.2 t -68.12 -38.76 82.58 Favored 'General case' 0 CA--C 1.545 0.774 0 CA-C-N 114.17 -1.377 . . . . 75.11 109.81 -179.775 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . -89.8 -64.8 1.25 Allowed Glycine 0 C--N 1.355 1.608 0 C-N-CA 121.153 -0.546 . . . . 73.33 113.674 -178.165 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 112' ' ' MET . . . . . 0.578 ' SD ' ' HB2' ' A' ' 113' ' ' LEU . 0.2 OUTLIER -93.8 -71.43 0.66 Allowed 'General case' 0 N--CA 1.481 1.093 0 CA-C-N 117.853 0.826 . . . . 73.12 111.389 -175.793 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 113' ' ' LEU . . . . . 0.578 ' HB2' ' SD ' ' A' ' 112' ' ' MET . 6.1 mt 170.12 35.57 0.0 OUTLIER 'General case' 0 N--CA 1.507 2.409 0 C-N-CA 125.649 1.579 . . . . 63.21 110.342 -178.47 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 114' ' ' LEU . . . . . 0.693 ' HB3' HG21 ' A' ' 52' ' ' THR . 1.9 tt 83.09 -20.39 0.34 Allowed 'General case' 0 N--CA 1.506 2.357 0 C-N-CA 127.03 2.132 . . . . 75.3 111.722 176.843 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 115' ' ' VAL . . . . . 0.443 HG22 ' SD ' ' A' ' 112' ' ' MET . 16.3 m -84.56 152.89 61.11 Favored Pre-proline 0 CA--C 1.553 1.088 0 N-CA-C 108.967 -0.753 . . . . 73.1 108.967 175.369 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 33.4 Cg_endo -62.01 140.83 86.63 Favored 'Trans proline' 0 C--N 1.366 1.458 0 C-N-CA 122.32 2.013 . . . . 74.5 112.174 177.962 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 4.2 m-20 -71.02 -30.25 66.41 Favored 'General case' 0 N--CA 1.482 1.149 0 C-N-CA 123.887 0.875 . . . . 53.23 111.18 -179.049 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . 55.84 62.69 6.83 Favored Pre-proline 0 N--CA 1.481 1.122 0 C-N-CA 123.843 0.857 . . . . 62.21 110.389 -167.789 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 119' ' ' PRO . . . . . . . . . . . . . 65.5 Cg_endo -71.26 144.45 46.24 Favored 'Trans proline' 0 C--N 1.374 1.882 0 C-N-CA 122.722 2.281 . . . . 72.1 112.268 -172.289 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . -82.02 123.0 5.89 Favored Glycine 0 CA--C 1.532 1.152 0 CA-C-N 116.148 -0.478 . . . . 64.22 112.139 178.213 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . -90.5 126.61 35.98 Favored 'General case' 0 N--CA 1.481 1.094 0 C-N-CA 123.728 0.811 . . . . 61.42 110.204 -179.578 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 122' ' ' SER . . . . . . . . . . . . . 41.9 m . . . . . 0 CA--C 1.555 1.167 0 C-N-CA 123.563 0.745 . . . . 72.43 110.583 -179.109 . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 25.2 ttt . . . . . 0 N--CA 1.487 1.375 0 CA-C-O 119.672 -0.204 . . . . 72.43 110.856 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 2' ' ' THR . . . . . 0.421 ' O ' ' HG2' ' A' ' 6' ' ' GLU . 41.6 m -49.47 -49.4 45.61 Favored 'General case' 0 N--CA 1.487 1.398 0 C-N-CA 123.65 0.78 . . . . 73.1 112.798 -173.547 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 68.8 p -60.72 -41.16 94.73 Favored 'General case' 0 N--CA 1.482 1.173 0 C-N-CA 123.609 0.764 . . . . 71.42 112.033 -178.392 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 30.4 m -69.1 -40.69 78.23 Favored 'General case' 0 N--CA 1.48 1.045 0 C-N-CA 123.261 0.625 . . . . 72.44 111.347 179.748 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 99.4 t -65.04 -46.08 92.5 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.922 0 C-N-CA 123.029 0.532 . . . . 73.13 109.885 178.942 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 6' ' ' GLU . . . . . 0.421 ' HG2' ' O ' ' A' ' 2' ' ' THR . 63.0 mm-40 -59.02 -44.69 91.75 Favored 'General case' 0 N--CA 1.476 0.844 0 C-N-CA 123.367 0.667 . . . . 64.44 110.328 174.854 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 39.2 t80 -57.49 -55.62 32.4 Favored 'General case' 0 N--CA 1.479 0.979 0 C-N-CA 124.451 1.1 . . . . 70.52 110.542 -176.036 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 45.3 mt -66.18 -37.36 79.57 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.986 0 C-N-CA 123.518 0.727 . . . . 64.54 110.322 -178.452 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 2.7 t-20 -72.28 -26.7 62.08 Favored 'General case' 0 N--CA 1.488 1.469 0 C-N-CA 123.298 0.639 . . . . 62.15 111.147 -177.442 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 10' ' ' ARG . . . . . 0.667 ' HB3' HG22 ' A' ' 47' ' ' VAL . 82.0 mtt180 -78.03 -35.47 49.77 Favored 'General case' 0 CA--C 1.536 0.421 0 C-N-CA 123.437 0.695 . . . . 74.4 109.648 174.688 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 11' ' ' TRP . . . . . 0.419 ' CZ3' HG12 ' A' ' 68' ' ' ILE . 73.4 m95 -67.67 -34.16 76.37 Favored 'General case' 0 N--CA 1.479 1.02 0 O-C-N 123.096 0.248 . . . . 74.45 110.381 172.028 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 54.4 mt-30 -60.0 -48.42 81.8 Favored 'General case' 0 C--N 1.359 0.993 0 N-CA-C 108.248 -1.019 . . . . 75.54 108.248 171.1 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 32.2 tpt180 -58.8 -46.81 86.75 Favored 'General case' 0 CA--C 1.552 1.045 0 CA-C-N 115.158 -0.928 . . . . 75.2 111.503 -175.754 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 14' ' ' ILE . . . . . 0.713 HD11 HG21 ' A' ' 47' ' ' VAL . 31.7 mt -67.05 -45.36 87.06 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.439 0 C-N-CA 122.665 0.386 . . . . 75.31 110.163 -179.652 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 15' ' ' ALA . . . . . 0.419 ' HB1' ' OE1' ' A' ' 70' ' ' GLN . . . -62.15 -42.79 99.6 Favored 'General case' 0 N--CA 1.483 1.193 0 C-N-CA 124.339 1.055 . . . . 73.31 111.792 -177.894 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 95.2 mt -75.51 -39.35 58.59 Favored 'General case' 0 N--CA 1.484 1.249 0 CA-C-N 114.593 -1.185 . . . . 74.31 110.247 -175.694 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.533 ' O ' ' HG ' ' A' ' 21' ' ' LEU . 44.2 mt -63.9 -49.14 73.84 Favored 'General case' 0 C--O 1.211 -0.948 0 O-C-N 123.565 0.54 . . . . 74.51 109.99 176.48 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 83.3 p -65.42 -30.55 71.37 Favored 'General case' 0 N--CA 1.484 1.265 0 C-N-CA 122.821 0.448 . . . . 64.1 111.515 -179.54 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 19' ' ' GLN . . . . . 0.578 ' HA ' HD22 ' A' ' 74' ' ' ASN . 16.4 tp60 -63.42 -47.69 80.91 Favored 'General case' 0 N--CA 1.481 1.115 0 CA-C-O 121.546 0.688 . . . . 72.03 110.124 173.037 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 55.0 m -61.39 -48.12 82.68 Favored 'General case' 0 CA--C 1.538 0.502 0 CA-C-N 114.321 -1.309 . . . . 42.33 110.394 178.488 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 21' ' ' LEU . . . . . 0.533 ' HG ' ' O ' ' A' ' 17' ' ' LEU . 95.6 mt -60.46 -38.42 84.15 Favored 'General case' 0 N--CA 1.473 0.679 0 C-N-CA 124.218 1.007 . . . . 75.12 110.136 -178.117 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.824 ' HA ' HD21 ' A' ' 78' ' ' LEU . 35.9 tp -61.09 -55.72 29.24 Favored 'General case' 0 C--O 1.253 1.276 0 C-N-CA 123.539 0.736 . . . . 71.1 110.733 178.812 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 23' ' ' GLU . . . . . 0.506 ' O ' ' HG3' ' A' ' 27' ' ' ARG . 56.0 mt-10 -59.19 -55.48 34.46 Favored 'General case' 0 CA--C 1.543 0.699 0 CA-C-N 114.917 -1.038 . . . . 71.32 111.678 -178.743 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.482 HD22 HD12 ' A' ' 32' ' ' LEU . 78.5 mt -58.42 -38.68 77.9 Favored 'General case' 0 N--CA 1.478 0.973 0 C-N-CA 124.714 1.206 . . . . 74.0 111.776 -175.952 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 25' ' ' ALA . . . . . 0.514 ' HB2' HD21 ' A' ' 33' ' ' LEU . . . -62.13 -45.16 94.67 Favored 'General case' 0 N--CA 1.478 0.934 0 C-N-CA 123.247 0.619 . . . . 74.01 111.727 176.033 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 92.6 mt-30 -73.17 -14.82 61.43 Favored 'General case' 0 CA--C 1.557 1.217 0 CA-C-N 115.42 -0.809 . . . . 74.3 111.564 177.48 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 27' ' ' ARG . . . . . 0.506 ' HG3' ' O ' ' A' ' 23' ' ' GLU . 72.7 mtt-85 -87.84 -2.15 58.43 Favored 'General case' 0 N--CA 1.491 1.616 0 C-N-CA 123.58 0.752 . . . . 72.5 111.489 170.979 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 85.45 0.02 88.32 Favored Glycine 0 N--CA 1.48 1.591 0 N-CA-C 113.9 0.32 . . . . 53.13 113.9 -179.311 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 24.2 mm-40 -85.2 68.2 10.43 Favored 'General case' 0 N--CA 1.473 0.695 0 C-N-CA 124.696 1.199 . . . . 74.32 111.287 -176.692 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 30' ' ' TRP . . . . . 0.44 ' O ' ' HG ' ' A' ' 34' ' ' LEU . 69.2 m95 -67.84 -28.7 67.78 Favored 'General case' 0 N--CA 1.48 1.046 0 CA-C-N 115.712 -0.677 . . . . 75.31 110.386 178.292 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 10.4 m-20 -53.13 -46.67 68.88 Favored 'General case' 0 N--CA 1.479 1.017 0 C-N-CA 124.738 1.215 . . . . 72.33 111.576 176.022 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.482 HD12 HD22 ' A' ' 24' ' ' LEU . 70.7 mt -70.44 -26.53 63.7 Favored 'General case' 0 CA--C 1.544 0.749 0 CA-C-N 114.856 -1.065 . . . . 64.55 110.758 -175.82 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 33' ' ' LEU . . . . . 0.514 HD21 ' HB2' ' A' ' 25' ' ' ALA . 11.0 mp -70.04 -42.86 72.34 Favored 'General case' 0 N--CA 1.485 1.325 0 C-N-CA 122.937 0.495 . . . . 74.43 110.418 172.45 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.44 ' HG ' ' O ' ' A' ' 30' ' ' TRP . 77.0 mt -65.02 -33.97 77.32 Favored 'General case' 0 N--CA 1.484 1.263 0 C-N-CA 123.495 0.718 . . . . 73.01 111.292 -179.776 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 96.5 mt-30 -71.47 -52.16 19.93 Favored 'General case' 0 N--CA 1.477 0.915 0 C-N-CA 123.446 0.698 . . . . 73.4 110.658 176.716 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 84.8 mm-40 -74.5 -12.74 60.56 Favored 'General case' 0 N--CA 1.481 1.081 0 C-N-CA 123.743 0.817 . . . . 71.32 112.594 -177.571 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 37' ' ' GLU . . . . . 0.43 ' O ' ' HG ' ' A' ' 41' ' ' LEU . 38.4 tt0 -52.86 -53.84 43.08 Favored 'General case' 0 N--CA 1.48 1.051 0 C-N-CA 124.066 0.947 . . . . 75.23 111.577 178.456 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 83.8 t -60.42 -39.53 81.34 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.258 0 C-N-CA 123.241 0.616 . . . . 71.43 110.901 -178.239 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 36.4 m -63.72 -43.63 95.98 Favored 'General case' 0 CA--C 1.551 0.987 0 CA-C-N 115.458 -0.792 . . . . 72.55 111.03 177.246 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 59.5 t80 -65.04 -52.66 54.61 Favored 'General case' 0 N--CA 1.479 0.977 0 C-N-CA 124.778 1.231 . . . . 70.41 110.242 -175.888 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 41' ' ' LEU . . . . . 0.43 ' HG ' ' O ' ' A' ' 37' ' ' GLU . 69.6 mt -63.01 -44.74 95.13 Favored 'General case' 0 C--N 1.35 0.609 0 CA-C-N 114.729 -1.123 . . . . 63.31 110.95 -177.64 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 50.9 tt0 -61.04 -47.9 84.24 Favored 'General case' 0 N--CA 1.481 1.08 0 C-N-CA 122.797 0.439 . . . . 74.1 111.009 179.709 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 43' ' ' SER . . . . . 0.503 ' O ' HG23 ' A' ' 47' ' ' VAL . 63.2 m -57.76 -53.76 54.52 Favored 'General case' 0 N--CA 1.481 1.124 0 C-N-CA 123.381 0.672 . . . . 72.51 111.407 -178.968 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 20.8 tt -69.37 -28.67 39.23 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.864 0 CA-C-N 115.54 -0.754 . . . . 73.2 112.045 -174.037 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 14.0 mm-40 -62.52 -47.42 84.0 Favored 'General case' 0 N--CA 1.479 0.982 0 C-N-CA 122.709 0.404 . . . . 50.32 110.151 169.374 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 19.2 m -61.96 -27.67 69.01 Favored 'General case' 0 N--CA 1.481 1.082 0 O-C-N 123.906 0.754 . . . . 72.03 111.139 179.987 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 47' ' ' VAL . . . . . 0.713 HG21 HD11 ' A' ' 14' ' ' ILE . 21.1 t -75.4 -50.98 22.27 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.213 0 O-C-N 122.26 -0.275 . . . . 74.23 111.602 175.086 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 48' ' ' MET . . . . . . . . . . . . . 73.9 mtm -73.4 -20.87 60.64 Favored 'General case' 0 N--CA 1.492 1.648 0 N-CA-C 112.818 0.673 . . . . 52.14 112.818 -172.35 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 16.1 pt-20 -85.05 -11.51 55.16 Favored 'General case' 0 N--CA 1.48 1.045 0 C-N-CA 122.598 0.359 . . . . 74.21 111.134 175.047 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 11.9 mptt -94.62 155.88 16.68 Favored 'General case' 0 N--CA 1.485 1.294 0 C-N-CA 124.213 1.005 . . . . 54.0 110.852 -178.567 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 8.8 tt0 -87.07 142.23 28.08 Favored 'General case' 0 CA--C 1.545 0.773 0 CA-C-N 114.901 -1.045 . . . . 75.42 110.218 -179.396 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 95.7 m -68.74 131.59 91.17 Favored Pre-proline 0 CA--C 1.555 1.173 0 C-N-CA 123.868 0.867 . . . . 53.02 110.128 174.48 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 26.9 Cg_exo -66.79 151.91 81.52 Favored 'Trans proline' 0 C--N 1.381 2.285 0 C-N-CA 122.388 2.059 . . . . 72.13 112.475 172.891 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 17.0 Cg_exo -71.4 -46.88 0.57 Allowed 'Trans proline' 0 C--N 1.373 1.824 0 C-N-CA 122.898 2.398 . . . . 75.02 112.339 174.916 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . -81.98 48.92 4.0 Favored Glycine 0 C--N 1.351 1.383 0 CA-C-N 115.792 -0.64 . . . . 73.2 114.636 -172.742 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 56' ' ' ILE . . . . . 0.507 ' HB ' HD21 ' A' ' 113' ' ' LEU . 44.2 mt -81.71 109.1 15.52 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.598 0 N-CA-C 108.331 -0.988 . . . . 62.22 108.331 170.89 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 57' ' ' THR . . . . . 0.417 ' H ' HD12 ' A' ' 60' ' ' ILE . 67.6 p -75.76 -178.36 4.2 Favored 'General case' 0 N--CA 1.476 0.84 0 C-N-CA 123.434 0.694 . . . . 72.52 110.729 -179.687 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 47.4 tpt85 -60.1 -48.44 81.72 Favored 'General case' 0 CA--C 1.546 0.811 0 C-N-CA 123.331 0.653 . . . . 63.13 109.638 174.48 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 14.9 m -59.33 -44.59 92.59 Favored 'General case' 0 C--O 1.248 0.982 0 C-N-CA 124.502 1.121 . . . . 51.43 111.625 179.754 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 60' ' ' ILE . . . . . 0.417 HD12 ' H ' ' A' ' 57' ' ' THR . 87.5 mt -66.07 -38.35 81.82 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.652 0 CA-C-N 114.87 -1.059 . . . . 74.32 110.38 179.812 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 51.9 tt0 -64.27 -40.28 95.67 Favored 'General case' 0 N--CA 1.48 1.071 0 C-N-CA 123.028 0.531 . . . . 71.23 110.655 177.642 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 40.2 m-20 -60.92 -50.34 73.81 Favored 'General case' 0 N--CA 1.479 0.993 0 C-N-CA 123.11 0.564 . . . . 64.02 110.811 178.259 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 63' ' ' MET . . . . . . . . . . . . . 71.4 mtm -63.41 -57.83 9.02 Favored 'General case' 0 N--CA 1.478 0.971 0 CA-C-N 115.856 -0.611 . . . . 75.14 110.787 -178.902 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 64' ' ' VAL . . . . . 0.493 ' O ' HG13 ' A' ' 68' ' ' ILE . 55.7 t -54.72 -57.89 5.42 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.146 0 C-N-CA 124.04 0.936 . . . . 70.31 111.412 -177.495 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 65' ' ' ALA . . . . . 0.48 ' HB2' HD23 ' A' ' 109' ' ' LEU . . . -63.76 -41.91 97.92 Favored 'General case' 0 N--CA 1.488 1.427 0 C-N-CA 122.393 0.277 . . . . 74.13 111.5 -178.072 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -58.26 -37.35 86.69 Favored Glycine 0 C--N 1.351 1.375 0 O-C-N 123.192 0.307 . . . . 42.24 112.446 177.813 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 67' ' ' TYR . . . . . 0.514 ' O ' HG22 ' A' ' 71' ' ' THR . 18.1 m-30 -71.67 -38.73 70.62 Favored 'General case' 0 N--CA 1.472 0.671 0 C-N-CA 123.422 0.689 . . . . 73.45 111.48 177.028 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 68' ' ' ILE . . . . . 0.507 ' O ' ' HG ' ' A' ' 72' ' ' LEU . 69.8 mt -57.93 -53.39 45.93 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.05 0 O-C-N 123.904 0.752 . . . . 61.13 109.232 177.363 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 69' ' ' LYS . . . . . 0.496 ' HB2' ' CE2' ' A' ' 106' ' ' TYR . 23.0 tptm -61.02 -38.24 85.4 Favored 'General case' 0 N--CA 1.474 0.767 0 C-N-CA 123.262 0.625 . . . . 65.32 110.93 179.109 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 70' ' ' GLN . . . . . 0.419 ' OE1' ' HB1' ' A' ' 15' ' ' ALA . 64.3 tt0 -59.67 -47.04 87.19 Favored 'General case' 0 C--N 1.349 0.586 0 O-C-N 123.746 0.654 . . . . 70.12 110.715 179.737 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 71' ' ' THR . . . . . 0.514 HG22 ' O ' ' A' ' 67' ' ' TYR . 2.2 t -77.51 -26.97 51.6 Favored 'General case' 0 C--N 1.354 0.78 0 O-C-N 122.341 -0.224 . . . . 71.44 111.601 -177.169 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 72' ' ' LEU . . . . . 0.513 HD21 ' HB2' ' A' ' 102' ' ' LEU . 41.7 mt -69.97 -41.36 74.58 Favored 'General case' 0 N--CA 1.483 1.183 0 C-N-CA 122.153 0.181 . . . . 62.23 110.892 175.853 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 73' ' ' ASP . . . . . 0.424 ' O ' ' HG ' ' A' ' 77' ' ' LEU . 18.8 t70 -78.08 -42.12 33.19 Favored 'General case' 0 N--CA 1.477 0.9 0 O-C-N 123.952 0.782 . . . . 60.13 110.517 -175.717 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 74' ' ' ASN . . . . . 0.578 HD22 ' HA ' ' A' ' 19' ' ' GLN . 3.7 m-20 -63.43 -45.15 92.25 Favored 'General case' 0 N--CA 1.482 1.151 0 C-N-CA 122.986 0.514 . . . . 62.52 110.448 176.976 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 27.2 tt0 -66.07 -36.69 83.87 Favored 'General case' 0 C--O 1.206 -1.192 0 O-C-N 123.427 0.454 . . . . 64.12 110.093 175.934 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 55.3 tt0 -56.98 -44.34 82.6 Favored 'General case' 0 N--CA 1.494 1.734 0 C-N-CA 123.818 0.847 . . . . 73.45 110.83 178.518 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 77' ' ' LEU . . . . . 0.424 ' HG ' ' O ' ' A' ' 73' ' ' ASP . 94.8 mt -67.67 -46.41 72.44 Favored 'General case' 0 N--CA 1.478 0.958 0 CA-C-N 114.829 -1.078 . . . . 75.23 110.983 179.59 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 78' ' ' LEU . . . . . 0.824 HD21 ' HA ' ' A' ' 22' ' ' LEU . 71.3 mt -61.0 -52.85 63.24 Favored 'General case' 0 N--CA 1.488 1.427 0 C-N-CA 124.219 1.008 . . . . 74.41 112.802 178.43 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 79' ' ' LYS . . . . . 0.536 ' HD3' ' HA ' ' A' ' 86' ' ' LEU . 36.6 ttmt -68.19 -30.31 69.38 Favored 'General case' 0 C--N 1.315 -0.894 0 C-N-CA 125.409 1.484 . . . . 72.45 110.395 -175.328 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -71.11 -37.67 63.79 Favored Glycine 0 CA--C 1.536 1.364 0 CA-C-N 115.798 -0.637 . . . . 51.34 112.571 170.062 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 4.2 tt -63.88 -53.79 44.99 Favored 'General case' 0 N--CA 1.491 1.597 0 C-N-CA 124.043 0.937 . . . . 62.51 108.979 179.951 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 76.3 mt -60.6 -46.34 90.63 Favored 'General case' 0 CA--C 1.54 0.559 0 C-N-CA 124.705 1.202 . . . . 65.34 110.048 178.788 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 7.4 tt0 64.51 26.34 13.36 Favored 'General case' 0 CA--C 1.556 1.185 0 CA-C-N 114.582 -1.19 . . . . 74.22 111.512 171.862 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 21.8 mt-30 -83.69 -76.99 0.27 Allowed 'General case' 0 N--CA 1.478 0.946 0 N-CA-C 109.995 -0.372 . . . . 70.44 109.995 -178.436 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 85' ' ' ARG . . . . . . . . . . . . . 30.9 ttm180 -173.2 143.3 1.1 Allowed 'General case' 0 N--CA 1.492 1.65 0 C-N-CA 123.852 0.861 . . . . 75.23 109.279 -177.379 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 86' ' ' LEU . . . . . 0.536 ' HA ' ' HD3' ' A' ' 79' ' ' LYS . 79.4 mt -47.41 -25.6 1.09 Allowed 'General case' 0 N--CA 1.494 1.727 0 N-CA-C 114.836 1.421 . . . . 64.41 114.836 -168.534 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 2.3 m-20 -77.4 -12.01 59.91 Favored 'General case' 0 N--CA 1.489 1.523 0 N-CA-C 113.305 0.854 . . . . 71.34 113.305 -174.734 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 88' ' ' GLU . . . . . 0.55 ' HG3' ' HG ' ' A' ' 89' ' ' LEU . 12.1 pt-20 -58.22 -40.72 82.39 Favored 'General case' 0 N--CA 1.484 1.251 0 C-N-CA 124.442 1.097 . . . . 73.34 112.82 -174.969 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 89' ' ' LEU . . . . . 0.55 ' HG ' ' HG3' ' A' ' 88' ' ' GLU . 74.5 mt -114.51 13.95 17.67 Favored 'General case' 0 N--CA 1.484 1.269 0 C-N-CA 123.507 0.723 . . . . 72.22 110.511 -179.136 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 35.1 m -132.56 -95.87 0.32 Allowed 'General case' 0 CA--C 1.557 1.222 0 C-N-CA 123.466 0.706 . . . . 62.12 110.372 -177.721 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 22.8 t 54.45 29.14 10.58 Favored 'General case' 0 N--CA 1.495 1.775 0 C-N-CA 123.909 0.884 . . . . 73.3 112.391 -177.859 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 76.3 mt -81.83 -83.08 0.12 Allowed 'General case' 0 N--CA 1.48 1.055 0 N-CA-C 112.574 0.583 . . . . 62.51 112.574 -166.981 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 36.7 mt -82.28 75.03 0.93 Allowed 'Isoleucine or valine' 0 N--CA 1.475 0.811 0 N-CA-C 108.144 -1.058 . . . . 44.22 108.144 -177.193 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 75.32 -77.04 1.23 Allowed Glycine 0 C--N 1.347 1.146 0 CA-C-N 114.61 -1.177 . . . . 52.25 111.098 -169.092 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 84.4 mt-30 -104.59 -159.96 0.74 Allowed 'General case' 0 CA--C 1.549 0.922 0 C-N-CA 124.187 0.995 . . . . 71.13 110.593 -178.259 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 20.4 p -76.87 44.83 0.4 Allowed 'General case' 0 N--CA 1.478 0.97 0 C-N-CA 125.142 1.377 . . . . 70.23 113.159 176.334 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 28.5 m -62.21 -18.56 61.44 Favored 'General case' 0 CA--C 1.555 1.17 0 C-N-CA 124.785 1.234 . . . . 73.25 111.915 177.782 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 12.7 ttp85 -52.48 -55.38 22.34 Favored 'General case' 0 C--N 1.363 1.182 0 C-N-CA 124.435 1.094 . . . . 63.3 113.511 -172.278 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 7.3 tp60 -60.36 -44.41 95.61 Favored 'General case' 0 N--CA 1.478 0.935 0 O-C-N 123.916 0.76 . . . . 52.01 109.71 -173.824 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 27.0 mtpp -64.59 -40.75 96.09 Favored 'General case' 0 N--CA 1.477 0.879 0 CA-C-N 114.716 -1.129 . . . . 75.12 111.682 178.136 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 45.0 t -67.77 -47.73 68.35 Favored 'General case' 0 N--CA 1.478 0.941 0 C-N-CA 124.245 1.018 . . . . 73.4 110.752 -172.4 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 102' ' ' LEU . . . . . 0.513 ' HB2' HD21 ' A' ' 72' ' ' LEU . 10.2 mp -77.52 -30.26 52.79 Favored 'General case' 0 N--CA 1.472 0.652 0 CA-C-N 115.856 -0.611 . . . . 61.05 111.16 -179.236 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 26.0 t-20 -64.28 -46.14 84.97 Favored 'General case' 0 N--CA 1.484 1.267 0 N-CA-C 109.064 -0.717 . . . . 63.34 109.064 176.492 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 104' ' ' ASN . . . . . 0.419 ' O ' ' HG2' ' A' ' 108' ' ' ARG . 40.1 t30 -63.7 -46.27 86.26 Favored 'General case' 0 CA--C 1.539 0.525 0 CA-C-N 115.248 -0.887 . . . . 73.42 109.895 176.35 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -58.03 -37.49 74.45 Favored 'General case' 0 N--CA 1.482 1.146 0 C-N-CA 124.03 0.932 . . . . 73.35 111.438 179.348 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 106' ' ' TYR . . . . . 0.496 ' CE2' ' HB2' ' A' ' 69' ' ' LYS . 12.0 t80 -65.23 -50.37 66.1 Favored 'General case' 0 N--CA 1.475 0.793 0 C-N-CA 123.707 0.803 . . . . 72.52 109.394 177.324 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -60.95 -40.01 97.8 Favored Glycine 0 C--N 1.351 1.362 0 O-C-N 124.01 0.819 . . . . 74.3 112.966 -177.513 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 108' ' ' ARG . . . . . 0.419 ' HG2' ' O ' ' A' ' 104' ' ' ASN . 26.7 mmt180 -75.08 -29.38 60.65 Favored 'General case' 0 CA--C 1.548 0.881 0 C-N-CA 122.764 0.425 . . . . 54.31 110.244 179.307 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 109' ' ' LEU . . . . . 0.498 ' HA ' ' H ' ' A' ' 114' ' ' LEU . 45.6 tp -71.05 -36.63 72.39 Favored 'General case' 0 N--CA 1.492 1.657 0 C-N-CA 123.221 0.608 . . . . 64.42 110.475 176.361 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 45.3 t -69.85 -41.23 75.16 Favored 'General case' 0 CA--C 1.54 0.587 0 CA-C-N 115.019 -0.991 . . . . 63.0 109.604 177.758 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . -89.58 -63.68 1.28 Allowed Glycine 0 C--N 1.359 1.819 0 CA-C-O 119.42 -0.656 . . . . 53.32 114.438 -175.075 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 112' ' ' MET . . . . . . . . . . . . . 1.1 tmm? -96.26 -67.53 0.84 Allowed 'General case' 0 N--CA 1.493 1.721 0 CA-C-N 118.38 1.09 . . . . 73.11 112.366 -175.125 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 113' ' ' LEU . . . . . 0.507 HD21 ' HB ' ' A' ' 56' ' ' ILE . 1.4 tt 165.77 48.72 0.0 OUTLIER 'General case' 0 N--CA 1.508 2.458 0 C-N-CA 125.704 1.602 . . . . 73.21 107.878 179.755 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 114' ' ' LEU . . . . . 0.498 ' H ' ' HA ' ' A' ' 109' ' ' LEU . 1.3 tt 78.35 -25.3 0.2 Allowed 'General case' 0 N--CA 1.496 1.837 0 C-N-CA 126.76 2.024 . . . . 74.53 111.281 177.171 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 115' ' ' VAL . . . . . . . . . . . . . 18.6 m -88.59 132.92 37.33 Favored Pre-proline 0 CA--C 1.558 1.264 0 N-CA-C 108.698 -0.853 . . . . 73.43 108.698 174.546 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 65.6 Cg_endo -72.33 132.34 19.13 Favored 'Trans proline' 0 C--N 1.369 1.612 0 C-N-CA 122.926 2.417 . . . . 72.32 113.401 -178.25 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 21.5 t70 -81.08 -75.73 0.27 Allowed 'General case' 0 CA--C 1.544 0.738 0 N-CA-C 108.701 -0.852 . . . . 61.12 108.701 170.825 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 118' ' ' ALA . . . . . 0.404 ' HA ' ' HD3' ' A' ' 119' ' ' PRO . . . -171.59 141.52 1.28 Allowed Pre-proline 0 CA--C 1.551 1.004 0 C-N-CA 124.27 1.028 . . . . 52.54 109.433 -178.578 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 119' ' ' PRO . . . . . 0.404 ' HD3' ' HA ' ' A' ' 118' ' ' ALA . 13.0 Cg_exo -70.79 158.07 56.63 Favored 'Trans proline' 0 C--N 1.376 2.012 0 C-N-CA 123.122 2.548 . . . . 64.22 112.847 179.133 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . -77.12 87.31 0.99 Allowed Glycine 0 C--N 1.343 0.932 0 N-CA-C 110.945 -0.862 . . . . 23.25 110.945 173.109 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . -74.13 92.28 2.17 Favored 'General case' 0 CA--C 1.543 0.7 0 C-N-CA 123.318 0.647 . . . . 74.42 110.076 178.334 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 122' ' ' SER . . . . . . . . . . . . . 13.7 p . . . . . 0 C--O 1.256 1.42 0 C-N-CA 124.424 1.089 . . . . 64.23 110.696 -178.296 . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 1' ' ' MET . . . . . 0.501 ' HG2' ' HB ' ' A' ' 4' ' ' THR . 38.6 ttp . . . . . 0 N--CA 1.483 1.219 0 N-CA-C 109.253 -0.647 . . . . 52.24 109.253 . . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 42.5 m -50.25 -50.55 49.65 Favored 'General case' 0 N--CA 1.478 0.958 0 C-N-CA 124.85 1.26 . . . . 75.31 113.405 -170.118 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 37.0 m -56.25 -47.99 77.41 Favored 'General case' 0 N--CA 1.48 1.042 0 C-N-CA 123.249 0.619 . . . . 74.13 111.628 -176.688 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 4' ' ' THR . . . . . 0.508 HG21 HD13 ' A' ' 60' ' ' ILE . 40.9 m -68.66 -44.71 73.53 Favored 'General case' 0 C--N 1.35 0.625 0 CA-C-N 115.614 -0.721 . . . . 63.42 110.979 -179.29 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 83.9 t -62.33 -40.12 86.71 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.939 0 C-N-CA 123.115 0.566 . . . . 73.23 110.88 -177.789 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 6' ' ' GLU . . . . . 0.412 ' O ' ' HG3' ' A' ' 10' ' ' ARG . 34.2 mm-40 -69.21 -39.97 78.29 Favored 'General case' 0 N--CA 1.47 0.561 0 O-C-N 123.554 0.534 . . . . 62.11 110.591 177.226 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 30.4 t80 -65.38 -40.01 92.97 Favored 'General case' 0 CA--C 1.554 1.13 0 C-N-CA 122.67 0.388 . . . . 74.34 110.568 -179.545 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 8' ' ' ILE . . . . . 0.586 HD11 HG23 ' A' ' 60' ' ' ILE . 81.0 mt -68.06 -37.03 77.59 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.161 0 C-N-CA 123.876 0.87 . . . . 54.32 109.723 173.984 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 26.6 t-20 -64.45 -28.7 69.85 Favored 'General case' 0 N--CA 1.483 1.207 0 C-N-CA 124.001 0.92 . . . . 74.31 110.896 176.384 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 10' ' ' ARG . . . . . 0.636 ' HB3' HG22 ' A' ' 47' ' ' VAL . 91.5 mtt180 -82.11 -28.8 32.08 Favored 'General case' 0 CA--C 1.539 0.552 0 C-N-CA 123.474 0.71 . . . . 73.34 110.407 177.135 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 11' ' ' TRP . . . . . . . . . . . . . 53.4 m95 -70.92 -33.54 70.63 Favored 'General case' 0 N--CA 1.48 1.034 0 CA-C-O 119.745 -0.169 . . . . 72.11 110.632 167.608 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 12' ' ' GLN . . . . . 0.44 ' HG2' ' CE2' ' A' ' 67' ' ' TYR . 53.0 mt-30 -60.65 -49.19 78.52 Favored 'General case' 0 C--N 1.361 1.092 0 N-CA-C 107.874 -1.158 . . . . 55.23 107.874 171.838 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 28.5 tpt180 -53.19 -54.16 39.96 Favored 'General case' 0 CA--C 1.551 1.001 0 CA-C-N 114.267 -1.333 . . . . 73.25 111.345 -177.834 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 14' ' ' ILE . . . . . 0.406 HG13 ' O ' ' A' ' 10' ' ' ARG . 52.7 mt -62.38 -49.14 85.14 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.263 0 C-N-CA 122.501 0.321 . . . . 62.42 110.304 179.704 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 15' ' ' ALA . . . . . 0.527 ' HA ' ' HB ' ' A' ' 71' ' ' THR . . . -58.94 -44.15 91.34 Favored 'General case' 0 N--CA 1.485 1.288 0 C-N-CA 124.08 0.952 . . . . 62.2 112.319 -176.004 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 91.1 mt -74.47 -45.27 47.31 Favored 'General case' 0 N--CA 1.479 1.023 0 CA-C-N 114.956 -1.02 . . . . 73.43 110.632 -173.741 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.536 ' O ' ' HG ' ' A' ' 21' ' ' LEU . 90.2 mt -59.8 -51.21 70.72 Favored 'General case' 0 N--CA 1.474 0.748 0 O-C-N 123.588 0.555 . . . . 43.41 110.201 179.041 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 78.1 p -66.01 -37.1 85.06 Favored 'General case' 0 N--CA 1.479 0.993 0 O-C-N 123.698 0.623 . . . . 71.13 111.97 -177.088 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 6.8 tp-100 -63.26 -44.24 95.73 Favored 'General case' 0 C--O 1.25 1.1 0 CA-C-O 121.281 0.563 . . . . 75.43 110.753 178.022 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 35.9 m -59.48 -46.02 90.01 Favored 'General case' 0 CA--C 1.535 0.372 0 CA-C-N 114.978 -1.01 . . . . 74.02 109.823 174.255 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 21' ' ' LEU . . . . . 0.687 HD22 ' HA ' ' A' ' 33' ' ' LEU . 47.9 mt -63.95 -29.27 70.45 Favored 'General case' 0 N--CA 1.473 0.712 0 C-N-CA 123.142 0.577 . . . . 62.13 111.392 -178.836 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.651 ' HA ' HD21 ' A' ' 78' ' ' LEU . 36.5 tp -70.48 -50.99 32.25 Favored 'General case' 0 C--O 1.245 0.818 0 O-C-N 123.332 0.395 . . . . 72.25 110.043 178.842 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 23.8 mt-10 -60.96 -43.14 99.16 Favored 'General case' 0 N--CA 1.483 1.22 0 O-C-N 123.361 0.413 . . . . 74.13 111.435 177.063 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 96.5 mt -63.46 -39.64 94.99 Favored 'General case' 0 N--CA 1.475 0.782 0 C-N-CA 123.604 0.762 . . . . 64.44 110.767 -179.658 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 25' ' ' ALA . . . . . 0.515 ' HB2' HD21 ' A' ' 33' ' ' LEU . . . -63.75 -40.53 96.95 Favored 'General case' 0 N--CA 1.481 1.117 0 C-N-CA 123.246 0.618 . . . . 74.34 111.573 178.004 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 24.0 mt-30 -59.87 -39.54 85.6 Favored 'General case' 0 N--CA 1.484 1.256 0 C-N-CA 123.527 0.731 . . . . 75.55 110.785 173.209 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 47.8 mtt180 -81.61 -5.42 58.02 Favored 'General case' 0 N--CA 1.484 1.254 0 C-N-CA 123.63 0.772 . . . . 73.12 112.155 -179.613 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 79.12 15.97 79.46 Favored Glycine 0 C--N 1.35 1.313 0 O-C-N 123.126 0.266 . . . . 40.22 113.671 177.852 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 18.7 mm-40 -83.41 51.31 1.96 Allowed 'General case' 0 N--CA 1.476 0.859 0 C-N-CA 124.805 1.242 . . . . 53.13 111.248 177.273 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 30' ' ' TRP . . . . . 0.489 ' O ' ' HG ' ' A' ' 34' ' ' LEU . 88.5 m95 -62.33 -27.0 68.75 Favored 'General case' 0 N--CA 1.475 0.808 0 C-N-CA 123.457 0.703 . . . . 72.32 111.369 -177.309 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 11.2 m-20 -51.89 -54.74 25.8 Favored 'General case' 0 N--CA 1.478 0.928 0 O-C-N 123.933 0.771 . . . . 74.04 109.816 171.242 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 93.6 mt -63.18 -28.79 70.29 Favored 'General case' 0 N--CA 1.471 0.586 0 CA-C-N 114.862 -1.063 . . . . 70.34 111.417 -177.335 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 33' ' ' LEU . . . . . 0.687 ' HA ' HD22 ' A' ' 21' ' ' LEU . 8.4 mp -66.62 -42.8 86.24 Favored 'General case' 0 N--CA 1.479 0.977 0 O-C-N 123.151 0.282 . . . . 75.22 110.849 172.206 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.489 ' HG ' ' O ' ' A' ' 30' ' ' TRP . 77.0 mt -68.81 -35.87 77.52 Favored 'General case' 0 N--CA 1.483 1.178 0 O-C-N 123.621 0.575 . . . . 64.34 111.792 -176.826 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 1.3 mp0 -73.51 -55.33 6.47 Favored 'General case' 0 N--CA 1.483 1.21 0 N-CA-C 110.134 -0.321 . . . . 74.11 110.134 176.636 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 36' ' ' GLN . . . . . 0.483 ' HB2' HD21 ' A' ' 21' ' ' LEU . 82.6 mm-40 -65.63 -14.87 62.06 Favored 'General case' 0 N--CA 1.487 1.381 0 C-N-CA 123.516 0.726 . . . . 74.45 112.524 179.775 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 37' ' ' GLU . . . . . 0.522 ' O ' ' HG ' ' A' ' 41' ' ' LEU . 29.8 tt0 -50.36 -53.62 27.76 Favored 'General case' 0 C--O 1.217 -0.657 0 O-C-N 124.228 0.955 . . . . 74.35 110.591 173.386 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 60.7 t -55.58 -43.9 74.52 Favored 'Isoleucine or valine' 0 C--O 1.249 1.052 0 C-N-CA 123.981 0.913 . . . . 55.14 111.361 -175.632 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 19.6 m -61.34 -49.15 78.13 Favored 'General case' 0 N--CA 1.476 0.86 0 CA-C-N 115.517 -0.765 . . . . 53.03 110.398 175.324 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 40.2 t80 -60.38 -40.43 90.81 Favored 'General case' 0 N--CA 1.474 0.745 0 C-N-CA 124.434 1.094 . . . . 74.2 111.448 -176.932 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 41' ' ' LEU . . . . . 0.522 ' HG ' ' O ' ' A' ' 37' ' ' GLU . 71.7 mt -70.69 -46.56 62.93 Favored 'General case' 0 C--N 1.349 0.57 0 C-N-CA 123.62 0.768 . . . . 73.13 110.26 -176.62 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 53.3 tt0 -58.2 -42.39 86.03 Favored 'General case' 0 N--CA 1.474 0.748 0 O-C-N 123.503 0.502 . . . . 75.21 110.638 177.304 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 43' ' ' SER . . . . . 0.468 ' O ' HG23 ' A' ' 47' ' ' VAL . 49.6 m -63.71 -57.01 11.34 Favored 'General case' 0 CA--C 1.542 0.641 0 CA-C-N 115.514 -0.766 . . . . 74.22 112.007 -177.973 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 15.9 tt -63.06 -34.15 64.93 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.88 0 C-N-CA 123.391 0.676 . . . . 72.2 111.115 -174.959 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 45' ' ' GLU . . . . . 0.591 ' HG2' HD22 ' A' ' 92' ' ' LEU . 23.7 mm-40 -61.02 -53.6 55.22 Favored 'General case' 0 C--N 1.359 0.992 0 O-C-N 123.252 0.345 . . . . 70.21 110.594 169.819 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 46' ' ' THR . . . . . 0.43 ' O ' ' HB2' ' A' ' 50' ' ' LYS . 96.0 m -53.26 -34.43 57.21 Favored 'General case' 0 N--CA 1.482 1.155 0 C-N-CA 123.532 0.733 . . . . 73.34 111.664 -176.976 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 47' ' ' VAL . . . . . 0.636 HG22 ' HB3' ' A' ' 10' ' ' ARG . 41.2 t -75.64 -48.57 29.64 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.938 0 C-N-CA 123.189 0.595 . . . . 73.25 111.782 179.019 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 48' ' ' MET . . . . . . . . . . . . . 76.2 mtm -68.78 -30.53 69.15 Favored 'General case' 0 N--CA 1.489 1.485 0 C-N-CA 122.611 0.365 . . . . 74.34 111.736 -177.736 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 51.2 mt-10 -75.64 -18.48 59.66 Favored 'General case' 0 N--CA 1.48 1.063 0 C-N-CA 124.121 0.968 . . . . 71.43 110.867 175.845 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 50' ' ' LYS . . . . . 0.447 ' HE2' HH12 ' A' ' 10' ' ' ARG . 0.1 OUTLIER -93.36 142.52 27.23 Favored 'General case' 0 C--O 1.237 0.409 0 C-N-CA 122.936 0.494 . . . . 71.4 110.056 -175.738 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 36.8 tt0 -79.46 141.41 36.8 Favored 'General case' 0 C--O 1.244 0.814 0 N-CA-C 108.954 -0.758 . . . . 71.54 108.954 173.628 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 52' ' ' THR . . . . . 0.685 HG21 ' HB3' ' A' ' 114' ' ' LEU . 32.1 m -73.78 131.29 82.04 Favored Pre-proline 0 CA--C 1.552 1.033 0 O-C-N 123.624 0.578 . . . . 73.05 110.263 177.255 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 53' ' ' PRO . . . . . 0.413 ' HG2' ' HA ' ' A' ' 4' ' ' THR . 25.5 Cg_exo -65.29 155.12 70.3 Favored 'Trans proline' 0 C--N 1.371 1.743 0 C-N-CA 122.94 2.427 . . . . 74.53 112.814 174.784 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 32.8 Cg_exo -61.49 -47.7 11.05 Favored 'Trans proline' 0 C--N 1.376 1.999 0 C-N-CA 123.603 2.869 . . . . 53.34 112.812 179.268 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . -65.52 84.85 0.08 OUTLIER Glycine 0 C--N 1.347 1.148 0 CA-C-N 115.156 -0.929 . . . . 72.13 113.932 -173.553 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 62.6 mt -121.15 103.99 14.53 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.467 0 N-CA-C 107.932 -1.136 . . . . 73.21 107.932 173.75 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 57' ' ' THR . . . . . 0.444 ' H ' HD12 ' A' ' 60' ' ' ILE . 58.0 p -91.97 -174.36 3.77 Favored 'General case' 0 CA--C 1.544 0.743 0 C-N-CA 123.476 0.711 . . . . 75.01 109.668 175.175 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 3.6 tmt_? -60.52 -52.31 65.72 Favored 'General case' 0 CA--C 1.545 0.774 0 C-N-CA 123.949 0.9 . . . . 73.42 110.905 178.727 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 57.6 p -62.7 -39.11 92.96 Favored 'General case' 0 N--CA 1.481 1.085 0 C-N-CA 123.373 0.669 . . . . 71.44 111.635 -179.563 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 60' ' ' ILE . . . . . 0.586 HG23 HD11 ' A' ' 8' ' ' ILE . 87.0 mt -63.13 -47.98 89.91 Favored 'Isoleucine or valine' 0 C--N 1.349 0.55 0 CA-C-N 115.108 -0.951 . . . . 71.21 110.795 179.065 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 2.9 pt20 -70.97 -25.13 62.58 Favored 'General case' 0 N--CA 1.481 1.104 0 CA-C-N 117.491 0.132 . . . . 74.34 110.997 -177.885 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 53.8 m-20 -65.58 -48.56 71.93 Favored 'General case' 0 N--CA 1.482 1.132 0 C-N-CA 122.268 0.227 . . . . 71.53 111.256 172.647 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 63' ' ' MET . . . . . . . . . . . . . 73.4 mtm -65.87 -45.03 83.59 Favored 'General case' 0 N--CA 1.478 0.953 0 O-C-N 123.448 0.467 . . . . 64.54 111.061 178.29 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 64' ' ' VAL . . . . . 0.45 ' O ' HG13 ' A' ' 68' ' ' ILE . 55.6 t -64.49 -64.59 0.66 Allowed 'Isoleucine or valine' 0 N--CA 1.475 0.796 0 C-N-CA 123.337 0.655 . . . . 62.34 110.389 -178.921 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -63.48 -29.81 71.03 Favored 'General case' 0 N--CA 1.482 1.134 0 C-N-CA 123.053 0.541 . . . . 54.11 111.534 -177.149 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -60.24 -54.01 40.89 Favored Glycine 0 C--N 1.35 1.333 0 O-C-N 123.871 0.732 . . . . 74.21 111.378 174.71 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 67' ' ' TYR . . . . . 0.44 ' CE2' ' HG2' ' A' ' 12' ' ' GLN . 12.1 m-85 -66.44 -33.9 76.73 Favored 'General case' 0 N--CA 1.469 0.513 0 C-N-CA 122.999 0.52 . . . . 73.01 112.109 179.99 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 68' ' ' ILE . . . . . 0.521 ' O ' ' HG ' ' A' ' 72' ' ' LEU . 70.0 mt -59.97 -56.13 19.49 Favored 'Isoleucine or valine' 0 C--N 1.357 0.924 0 N-CA-C 108.982 -0.747 . . . . 71.24 108.982 175.958 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 54.7 tptt -54.42 -48.31 71.8 Favored 'General case' 0 N--CA 1.475 0.777 0 O-C-N 123.994 0.809 . . . . 62.35 110.927 -179.366 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 56.6 mt-30 -57.76 -46.41 84.58 Favored 'General case' 0 N--CA 1.474 0.767 0 O-C-N 124.021 0.825 . . . . 70.13 111.272 179.836 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 71' ' ' THR . . . . . 0.527 ' HB ' ' HA ' ' A' ' 15' ' ' ALA . 14.0 t -79.29 -18.96 51.63 Favored 'General case' 0 C--N 1.353 0.745 0 CA-C-O 118.981 -0.533 . . . . 64.51 111.233 -175.749 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 72' ' ' LEU . . . . . 0.521 ' HG ' ' O ' ' A' ' 68' ' ' ILE . 39.8 mt -70.67 -41.31 72.25 Favored 'General case' 0 N--CA 1.485 1.278 0 N-CA-C 109.627 -0.508 . . . . 64.51 109.627 171.918 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 6.2 m-20 -62.22 -50.17 72.83 Favored 'General case' 0 N--CA 1.474 0.762 0 O-C-N 123.676 0.61 . . . . 73.43 110.187 174.007 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 71.5 m-20 -59.47 -52.0 67.45 Favored 'General case' 0 N--CA 1.481 1.109 0 C-N-CA 122.975 0.51 . . . . 63.31 110.557 -178.712 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 75' ' ' GLU . . . . . 0.416 ' O ' ' HG2' ' A' ' 79' ' ' LYS . 40.1 tp10 -52.75 -56.21 17.28 Favored 'General case' 0 N--CA 1.485 1.286 0 C-N-CA 125.109 1.364 . . . . 74.5 111.455 178.547 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 62.0 tt0 -70.56 -42.14 71.52 Favored 'General case' 0 N--CA 1.473 0.724 0 C-N-CA 123.088 0.555 . . . . 73.41 111.51 -171.336 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 84.4 mt -62.11 -38.4 88.76 Favored 'General case' 0 N--CA 1.483 1.217 0 O-C-N 123.397 0.436 . . . . 44.4 110.677 178.207 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 78' ' ' LEU . . . . . 0.651 HD21 ' HA ' ' A' ' 22' ' ' LEU . 46.0 mt -63.35 -49.1 75.22 Favored 'General case' 0 N--CA 1.476 0.845 0 O-C-N 123.452 0.47 . . . . 54.32 111.396 174.525 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 79' ' ' LYS . . . . . 0.416 ' HG2' ' O ' ' A' ' 75' ' ' GLU . 46.6 mmtm -62.87 -34.03 76.52 Favored 'General case' 0 N--CA 1.485 1.291 0 C-N-CA 122.978 0.511 . . . . 74.54 111.635 -177.766 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -75.28 -35.78 47.23 Favored Glycine 0 C--N 1.346 1.113 0 CA-C-N 115.197 -0.911 . . . . 54.43 112.408 177.125 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 1.5 tt -67.28 -37.37 83.32 Favored 'General case' 0 N--CA 1.477 0.877 0 C-N-CA 123.786 0.834 . . . . 71.3 109.03 178.172 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 82' ' ' LEU . . . . . 0.483 ' HG ' ' O ' ' A' ' 78' ' ' LEU . 60.1 mt -56.77 -43.0 80.39 Favored 'General case' 0 C--N 1.352 0.697 0 C-N-CA 123.768 0.827 . . . . 74.52 111.565 179.683 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 35.7 tt0 68.37 2.75 3.44 Favored 'General case' 0 CA--C 1.565 1.533 0 C-N-CA 124.375 1.07 . . . . 62.53 110.975 -173.019 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 14.9 mm100 -93.88 170.85 9.25 Favored 'General case' 0 N--CA 1.469 0.524 0 C-N-CA 124.284 1.033 . . . . 64.0 110.302 -173.839 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 85' ' ' ARG . . . . . . . . . . . . . 36.3 mmt180 -67.26 156.54 36.08 Favored 'General case' 0 C--O 1.246 0.886 0 CA-C-N 115.474 -0.784 . . . . 71.33 109.467 171.378 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 86' ' ' LEU . . . . . 0.402 ' HB3' ' NH2' ' A' ' 98' ' ' ARG . 94.1 mt -78.35 75.62 4.87 Favored 'General case' 0 CA--C 1.548 0.873 0 CA-C-O 121.612 0.72 . . . . 75.02 110.507 -176.149 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 6.6 p-10 -142.87 -43.63 0.3 Allowed 'General case' 0 N--CA 1.474 0.756 0 C-N-CA 124.55 1.14 . . . . 72.32 108.416 174.331 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 37.3 mt-10 -69.42 122.73 19.54 Favored 'General case' 0 C--N 1.352 0.691 0 C-N-CA 123.465 0.706 . . . . 74.25 109.918 174.971 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 74.4 mt 64.02 11.25 5.98 Favored 'General case' 0 N--CA 1.487 1.388 0 C-N-CA 124.83 1.252 . . . . 73.54 111.906 -175.281 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 90' ' ' SER . . . . . 0.584 ' O ' ' HG ' ' A' ' 92' ' ' LEU . 6.0 m -111.05 -79.98 0.58 Allowed 'General case' 0 C--O 1.217 -0.654 0 N-CA-C 107.927 -1.138 . . . . 64.34 107.927 -176.908 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 32.8 t 54.52 -116.32 1.04 Allowed 'General case' 0 CA--C 1.563 1.476 0 C-N-CA 124.009 0.924 . . . . 63.55 111.039 -176.496 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 92' ' ' LEU . . . . . 0.591 HD22 ' HG2' ' A' ' 45' ' ' GLU . 43.7 mt 48.74 -148.53 0.23 Allowed 'General case' 0 N--CA 1.492 1.647 0 C-N-CA 124.737 1.215 . . . . 71.24 112.629 172.956 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 49.4 mt -53.41 111.12 0.26 Allowed 'Isoleucine or valine' 0 CA--C 1.558 1.26 0 C-N-CA 123.892 0.877 . . . . 74.13 110.182 167.203 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -76.86 0.61 65.44 Favored Glycine 0 C--N 1.35 1.314 0 CA-C-N 115.82 -0.627 . . . . 71.43 114.114 -175.561 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 9.9 tt0 -69.69 -11.58 60.96 Favored 'General case' 0 N--CA 1.48 1.071 0 C-N-CA 123.858 0.863 . . . . 64.13 110.67 169.254 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 19.6 t 73.25 17.49 3.97 Favored 'General case' 0 C--N 1.358 0.973 0 C-N-CA 124.944 1.298 . . . . 71.41 111.453 176.856 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 13.5 t -86.57 16.7 4.41 Favored 'General case' 0 CA--C 1.553 1.067 0 C-N-CA 123.732 0.813 . . . . 45.53 111.571 -179.346 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 98' ' ' ARG . . . . . 0.402 ' NH2' ' HB3' ' A' ' 86' ' ' LEU . 14.3 mtm-85 -65.59 -58.13 6.49 Favored 'General case' 0 N--CA 1.489 1.515 0 C-N-CA 123.839 0.855 . . . . 74.34 112.554 -167.441 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 8.1 tt0 -63.4 -37.81 88.73 Favored 'General case' 0 CA--C 1.542 0.65 0 CA-C-N 115.296 -0.865 . . . . 72.14 109.675 178.344 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 51.5 tttm -68.17 -26.45 65.75 Favored 'General case' 0 CA--C 1.546 0.816 0 CA-C-N 114.794 -1.094 . . . . 72.22 111.357 177.766 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 47.2 t -73.23 -48.39 35.4 Favored 'General case' 0 N--CA 1.471 0.608 0 C-N-CA 123.502 0.721 . . . . 32.42 109.159 -178.509 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 9.5 mp -69.3 -30.1 68.1 Favored 'General case' 0 N--CA 1.484 1.266 0 O-C-N 123.498 0.499 . . . . 51.14 111.418 176.225 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 6.8 t30 -71.01 -50.33 35.37 Favored 'General case' 0 N--CA 1.478 0.964 0 CA-C-O 121.055 0.455 . . . . 71.31 110.499 179.642 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 10.8 m120 -71.09 -18.9 62.52 Favored 'General case' 0 N--CA 1.479 1.016 0 C-N-CA 123.072 0.549 . . . . 50.1 111.091 176.449 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -64.91 -47.43 77.77 Favored 'General case' 0 C--N 1.349 0.572 0 O-C-N 123.626 0.579 . . . . 75.03 109.795 169.18 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 106' ' ' TYR . . . . . . . . . . . . . 1.1 t80 -58.11 -45.02 87.97 Favored 'General case' 0 N--CA 1.482 1.161 0 N-CA-C 109.482 -0.562 . . . . 73.53 109.482 174.225 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -58.79 -44.85 95.62 Favored Glycine 0 C--N 1.35 1.361 0 CA-C-N 115.778 -0.646 . . . . 54.31 113.345 -179.777 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 31.4 ptt180 -81.7 -14.53 56.44 Favored 'General case' 0 N--CA 1.476 0.828 0 C-N-CA 122.746 0.418 . . . . 73.22 111.051 -179.979 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 109' ' ' LEU . . . . . 0.567 HD13 ' HB2' ' A' ' 114' ' ' LEU . 36.4 tp -70.83 -43.37 68.7 Favored 'General case' 0 N--CA 1.486 1.373 0 N-CA-C 109.218 -0.66 . . . . 73.45 109.218 171.012 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 19.1 m -71.83 -36.44 70.2 Favored 'General case' 0 CA--C 1.547 0.837 0 CA-C-N 114.984 -1.007 . . . . 70.41 110.376 177.762 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . -91.02 -61.61 1.26 Allowed Glycine 0 C--N 1.358 1.789 0 N-CA-C 114.585 0.594 . . . . 65.22 114.585 -177.568 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 112' ' ' MET . . . . . . . . . . . . . 12.5 tpt -91.83 -69.72 0.73 Allowed 'General case' 0 N--CA 1.488 1.431 0 N-CA-C 112.961 0.726 . . . . 42.4 112.961 -172.377 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 18.8 tp 170.75 21.92 0.0 OUTLIER 'General case' 0 N--CA 1.493 1.721 0 C-N-CA 124.54 1.136 . . . . 70.34 110.593 -178.543 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 114' ' ' LEU . . . . . 0.685 ' HB3' HG21 ' A' ' 52' ' ' THR . 39.0 tp 72.68 -5.02 1.95 Allowed 'General case' 0 N--CA 1.499 1.999 0 C-N-CA 124.788 1.235 . . . . 74.05 111.698 -175.922 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 115' ' ' VAL . . . . . . . . . . . . . 30.2 m -83.2 141.93 43.5 Favored Pre-proline 0 CA--C 1.55 0.963 0 N-CA-C 108.804 -0.813 . . . . 75.34 108.804 173.552 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 29.5 Cg_endo -61.42 115.53 2.82 Favored 'Trans proline' 0 C--N 1.372 1.798 0 C-N-CA 122.789 2.326 . . . . 40.45 112.518 -177.164 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 32.9 t70 -155.42 -74.93 0.11 Allowed 'General case' 0 N--CA 1.474 0.743 0 C-N-CA 123.032 0.533 . . . . 71.33 109.6 176.993 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . 64.58 132.52 0.03 OUTLIER Pre-proline 0 CA--C 1.558 1.265 0 C-N-CA 124.768 1.227 . . . . 53.33 111.698 -176.675 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 119' ' ' PRO . . . . . . . . . . . . . 76.4 Cg_endo -81.41 -163.64 0.23 Allowed 'Trans proline' 0 C--N 1.371 1.722 0 C-N-CA 122.52 2.147 . . . . 55.5 111.195 177.663 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . -79.13 61.44 4.13 Favored Glycine 0 C--N 1.342 0.893 0 N-CA-C 111.546 -0.621 . . . . 72.33 111.546 171.182 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . -81.91 76.71 8.8 Favored 'General case' 0 C--N 1.35 0.624 0 C-N-CA 124.038 0.935 . . . . 71.43 109.808 -175.67 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 122' ' ' SER . . . . . . . . . . . . . 24.7 t . . . . . 0 C--O 1.255 1.371 0 C-N-CA 124.231 1.012 . . . . 43.44 110.116 -178.042 . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 25.3 ttt . . . . . 0 CA--C 1.558 1.257 0 N-CA-C 110.369 -0.234 . . . . 54.1 110.369 . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 74.1 p -55.63 -56.48 19.85 Favored 'General case' 0 N--CA 1.489 1.523 0 C-N-CA 123.957 0.903 . . . . 42.31 112.546 -171.971 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 34.1 t -65.23 -30.63 71.54 Favored 'General case' 0 N--CA 1.478 0.94 0 C-N-CA 123.208 0.603 . . . . 61.14 111.474 -177.178 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 4' ' ' THR . . . . . 0.468 ' HA ' ' HG3' ' A' ' 53' ' ' PRO . 28.0 m -72.27 -43.03 64.88 Favored 'General case' 0 N--CA 1.471 0.624 0 C-N-CA 123.162 0.585 . . . . 70.31 111.214 179.078 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 76.6 t -63.59 -45.77 96.72 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.759 0 N-CA-C 109.2 -0.667 . . . . 62.14 109.2 179.29 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 24.1 mm-40 -56.66 -51.63 68.01 Favored 'General case' 0 N--CA 1.475 0.783 0 O-C-N 124.058 0.849 . . . . 74.51 110.627 174.226 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 34.0 t80 -58.11 -53.65 55.84 Favored 'General case' 0 N--CA 1.481 1.122 0 C-N-CA 124.195 0.998 . . . . 73.34 111.496 -173.577 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 8' ' ' ILE . . . . . 0.408 ' O ' ' HG3' ' A' ' 12' ' ' GLN . 72.1 mt -61.77 -45.32 98.94 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.967 0 C-N-CA 123.54 0.736 . . . . 61.15 110.151 178.776 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 26.2 t-20 -62.01 -32.86 73.38 Favored 'General case' 0 N--CA 1.488 1.436 0 C-N-CA 123.894 0.878 . . . . 74.24 111.954 -177.897 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 10' ' ' ARG . . . . . 0.412 ' O ' HG13 ' A' ' 14' ' ' ILE . 96.6 mtt180 -78.13 -34.75 49.75 Favored 'General case' 0 C--O 1.214 -0.773 0 CA-C-N 115.954 -0.566 . . . . 74.31 110.042 178.694 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 11' ' ' TRP . . . . . . . . . . . . . 53.0 m95 -67.28 -33.76 75.98 Favored 'General case' 0 N--CA 1.482 1.163 0 O-C-N 122.916 0.135 . . . . 74.22 111.131 172.037 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 12' ' ' GLN . . . . . 0.444 ' HG2' ' CE2' ' A' ' 67' ' ' TYR . 51.4 mt-30 -61.42 -48.41 81.31 Favored 'General case' 0 C--O 1.218 -0.562 0 N-CA-C 108.327 -0.99 . . . . 73.41 108.327 171.939 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 79.2 ttt180 -62.56 -48.59 78.83 Favored 'General case' 0 C--O 1.216 -0.687 0 O-C-N 124.638 1.211 . . . . 74.33 111.373 -175.799 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 14' ' ' ILE . . . . . 0.412 HG13 ' O ' ' A' ' 10' ' ' ARG . 90.9 mt -62.44 -43.12 97.93 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.002 0 C-N-CA 123.615 0.766 . . . . 61.41 109.69 -179.312 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 15' ' ' ALA . . . . . 0.619 ' HA ' ' HB ' ' A' ' 71' ' ' THR . . . -60.79 -44.3 97.0 Favored 'General case' 0 N--CA 1.482 1.139 0 C-N-CA 123.373 0.669 . . . . 73.32 111.799 176.645 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 87.8 mt -74.76 -35.58 62.58 Favored 'General case' 0 N--CA 1.485 1.301 0 CA-C-N 115.143 -0.935 . . . . 73.4 111.038 -175.027 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.508 ' O ' ' HG ' ' A' ' 21' ' ' LEU . 72.4 mt -72.05 -47.31 52.57 Favored 'General case' 0 N--CA 1.475 0.798 0 C-N-CA 122.912 0.485 . . . . 74.21 109.742 -177.721 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 79.3 p -65.1 -36.0 82.9 Favored 'General case' 0 N--CA 1.48 1.048 0 C-N-CA 123.04 0.536 . . . . 72.31 111.091 176.951 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 26.9 tp60 -61.88 -45.57 93.16 Favored 'General case' 0 N--CA 1.475 0.79 0 C-N-CA 123.391 0.676 . . . . 74.12 110.189 174.971 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 20' ' ' SER . . . . . 0.404 ' O ' ' HG ' ' A' ' 24' ' ' LEU . 66.5 m -58.79 -52.93 63.63 Favored 'General case' 0 C--O 1.202 -1.442 0 CA-C-N 114.929 -1.032 . . . . 75.24 109.584 174.7 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 21' ' ' LEU . . . . . 0.643 HD22 ' HA ' ' A' ' 33' ' ' LEU . 52.6 mt -62.22 -27.69 69.16 Favored 'General case' 0 N--CA 1.473 0.699 0 C-N-CA 123.676 0.79 . . . . 74.43 111.323 -175.963 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.673 ' HA ' HD21 ' A' ' 78' ' ' LEU . 56.8 tp -70.51 -54.09 13.59 Favored 'General case' 0 N--CA 1.472 0.651 0 C-N-CA 122.953 0.501 . . . . 74.12 109.894 176.691 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 23' ' ' GLU . . . . . 0.441 ' O ' ' HG3' ' A' ' 27' ' ' ARG . 44.6 mt-10 -59.12 -52.74 64.43 Favored 'General case' 0 CA--C 1.545 0.776 0 O-C-N 123.929 0.768 . . . . 74.44 110.246 179.506 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.461 ' HB3' ' HB2' ' A' ' 29' ' ' GLU . 92.2 mt -53.56 -42.56 67.65 Favored 'General case' 0 N--CA 1.479 1.007 0 C-N-CA 125.441 1.496 . . . . 75.11 112.174 176.578 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 25' ' ' ALA . . . . . 0.512 ' HB2' HD21 ' A' ' 33' ' ' LEU . . . -58.28 -47.68 82.87 Favored 'General case' 0 N--CA 1.484 1.237 0 C-N-CA 122.944 0.498 . . . . 74.02 110.901 176.918 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 90.8 mt-30 -66.59 -30.34 70.61 Favored 'General case' 0 CA--C 1.555 1.157 0 CA-C-N 114.99 -1.005 . . . . 73.33 111.141 178.721 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 27' ' ' ARG . . . . . 0.441 ' HG3' ' O ' ' A' ' 23' ' ' GLU . 94.9 mtt180 -78.38 -17.81 55.94 Favored 'General case' 0 N--CA 1.483 1.202 0 C-N-CA 123.857 0.863 . . . . 75.45 111.326 178.253 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 92.43 9.27 61.83 Favored Glycine 0 N--CA 1.475 1.283 0 C-N-CA 122.922 0.296 . . . . 51.13 113.564 -178.231 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 29' ' ' GLU . . . . . 0.461 ' HB2' ' HB3' ' A' ' 24' ' ' LEU . 5.4 mm-40 -82.58 53.72 2.42 Favored 'General case' 0 CA--C 1.55 0.973 0 C-N-CA 124.387 1.075 . . . . 72.21 111.014 178.09 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 30' ' ' TRP . . . . . . . . . . . . . 86.4 m95 -63.56 -28.89 70.25 Favored 'General case' 0 N--CA 1.483 1.187 0 C-N-CA 123.902 0.881 . . . . 73.11 111.717 -176.404 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 31' ' ' ASP . . . . . 0.485 ' O ' ' HG3' ' A' ' 35' ' ' GLN . 3.4 m-20 -53.23 -46.37 69.1 Favored 'General case' 0 N--CA 1.475 0.823 0 C-N-CA 123.603 0.761 . . . . 53.42 110.548 174.789 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.438 HD12 HD22 ' A' ' 24' ' ' LEU . 64.9 mt -67.14 -28.25 67.98 Favored 'General case' 0 CA--C 1.549 0.94 0 CA-C-N 115.501 -0.772 . . . . 74.22 111.34 -176.527 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 33' ' ' LEU . . . . . 0.643 ' HA ' HD22 ' A' ' 21' ' ' LEU . 9.6 mp -68.61 -43.81 75.6 Favored 'General case' 0 N--CA 1.486 1.36 0 C-N-CA 123.122 0.569 . . . . 72.42 110.116 173.365 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 79.3 mt -64.36 -36.97 85.86 Favored 'General case' 0 CA--C 1.551 0.986 0 CA-C-N 115.324 -0.853 . . . . 73.02 111.348 178.844 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 35' ' ' GLN . . . . . 0.485 ' HG3' ' O ' ' A' ' 31' ' ' ASP . 90.4 mt-30 -69.74 -51.55 33.23 Favored 'General case' 0 N--CA 1.481 1.119 0 C-N-CA 123.292 0.637 . . . . 72.12 110.312 177.608 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 36' ' ' GLN . . . . . 0.443 ' HB2' HD21 ' A' ' 21' ' ' LEU . 77.2 mm-40 -70.87 -14.25 62.33 Favored 'General case' 0 N--CA 1.477 0.888 0 CA-C-N 115.248 -0.887 . . . . 73.42 112.993 -177.73 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 38.3 tt0 -45.31 -51.38 11.07 Favored 'General case' 0 N--CA 1.487 1.377 0 CA-C-N 118.287 0.494 . . . . 73.12 111.373 174.241 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 81.4 t -61.12 -54.57 33.52 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.793 0 O-C-N 123.877 0.736 . . . . 72.51 110.74 -179.027 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 21.9 m -65.51 -52.09 55.21 Favored 'General case' 0 CA--C 1.551 1.006 0 C-N-CA 123.525 0.73 . . . . 71.44 112.507 -173.441 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 44.4 t80 -60.58 -51.53 69.01 Favored 'General case' 0 N--CA 1.478 0.951 0 C-N-CA 124.792 1.237 . . . . 71.34 111.904 -179.077 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 41' ' ' LEU . . . . . 0.54 ' HA ' HG22 ' A' ' 44' ' ' ILE . 64.4 mt -77.81 -23.35 49.1 Favored 'General case' 0 CA--C 1.546 0.793 0 CA-C-N 116.317 -0.401 . . . . 75.32 111.604 -174.688 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 51.8 tt0 -66.54 -44.49 82.24 Favored 'General case' 0 N--CA 1.484 1.255 0 N-CA-C 109.435 -0.579 . . . . 65.45 109.435 168.7 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 43' ' ' SER . . . . . 0.432 ' O ' HG23 ' A' ' 47' ' ' VAL . 74.3 m -60.79 -43.51 98.0 Favored 'General case' 0 N--CA 1.476 0.859 0 C-N-CA 123.251 0.62 . . . . 71.33 111.582 179.465 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 44' ' ' ILE . . . . . 0.54 HG22 ' HA ' ' A' ' 41' ' ' LEU . 12.5 tt -69.02 -40.45 80.86 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.972 0 O-C-N 123.121 0.263 . . . . 54.44 110.464 -178.145 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 14.3 mm-40 -58.81 -42.51 89.34 Favored 'General case' 0 N--CA 1.484 1.251 0 C-N-CA 122.895 0.478 . . . . 62.05 110.767 172.747 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 99.4 m -62.0 -43.37 98.97 Favored 'General case' 0 N--CA 1.48 1.059 0 C-N-CA 123.919 0.888 . . . . 51.53 111.578 -179.437 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 47' ' ' VAL . . . . . 0.432 HG23 ' O ' ' A' ' 43' ' ' SER . 58.0 t -67.95 -41.89 85.07 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.012 0 C-N-CA 122.269 0.228 . . . . 63.03 110.938 178.889 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 48' ' ' MET . . . . . . . . . . . . . 78.4 mtm -68.91 -34.45 75.41 Favored 'General case' 0 N--CA 1.484 1.244 0 N-CA-C 112.479 0.548 . . . . 42.54 112.479 -177.468 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 13.1 pt-20 -82.33 -24.22 34.7 Favored 'General case' 0 N--CA 1.487 1.407 0 C-N-CA 122.355 0.262 . . . . 72.21 111.359 179.574 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 13.4 mptt -83.72 143.66 29.87 Favored 'General case' 0 N--CA 1.479 1.021 0 C-N-CA 122.914 0.486 . . . . 75.51 110.228 177.808 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 51.1 tt0 -74.55 137.48 42.44 Favored 'General case' 0 CA--C 1.542 0.645 0 CA-C-N 114.975 -1.011 . . . . 72.32 110.581 -178.869 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 17.4 m -62.95 132.76 95.09 Favored Pre-proline 0 CA--C 1.561 1.397 0 O-C-N 123.799 0.687 . . . . 62.24 110.381 175.637 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 53' ' ' PRO . . . . . 0.468 ' HG3' ' HA ' ' A' ' 4' ' ' THR . 61.0 Cg_endo -70.05 156.26 63.0 Favored 'Trans proline' 0 C--N 1.377 2.072 0 C-N-CA 122.645 2.23 . . . . 63.11 112.424 177.376 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 35.6 Cg_endo -64.5 -47.57 5.51 Favored 'Trans proline' 0 C--N 1.374 1.891 0 C-N-CA 122.803 2.335 . . . . 71.22 113.284 175.61 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . -67.14 83.34 0.12 Allowed Glycine 0 C--N 1.347 1.154 0 O-C-N 123.866 0.729 . . . . 71.32 113.613 -174.115 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 60.5 mt -124.86 103.02 11.71 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.455 0 C-N-CA 124.203 1.001 . . . . 72.34 108.455 175.164 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 57' ' ' THR . . . . . 0.423 ' H ' HD12 ' A' ' 60' ' ' ILE . 81.9 p -83.67 -178.9 7.17 Favored 'General case' 0 N--CA 1.473 0.712 0 N-CA-C 109.244 -0.65 . . . . 62.34 109.244 170.547 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 27.1 tpt180 -69.04 -35.53 76.69 Favored 'General case' 0 N--CA 1.472 0.626 0 N-CA-C 110.016 -0.364 . . . . 74.31 110.016 177.261 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 35.9 m -60.49 -47.9 84.1 Favored 'General case' 0 CA--C 1.546 0.799 0 C-N-CA 123.212 0.605 . . . . 71.34 110.716 176.508 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 60' ' ' ILE . . . . . 0.423 HD12 ' H ' ' A' ' 57' ' ' THR . 86.1 mt -61.75 -42.73 95.52 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.814 0 CA-C-N 115.097 -0.956 . . . . 74.31 110.405 176.347 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 64.5 tt0 -65.26 -36.3 83.7 Favored 'General case' 0 N--CA 1.476 0.864 0 C-N-CA 123.754 0.822 . . . . 52.15 111.597 -178.129 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 37.2 m-20 -75.68 -38.1 59.01 Favored 'General case' 0 N--CA 1.481 1.079 0 C-N-CA 122.831 0.452 . . . . 62.24 111.786 179.924 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 63' ' ' MET . . . . . . . . . . . . . 72.3 mtm -66.8 -51.55 54.43 Favored 'General case' 0 N--CA 1.482 1.125 0 C-N-CA 122.4 0.28 . . . . 75.45 110.446 176.649 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 64' ' ' VAL . . . . . 0.488 ' O ' HG13 ' A' ' 68' ' ' ILE . 55.5 t -59.58 -58.97 4.7 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.765 0 C-N-CA 123.524 0.73 . . . . 73.35 110.768 179.128 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 65' ' ' ALA . . . . . 0.485 ' HB2' HD23 ' A' ' 109' ' ' LEU . . . -62.26 -35.94 80.53 Favored 'General case' 0 N--CA 1.488 1.475 0 C-N-CA 122.567 0.347 . . . . 51.14 111.876 -178.405 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -59.27 -41.68 96.93 Favored Glycine 0 C--N 1.347 1.172 0 N-CA-C 111.776 -0.529 . . . . 72.42 111.776 175.138 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 67' ' ' TYR . . . . . 0.444 ' CE2' ' HG2' ' A' ' 12' ' ' GLN . 10.7 m-30 -78.86 -29.81 44.75 Favored 'General case' 0 N--CA 1.467 0.422 0 N-CA-C 113.198 0.814 . . . . 74.42 113.198 -179.902 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 68' ' ' ILE . . . . . 0.488 HG13 ' O ' ' A' ' 64' ' ' VAL . 59.4 mt -64.85 -51.64 64.35 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.095 0 N-CA-C 108.414 -0.958 . . . . 74.11 108.414 174.702 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 20.2 tptm -55.21 -45.17 75.89 Favored 'General case' 0 N--CA 1.474 0.767 0 O-C-N 123.913 0.758 . . . . 73.21 110.57 175.119 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 55.4 tt0 -61.38 -45.39 94.55 Favored 'General case' 0 C--N 1.352 0.717 0 O-C-N 123.818 0.699 . . . . 75.35 110.848 -176.3 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 71' ' ' THR . . . . . 0.619 ' HB ' ' HA ' ' A' ' 15' ' ' ALA . 11.1 t -78.3 -28.1 47.4 Favored 'General case' 0 C--N 1.353 0.752 0 O-C-N 122.999 0.187 . . . . 75.54 110.999 -173.864 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 72' ' ' LEU . . . . . 0.433 ' O ' ' HB2' ' A' ' 76' ' ' GLN . 36.0 mt -73.64 -29.54 62.4 Favored 'General case' 0 N--CA 1.474 0.748 0 O-C-N 123.407 0.442 . . . . 74.41 110.658 174.966 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 33.3 t70 -77.22 -43.49 33.4 Favored 'General case' 0 N--CA 1.48 1.055 0 O-C-N 123.907 0.754 . . . . 75.32 110.678 178.927 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 74' ' ' ASN . . . . . 0.431 ' HA ' HD22 ' A' ' 22' ' ' LEU . 82.7 m-20 -59.66 -49.57 77.25 Favored 'General case' 0 N--CA 1.472 0.638 0 CA-C-N 115.613 -0.721 . . . . 65.5 109.676 176.499 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 75' ' ' GLU . . . . . 0.43 ' HA ' ' HB2' ' A' ' 78' ' ' LEU . 25.5 tt0 -74.7 -23.1 58.55 Favored 'General case' 0 CA--C 1.552 1.027 0 CA-C-N 115.082 -0.963 . . . . 64.42 111.494 179.609 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 76' ' ' GLN . . . . . 0.433 ' HB2' ' O ' ' A' ' 72' ' ' LEU . 60.7 tt0 -58.88 -48.31 81.84 Favored 'General case' 0 N--CA 1.488 1.426 0 N-CA-C 109.085 -0.709 . . . . 72.42 109.085 172.283 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 82.6 mt -67.56 -43.72 79.97 Favored 'General case' 0 CA--C 1.548 0.869 0 CA-C-N 115.169 -0.923 . . . . 72.22 111.183 177.451 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 78' ' ' LEU . . . . . 0.673 HD21 ' HA ' ' A' ' 22' ' ' LEU . 61.1 mt -62.18 -58.75 6.61 Favored 'General case' 0 N--CA 1.486 1.343 0 C-N-CA 123.35 0.66 . . . . 74.32 112.474 -178.421 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 79' ' ' LYS . . . . . 0.612 ' HB3' ' HA ' ' A' ' 84' ' ' GLN . 46.3 mmtm -64.49 -34.47 78.29 Favored 'General case' 0 CA--C 1.553 1.08 0 C-N-CA 123.159 0.584 . . . . 72.24 110.611 176.794 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -62.5 -28.3 71.01 Favored Glycine 0 C--N 1.346 1.137 0 CA-C-N 116.695 -0.23 . . . . 72.2 112.928 175.396 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 8.6 tt -86.16 -47.13 9.76 Favored 'General case' 0 CA--C 1.545 0.769 0 C-N-CA 123.871 0.868 . . . . 72.45 109.728 175.281 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 50.4 mt -87.3 -66.15 0.94 Allowed 'General case' 0 N--CA 1.478 0.938 0 C-N-CA 123.682 0.793 . . . . 53.4 110.667 -166.415 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 2.0 mm100 -177.92 97.3 0.04 OUTLIER 'General case' 0 N--CA 1.475 0.786 0 C-N-CA 125.002 1.321 . . . . 73.12 108.91 -172.486 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 84' ' ' GLN . . . . . 0.612 ' HA ' ' HB3' ' A' ' 79' ' ' LYS . 7.2 tt0 -43.77 -53.98 5.51 Favored 'General case' 0 N--CA 1.491 1.583 0 C-N-CA 124.761 1.224 . . . . 75.5 111.492 172.27 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 85' ' ' ARG . . . . . . . . . . . . . 99.6 mtt180 -70.01 130.45 42.2 Favored 'General case' 0 CA--C 1.543 0.702 0 CA-C-N 114.517 -1.22 . . . . 64.54 108.979 170.339 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 72.8 mt -54.01 110.31 0.58 Allowed 'General case' 0 N--CA 1.478 0.938 0 C-N-CA 123.904 0.882 . . . . 74.21 110.527 -179.535 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 14.0 t70 -157.44 -62.15 0.09 Allowed 'General case' 0 CA--C 1.541 0.619 0 N-CA-C 109.303 -0.628 . . . . 74.22 109.303 -171.869 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 34.6 mm-40 -67.1 -42.49 84.49 Favored 'General case' 0 N--CA 1.486 1.33 0 C-N-CA 122.962 0.505 . . . . 75.55 110.69 172.709 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 90.5 mt -136.09 109.16 7.69 Favored 'General case' 0 CA--C 1.544 0.723 0 N-CA-C 107.576 -1.268 . . . . 63.45 107.576 176.131 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 90' ' ' SER . . . . . 0.465 ' O ' HD13 ' A' ' 41' ' ' LEU . 14.0 m -113.78 -89.23 0.54 Allowed 'General case' 0 N--CA 1.482 1.14 0 C-N-CA 123.112 0.565 . . . . 61.53 110.674 -176.351 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 22.1 t 50.64 26.12 2.34 Favored 'General case' 0 N--CA 1.499 1.976 0 C-N-CA 124.861 1.264 . . . . 64.3 114.314 174.867 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 92' ' ' LEU . . . . . 0.456 ' HG ' ' O ' ' A' ' 90' ' ' SER . 97.7 mt -124.67 -173.12 2.71 Favored 'General case' 0 N--CA 1.491 1.576 0 C-N-CA 123.582 0.753 . . . . 71.22 110.863 -178.487 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 60.4 mt -59.04 -71.61 0.1 Allowed 'Isoleucine or valine' 0 N--CA 1.482 1.146 0 C-N-CA 124.023 0.929 . . . . 75.41 111.768 -178.608 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -139.53 -123.26 2.05 Favored Glycine 0 C--N 1.346 1.135 0 N-CA-C 112.099 -0.401 . . . . 44.01 112.099 -173.949 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -88.46 148.2 24.29 Favored 'General case' 0 N--CA 1.477 0.91 0 C-N-CA 122.896 0.478 . . . . 73.33 109.881 176.099 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 70.2 p 52.26 -79.88 0.01 OUTLIER 'General case' 0 CA--C 1.559 1.289 0 C-N-CA 125.79 1.636 . . . . 63.13 111.972 -175.705 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 28.1 m 66.74 -80.35 0.03 OUTLIER 'General case' 0 CA--C 1.555 1.145 0 C-N-CA 125.188 1.395 . . . . 54.1 111.905 175.779 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 98' ' ' ARG . . . . . 0.47 ' HB2' HD13 ' A' ' 44' ' ' ILE . 0.0 OUTLIER -62.64 -43.9 97.64 Favored 'General case' 0 N--CA 1.488 1.446 0 N-CA-C 112.581 0.586 . . . . 71.13 112.581 -170.243 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 3.8 pt20 -70.5 -40.06 73.78 Favored 'General case' 0 N--CA 1.477 0.885 0 C-N-CA 122.61 0.364 . . . . 74.32 110.331 -174.768 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 23.6 tptm -66.9 -46.12 75.85 Favored 'General case' 0 CA--C 1.55 0.96 0 C-N-CA 124.144 0.978 . . . . 73.04 110.579 -179.498 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 31.4 t -72.68 -39.56 66.97 Favored 'General case' 0 N--CA 1.476 0.835 0 CA-C-N 115.155 -0.93 . . . . 70.45 111.546 -174.437 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 11.2 mp -78.39 -29.69 47.41 Favored 'General case' 0 N--CA 1.485 1.281 0 C-N-CA 122.684 0.394 . . . . 73.13 111.54 -179.838 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 50.1 t-20 -64.97 -45.85 83.96 Favored 'General case' 0 N--CA 1.482 1.13 0 N-CA-C 108.563 -0.903 . . . . 65.31 108.563 172.239 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 104' ' ' ASN . . . . . 0.404 ' O ' ' HD3' ' A' ' 108' ' ' ARG . 40.3 t-20 -59.71 -47.0 87.39 Favored 'General case' 0 N--CA 1.478 0.945 0 CA-C-N 115.269 -0.878 . . . . 71.34 109.557 176.017 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -63.87 -33.63 76.13 Favored 'General case' 0 CA--C 1.538 0.503 0 CA-C-N 115.112 -0.949 . . . . 73.53 111.627 -178.488 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 106' ' ' TYR . . . . . . . . . . . . . 3.9 t80 -70.54 -54.23 12.98 Favored 'General case' 0 N--CA 1.476 0.838 0 C-N-CA 122.897 0.479 . . . . 74.31 110.071 -179.063 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -62.64 -32.03 82.02 Favored Glycine 0 C--N 1.345 1.064 0 CA-C-N 115.512 -0.767 . . . . 74.43 112.573 -178.781 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 108' ' ' ARG . . . . . 0.539 ' HG2' ' HA ' ' A' ' 116' ' ' PRO . 9.7 mpt_? -83.28 -21.5 33.27 Favored 'General case' 0 C--O 1.217 -0.641 0 C-N-CA 122.935 0.494 . . . . 74.24 110.62 176.463 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 109' ' ' LEU . . . . . 0.525 HD13 ' HB2' ' A' ' 114' ' ' LEU . 43.9 tp -68.79 -31.18 70.0 Favored 'General case' 0 N--CA 1.494 1.728 0 CA-C-N 118.841 0.746 . . . . 55.03 109.603 170.633 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 25.7 t -72.81 -46.57 52.44 Favored 'General case' 0 CA--C 1.551 1.002 0 CA-C-N 115.382 -0.826 . . . . 60.5 110.205 170.592 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . -89.97 -63.0 1.27 Allowed Glycine 0 C--N 1.358 1.793 0 N-CA-C 115.67 1.028 . . . . 45.2 115.67 -172.201 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 112' ' ' MET . . . . . . . . . . . . . 54.8 mmm -92.67 -69.51 0.74 Allowed 'General case' 0 N--CA 1.49 1.542 0 CA-C-N 118.277 1.038 . . . . 72.12 113.683 -175.472 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 113' ' ' LEU . . . . . 0.405 ' HB3' HG22 ' A' ' 115' ' ' VAL . 15.2 tp 173.27 28.76 0.0 OUTLIER 'General case' 0 N--CA 1.492 1.629 0 C-N-CA 123.34 0.656 . . . . 62.42 109.673 -169.769 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 114' ' ' LEU . . . . . 0.525 ' HB2' HD13 ' A' ' 109' ' ' LEU . 6.3 tt 77.12 -22.47 0.28 Allowed 'General case' 0 N--CA 1.501 2.115 0 C-N-CA 125.454 1.502 . . . . 73.31 111.267 -172.394 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 115' ' ' VAL . . . . . 0.405 HG22 ' HB3' ' A' ' 113' ' ' LEU . 29.0 m -79.11 127.86 77.99 Favored Pre-proline 0 CA--C 1.557 1.23 0 C-N-CA 123.511 0.724 . . . . 71.34 110.352 179.795 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 116' ' ' PRO . . . . . 0.539 ' HA ' ' HG2' ' A' ' 108' ' ' ARG . 80.6 Cg_endo -77.86 157.7 31.2 Favored 'Trans proline' 0 C--N 1.377 2.034 0 C-N-CA 122.514 2.143 . . . . 73.23 112.244 176.498 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 13.3 t70 -100.79 -70.51 0.74 Allowed 'General case' 0 N--CA 1.472 0.646 0 N-CA-C 108.098 -1.075 . . . . 63.31 108.098 176.854 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -148.82 105.48 3.43 Favored Pre-proline 0 CA--C 1.555 1.138 0 C-N-CA 124.498 1.119 . . . . 61.01 108.583 178.111 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 119' ' ' PRO . . . . . . . . . . . . . 42.3 Cg_endo -64.7 150.17 88.59 Favored 'Trans proline' 0 C--N 1.378 2.095 0 C-N-CA 122.789 2.326 . . . . 72.1 112.718 -179.316 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . -155.53 84.27 0.14 Allowed Glycine 0 C--N 1.344 1.017 0 N-CA-C 111.848 -0.501 . . . . 40.14 111.848 -175.506 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . -145.16 -178.06 5.86 Favored 'General case' 0 N--CA 1.475 0.82 0 C-N-CA 124.127 0.971 . . . . 74.03 109.86 -179.542 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 122' ' ' SER . . . . . . . . . . . . . 40.3 m . . . . . 0 CA--C 1.553 1.061 0 N-CA-C 108.825 -0.806 . . . . 63.35 108.825 172.369 . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 1' ' ' MET . . . . . 0.49 ' SD ' ' HB ' ' A' ' 4' ' ' THR . 13.7 tpt . . . . . 0 N--CA 1.482 1.138 0 CA-C-O 119.272 -0.394 . . . . 65.11 111.217 . . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 62.5 m -53.94 -47.4 71.29 Favored 'General case' 0 N--CA 1.489 1.498 0 C-N-CA 124.205 1.002 . . . . 71.25 112.572 -175.388 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 46.9 t -62.69 -38.25 89.68 Favored 'General case' 0 N--CA 1.481 1.124 0 C-N-CA 123.025 0.53 . . . . 50.32 110.656 177.347 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 4' ' ' THR . . . . . 0.49 ' HB ' ' SD ' ' A' ' 1' ' ' MET . 11.9 m -69.35 -33.39 73.02 Favored 'General case' 0 CA--C 1.547 0.853 0 C-N-CA 123.508 0.723 . . . . 73.41 111.059 179.552 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 62.9 t -64.58 -48.56 84.39 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.175 0 C-N-CA 123.504 0.722 . . . . 70.13 109.837 177.376 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 26.7 mm-40 -62.29 -41.03 98.16 Favored 'General case' 0 N--CA 1.477 0.923 0 O-C-N 123.904 0.752 . . . . 74.0 110.896 175.753 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 65.2 t80 -60.99 -46.4 90.9 Favored 'General case' 0 CA--C 1.547 0.855 0 C-N-CA 124.487 1.115 . . . . 63.11 110.937 -176.608 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 8' ' ' ILE . . . . . 0.429 HG13 ' O ' ' A' ' 4' ' ' THR . 85.0 mt -62.14 -52.62 58.09 Favored 'Isoleucine or valine' 0 C--N 1.356 0.882 0 O-C-N 123.778 0.674 . . . . 74.31 109.559 175.906 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 28.4 t-20 -58.67 -34.29 71.08 Favored 'General case' 0 N--CA 1.481 1.118 0 O-C-N 124.177 0.923 . . . . 65.21 111.781 -174.762 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 99.2 mtt180 -78.19 -37.07 46.48 Favored 'General case' 0 N--CA 1.471 0.616 0 C-N-CA 123.039 0.535 . . . . 72.44 111.021 -179.8 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 11' ' ' TRP . . . . . . . . . . . . . 51.3 m95 -71.59 -25.8 62.33 Favored 'General case' 0 N--CA 1.484 1.226 0 N-CA-C 111.549 0.203 . . . . 74.35 111.549 172.518 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 12' ' ' GLN . . . . . 0.506 ' HG2' ' CE2' ' A' ' 67' ' ' TYR . 53.0 mt-30 -67.25 -44.81 78.49 Favored 'General case' 0 C--O 1.208 -1.101 0 N-CA-C 108.163 -1.051 . . . . 73.45 108.163 170.399 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 15.0 tpt180 -60.48 -44.17 96.19 Favored 'General case' 0 CA--C 1.545 0.762 0 O-C-N 124.152 0.908 . . . . 71.33 110.816 -177.042 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 14' ' ' ILE . . . . . 0.431 HD11 HG21 ' A' ' 47' ' ' VAL . 58.3 mt -68.32 -45.84 81.89 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.997 0 C-N-CA 122.601 0.36 . . . . 74.3 110.035 177.916 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 15' ' ' ALA . . . . . 0.579 ' HA ' ' HB ' ' A' ' 71' ' ' THR . . . -56.87 -49.0 76.81 Favored 'General case' 0 N--CA 1.484 1.251 0 C-N-CA 123.76 0.824 . . . . 64.02 111.551 -179.976 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 96.8 mt -73.33 -43.71 60.3 Favored 'General case' 0 N--CA 1.475 0.802 0 CA-C-N 114.422 -1.263 . . . . 71.45 110.675 -173.154 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.493 ' O ' ' HG ' ' A' ' 21' ' ' LEU . 40.7 mt -61.05 -53.53 56.03 Favored 'General case' 0 N--CA 1.481 1.077 0 O-C-N 123.606 0.566 . . . . 74.11 110.566 178.68 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 87.2 p -65.69 -33.55 76.14 Favored 'General case' 0 N--CA 1.478 0.953 0 O-C-N 123.682 0.614 . . . . 45.2 111.231 -176.04 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 6.7 tp-100 -69.11 -37.32 78.32 Favored 'General case' 0 N--CA 1.479 0.975 0 C-N-CA 122.845 0.458 . . . . 53.24 110.836 175.601 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 68.9 m -70.05 -33.24 71.7 Favored 'General case' 0 CA--C 1.539 0.542 0 CA-C-N 115.826 -0.624 . . . . 63.03 110.66 174.423 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 21' ' ' LEU . . . . . 0.622 HD22 ' HA ' ' A' ' 33' ' ' LEU . 50.5 mt -73.91 -29.2 61.93 Favored 'General case' 0 N--CA 1.474 0.755 0 C-N-CA 123.146 0.578 . . . . 65.14 110.044 178.294 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.709 ' HA ' HD21 ' A' ' 78' ' ' LEU . 50.3 tp -67.29 -48.46 67.58 Favored 'General case' 0 N--CA 1.47 0.545 0 C-N-CA 123.366 0.666 . . . . 71.41 109.357 174.425 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 38.3 mm-40 -51.06 -59.4 4.21 Favored 'General case' 0 N--CA 1.47 0.555 0 C-N-CA 124.169 0.988 . . . . 74.21 111.374 173.263 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 93.6 mt -59.09 -46.54 88.02 Favored 'General case' 0 CA--C 1.539 0.548 0 O-C-N 124.233 0.958 . . . . 55.4 111.358 -175.585 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 25' ' ' ALA . . . . . 0.525 ' HB2' HD21 ' A' ' 33' ' ' LEU . . . -60.06 -45.24 93.53 Favored 'General case' 0 N--CA 1.48 1.038 0 C-N-CA 123.413 0.685 . . . . 73.12 112.047 -177.915 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 97.1 mt-30 -67.04 -32.03 72.96 Favored 'General case' 0 N--CA 1.483 1.2 0 C-N-CA 123.169 0.587 . . . . 73.1 111.269 178.15 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 92.5 mtt-85 -83.97 -2.2 56.13 Favored 'General case' 0 N--CA 1.479 1.005 0 C-N-CA 123.591 0.757 . . . . 72.51 111.239 176.716 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 92.7 2.33 67.34 Favored Glycine 0 C--N 1.356 1.679 0 C-N-CA 123.37 0.509 . . . . 71.02 114.2 171.256 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 58.9 mm-40 -83.66 70.01 10.24 Favored 'General case' 0 CA--C 1.548 0.896 0 C-N-CA 124.123 0.969 . . . . 75.35 111.563 -179.827 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 30' ' ' TRP . . . . . . . . . . . . . 65.3 m95 -69.93 -39.31 76.19 Favored 'General case' 0 N--CA 1.482 1.173 0 C-N-CA 123.983 0.913 . . . . 72.33 111.628 -176.626 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 18.2 m-20 -62.06 -31.9 72.36 Favored 'General case' 0 N--CA 1.477 0.901 0 CA-C-N 115.517 -0.765 . . . . 74.53 111.001 -177.616 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 62.1 mt -70.69 -28.03 64.46 Favored 'General case' 0 CA--C 1.542 0.663 0 C-N-CA 122.569 0.347 . . . . 64.13 111.021 178.677 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 33' ' ' LEU . . . . . 0.622 ' HA ' HD22 ' A' ' 21' ' ' LEU . 10.1 mp -66.9 -47.55 71.43 Favored 'General case' 0 N--CA 1.493 1.69 0 C-N-CA 122.799 0.439 . . . . 70.55 109.913 169.724 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 80.2 mt -61.74 -33.62 74.37 Favored 'General case' 0 N--CA 1.481 1.118 0 O-C-N 124.282 0.989 . . . . 55.22 111.677 -178.777 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -70.8 -55.9 7.54 Favored 'General case' 0 N--CA 1.477 0.905 0 C-N-CA 123.716 0.806 . . . . 62.43 109.58 175.396 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 36' ' ' GLN . . . . . 0.435 ' HB2' HD21 ' A' ' 21' ' ' LEU . 89.6 mm-40 -66.03 -12.69 56.99 Favored 'General case' 0 N--CA 1.482 1.128 0 O-C-N 123.84 0.713 . . . . 61.23 112.742 -176.873 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 37' ' ' GLU . . . . . 0.542 ' O ' ' HG ' ' A' ' 41' ' ' LEU . 43.3 tt0 -47.87 -40.41 21.47 Favored 'General case' 0 C--O 1.211 -0.95 0 C-N-CA 123.941 0.896 . . . . 73.12 111.656 172.87 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 43.1 t -58.22 -48.89 83.53 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.521 0 C-N-CA 123.052 0.541 . . . . 64.42 110.935 178.838 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 23.3 m -66.24 -38.96 89.15 Favored 'General case' 0 N--CA 1.475 0.786 0 CA-C-N 115.139 -0.937 . . . . 62.45 111.167 178.558 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 36.3 t80 -57.28 -52.05 66.9 Favored 'General case' 0 C--N 1.352 0.69 0 C-N-CA 124.887 1.275 . . . . 72.1 109.164 178.749 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 41' ' ' LEU . . . . . 0.542 ' HG ' ' O ' ' A' ' 37' ' ' GLU . 17.2 mt -59.38 -58.29 9.26 Favored 'General case' 0 C--N 1.363 1.193 0 O-C-N 124.702 1.251 . . . . 73.31 109.629 -178.601 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 48.1 tt0 -52.21 -49.61 63.58 Favored 'General case' 0 N--CA 1.476 0.828 0 O-C-N 123.994 0.809 . . . . 70.52 111.758 -174.094 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 36.9 m -64.85 -54.36 32.23 Favored 'General case' 0 CA--C 1.549 0.917 0 CA-C-N 115.991 -0.55 . . . . 73.01 111.859 -177.584 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 44' ' ' ILE . . . . . 0.554 HD11 HD11 ' A' ' 102' ' ' LEU . 14.1 tt -65.42 -36.23 77.2 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.105 0 C-N-CA 123.162 0.585 . . . . 64.31 111.238 -173.328 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 12.5 mm-40 -64.57 -47.36 79.02 Favored 'General case' 0 C--N 1.348 0.508 0 C-N-CA 123.773 0.829 . . . . 73.22 110.058 174.898 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 87.1 m -62.87 -26.1 68.61 Favored 'General case' 0 N--CA 1.477 0.902 0 O-C-N 123.443 0.464 . . . . 64.34 111.593 -179.314 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 47' ' ' VAL . . . . . 0.431 HG21 HD11 ' A' ' 14' ' ' ILE . 63.0 t -73.64 -54.05 16.29 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.008 0 O-C-N 122.173 -0.329 . . . . 72.5 110.906 172.831 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 48' ' ' MET . . . . . . . . . . . . . 70.4 mtm -72.22 -24.17 61.35 Favored 'General case' 0 N--CA 1.487 1.389 0 C-N-CA 123.104 0.562 . . . . 70.13 112.215 -171.324 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 32.7 mm-40 -82.34 -24.5 34.52 Favored 'General case' 0 N--CA 1.48 1.043 0 C-N-CA 123.96 0.904 . . . . 63.11 111.329 176.607 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 13.7 mptt -97.22 165.27 12.12 Favored 'General case' 0 N--CA 1.479 1.004 0 CA-C-O 121.802 0.81 . . . . 63.01 111.393 -175.663 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 8.5 tt0 -90.76 133.34 35.25 Favored 'General case' 0 C--O 1.24 0.594 0 CA-C-N 113.968 -1.469 . . . . 72.35 110.529 -172.81 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 89.9 m -78.26 127.94 79.67 Favored Pre-proline 0 CA--C 1.553 1.07 0 N-CA-C 108.755 -0.831 . . . . 63.11 108.755 169.754 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 57.0 Cg_endo -68.49 156.8 64.34 Favored 'Trans proline' 0 CA--C 1.562 1.901 0 C-N-CA 122.907 2.405 . . . . 65.31 112.574 176.996 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 7.6 Cg_exo -74.43 -50.06 0.16 Allowed 'Trans proline' 0 C--N 1.374 1.902 0 C-N-CA 122.798 2.332 . . . . 64.23 112.153 173.607 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . -80.86 72.64 2.68 Favored Glycine 0 C--N 1.349 1.274 0 CA-C-N 115.447 -0.797 . . . . 75.21 112.389 -177.141 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 70.0 mt -83.66 -85.01 0.08 OUTLIER 'Isoleucine or valine' 0 CA--C 1.559 1.291 0 N-CA-C 108.574 -0.898 . . . . 72.24 108.574 178.507 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 36.8 p 138.18 163.32 0.0 OUTLIER 'General case' 0 N--CA 1.495 1.794 0 C-N-CA 131.201 3.8 . . . . 73.51 107.165 167.342 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 46.0 tpt85 -60.28 -52.28 65.97 Favored 'General case' 0 CA--C 1.549 0.934 0 C-N-CA 123.82 0.848 . . . . 53.41 111.996 -174.084 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 43.4 m -63.95 -36.61 84.52 Favored 'General case' 0 N--CA 1.476 0.85 0 C-N-CA 123.426 0.691 . . . . 41.14 112.07 -178.646 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 78.1 mt -71.15 -35.17 57.48 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.645 0 CA-C-N 116.339 -0.392 . . . . 74.42 110.06 178.038 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 7.8 tt0 -60.88 -38.77 86.78 Favored 'General case' 0 CA--C 1.543 0.693 0 C-N-CA 123.123 0.569 . . . . 73.35 109.899 175.05 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 44.4 m-20 -65.35 -42.69 92.56 Favored 'General case' 0 N--CA 1.479 0.987 0 CA-C-N 115.909 -0.587 . . . . 73.43 112.045 175.088 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 63' ' ' MET . . . . . . . . . . . . . 71.3 mtm -68.18 -49.36 61.4 Favored 'General case' 0 N--CA 1.484 1.259 0 C-N-CA 122.566 0.346 . . . . 53.42 111.6 -178.933 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 64' ' ' VAL . . . . . 0.455 ' O ' HG13 ' A' ' 68' ' ' ILE . 70.8 t -60.14 -56.91 14.37 Favored 'Isoleucine or valine' 0 C--N 1.35 0.607 0 C-N-CA 123.879 0.872 . . . . 60.54 110.675 177.518 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -62.38 -28.2 69.61 Favored 'General case' 0 N--CA 1.489 1.498 0 O-C-N 123.405 0.44 . . . . 64.33 111.282 -179.848 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -63.65 -42.73 98.64 Favored Glycine 0 C--N 1.347 1.154 0 N-CA-C 111.753 -0.539 . . . . 55.32 111.753 172.608 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 67' ' ' TYR . . . . . 0.506 ' CE2' ' HG2' ' A' ' 12' ' ' GLN . 17.1 m-30 -79.59 -27.24 41.12 Favored 'General case' 0 N--CA 1.48 1.051 0 N-CA-C 112.855 0.687 . . . . 74.03 112.855 -179.621 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 68' ' ' ILE . . . . . 0.525 ' O ' ' HG ' ' A' ' 72' ' ' LEU . 38.9 mt -66.29 -49.59 74.63 Favored 'Isoleucine or valine' 0 C--N 1.35 0.592 0 N-CA-C 107.405 -1.331 . . . . 35.42 107.405 171.581 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 69' ' ' LYS . . . . . 0.659 ' HB2' ' HE2' ' A' ' 106' ' ' TYR . 0.3 OUTLIER -54.78 -46.75 74.46 Favored 'General case' 0 C--N 1.356 0.872 0 O-C-N 123.989 0.805 . . . . 71.23 110.619 177.66 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 62.0 tt0 -57.43 -51.11 70.75 Favored 'General case' 0 C--N 1.349 0.569 0 O-C-N 124.926 1.391 . . . . 71.34 110.506 -178.843 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 71' ' ' THR . . . . . 0.579 ' HB ' ' HA ' ' A' ' 15' ' ' ALA . 12.8 t -72.57 -19.67 61.45 Favored 'General case' 0 C--O 1.215 -0.757 0 CA-C-O 118.566 -0.731 . . . . 73.11 111.607 -179.199 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 72' ' ' LEU . . . . . 0.716 HD21 ' HB3' ' A' ' 102' ' ' LEU . 17.0 mt -79.74 -28.78 40.44 Favored 'General case' 0 N--CA 1.49 1.566 0 C-N-CA 122.945 0.498 . . . . 70.32 111.499 174.559 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 29.8 m-20 -65.53 -53.24 45.07 Favored 'General case' 0 N--CA 1.473 0.719 0 N-CA-C 107.882 -1.155 . . . . 62.24 107.882 170.519 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 35.0 m-20 -61.54 -33.53 73.99 Favored 'General case' 0 N--CA 1.477 0.879 0 CA-C-N 114.666 -1.152 . . . . 64.1 110.961 179.553 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 75' ' ' GLU . . . . . 0.455 ' O ' ' HG2' ' A' ' 79' ' ' LYS . 27.2 tp10 -61.84 -60.63 3.36 Favored 'General case' 0 N--CA 1.474 0.737 0 C-N-CA 124.238 1.015 . . . . 73.01 109.455 176.876 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 10.3 tt0 -63.5 -36.34 83.45 Favored 'General case' 0 CA--C 1.545 0.787 0 CA-C-N 116.108 -0.496 . . . . 72.23 111.862 -175.715 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 77' ' ' LEU . . . . . 0.431 ' O ' ' HB2' ' A' ' 81' ' ' LEU . 93.1 mt -68.22 -54.42 17.92 Favored 'General case' 0 N--CA 1.471 0.594 0 C-N-CA 122.84 0.456 . . . . 72.24 110.537 -179.281 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 78' ' ' LEU . . . . . 0.709 HD21 ' HA ' ' A' ' 22' ' ' LEU . 51.0 mt -62.24 -52.66 62.84 Favored 'General case' 0 N--CA 1.484 1.248 0 C-N-CA 122.979 0.512 . . . . 71.4 112.08 -178.532 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 79' ' ' LYS . . . . . 0.455 ' HG2' ' O ' ' A' ' 75' ' ' GLU . 26.3 mmtp -73.87 -28.08 61.39 Favored 'General case' 0 N--CA 1.476 0.86 0 O-C-N 123.716 0.635 . . . . 73.31 110.805 -173.81 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -75.42 -24.19 71.38 Favored Glycine 0 C--N 1.344 1.019 0 CA-C-N 116.02 -0.536 . . . . 64.31 112.287 171.285 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 81' ' ' LEU . . . . . 0.431 ' HB2' ' O ' ' A' ' 77' ' ' LEU . 5.1 tt -80.51 -41.96 23.33 Favored 'General case' 0 N--CA 1.475 0.791 0 C-N-CA 123.662 0.785 . . . . 71.41 109.829 178.087 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 96.4 mt -70.47 -65.55 0.72 Allowed 'General case' 0 N--CA 1.475 0.799 0 N-CA-C 109.754 -0.461 . . . . 71.21 109.754 -173.131 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 66.9 mm-40 -129.75 -74.21 0.55 Allowed 'General case' 0 N--CA 1.473 0.687 0 N-CA-C 108.518 -0.919 . . . . 74.31 108.518 179.3 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 6.5 tp-100 174.88 105.83 0.02 OUTLIER 'General case' 0 N--CA 1.479 1.014 0 C-N-CA 124.461 1.104 . . . . 75.21 108.977 -177.354 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 85' ' ' ARG . . . . . 0.563 ' HG3' ' H ' ' A' ' 86' ' ' LEU . 4.3 ptp180 34.38 -77.05 0.0 OUTLIER 'General case' 0 N--CA 1.499 2.025 0 C-N-CA 126.898 2.079 . . . . 61.0 114.792 -179.859 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 86' ' ' LEU . . . . . 0.563 ' H ' ' HG3' ' A' ' 85' ' ' ARG . 63.4 mt -73.49 101.57 3.57 Favored 'General case' 0 N--CA 1.477 0.887 0 CA-C-N 119.096 0.862 . . . . 73.02 109.461 175.969 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 40.2 p-10 -170.05 -151.41 0.08 Allowed 'General case' 0 N--CA 1.486 1.359 0 N-CA-C 112.373 0.509 . . . . 51.33 112.373 -173.963 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 43.3 mt-10 -49.86 160.93 0.28 Allowed 'General case' 0 N--CA 1.481 1.112 0 C-N-CA 126.282 1.833 . . . . 73.1 114.182 178.153 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 89' ' ' LEU . . . . . 0.434 ' HB2' ' HE2' ' A' ' 79' ' ' LYS . 65.4 mt 63.95 25.14 13.84 Favored 'General case' 0 N--CA 1.48 1.047 0 C-N-CA 125.107 1.363 . . . . 70.34 110.764 -176.868 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 45.7 t -94.07 -92.76 0.18 Allowed 'General case' 0 C--N 1.349 0.585 0 N-CA-C 107.918 -1.141 . . . . 61.3 107.918 175.644 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 35.8 p 43.79 25.28 0.09 Allowed 'General case' 0 N--CA 1.488 1.443 0 C-N-CA 124.88 1.272 . . . . 64.43 113.761 -175.552 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 80.3 mt -89.23 -72.67 0.54 Allowed 'General case' 0 C--N 1.355 0.842 0 N-CA-C 107.946 -1.131 . . . . 71.32 107.946 178.594 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 93' ' ' ILE . . . . . 0.482 HG22 ' HG2' ' A' ' 95' ' ' GLN . 43.8 mt -128.24 138.02 55.82 Favored 'Isoleucine or valine' 0 C--O 1.241 0.625 0 N-CA-C 107.53 -1.285 . . . . 73.41 107.53 177.383 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -63.08 -30.59 77.94 Favored Glycine 0 C--N 1.353 1.481 0 O-C-N 124.114 0.884 . . . . 64.14 114.362 -171.671 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 95' ' ' GLN . . . . . 0.482 ' HG2' HG22 ' A' ' 93' ' ' ILE . 30.0 pt20 -73.12 -0.29 13.68 Favored 'General case' 0 N--CA 1.486 1.343 0 C-N-CA 123.338 0.655 . . . . 74.45 112.407 178.437 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 20.9 m 66.12 30.27 9.48 Favored 'General case' 0 C--N 1.358 0.96 0 C-N-CA 124.987 1.315 . . . . 75.13 111.978 171.503 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 14.9 t -74.6 14.11 0.52 Allowed 'General case' 0 N--CA 1.481 1.106 0 C-N-CA 123.679 0.792 . . . . 72.24 112.923 -176.265 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 98' ' ' ARG . . . . . 0.401 ' O ' HD13 ' A' ' 102' ' ' LEU . 60.6 ttp180 -53.57 -53.09 56.7 Favored 'General case' 0 N--CA 1.476 0.857 0 C-N-CA 124.377 1.071 . . . . 63.24 111.622 179.145 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 99' ' ' GLN . . . . . 0.409 HE22 ' HG3' ' A' ' 75' ' ' GLU . 9.7 mm100 -61.94 -47.0 86.87 Favored 'General case' 0 N--CA 1.479 0.997 0 CA-C-O 121.488 0.661 . . . . 70.13 109.63 -176.76 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 38.9 ttmt -62.36 -40.53 96.73 Favored 'General case' 0 CA--C 1.54 0.584 0 CA-C-N 113.781 -1.554 . . . . 61.34 111.729 -178.385 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 38.7 t -71.95 -44.37 63.7 Favored 'General case' 0 N--CA 1.474 0.737 0 C-N-CA 123.753 0.821 . . . . 55.52 110.942 -172.464 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 102' ' ' LEU . . . . . 0.716 ' HB3' HD21 ' A' ' 72' ' ' LEU . 8.9 mp -72.08 -37.57 69.57 Favored 'General case' 0 CA--C 1.546 0.819 0 CA-C-N 115.314 -0.857 . . . . 51.14 110.682 -179.662 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 9.8 t30 -68.82 -31.9 71.21 Favored 'General case' 0 N--CA 1.48 1.051 0 CA-C-N 115.698 -0.683 . . . . 74.52 110.503 176.176 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 49.0 t30 -74.47 -36.11 63.3 Favored 'General case' 0 N--CA 1.482 1.173 0 C-N-CA 123.596 0.759 . . . . 52.52 110.017 176.947 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -61.21 -49.59 76.52 Favored 'General case' 0 N--CA 1.475 0.794 0 C-N-CA 123.057 0.543 . . . . 53.03 110.134 177.4 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 106' ' ' TYR . . . . . 0.659 ' HE2' ' HB2' ' A' ' 69' ' ' LYS . 1.7 t80 -63.85 -48.88 74.97 Favored 'General case' 0 C--N 1.354 0.795 0 O-C-N 123.993 0.808 . . . . 72.35 109.472 175.62 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -56.93 -38.3 83.91 Favored Glycine 0 C--N 1.35 1.31 0 O-C-N 124.017 0.823 . . . . 35.42 113.772 -173.691 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 70.8 mtm180 -75.63 -42.82 50.61 Favored 'General case' 0 C--O 1.239 0.545 0 C-N-CA 123.386 0.674 . . . . 75.03 110.533 176.767 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 32.7 tp -61.82 -28.27 69.35 Favored 'General case' 0 N--CA 1.491 1.578 0 C-N-CA 123.141 0.576 . . . . 72.13 110.894 177.251 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 39.5 t -83.08 -38.62 22.26 Favored 'General case' 0 N--CA 1.452 -0.363 0 CA-C-N 114.711 -1.131 . . . . 62.21 109.449 178.144 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . -79.09 -64.99 1.85 Allowed Glycine 0 C--N 1.356 1.643 0 CA-C-O 119.214 -0.77 . . . . 50.13 113.558 -173.228 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 112' ' ' MET . . . . . 0.675 ' HA ' ' HA2' ' A' ' 120' ' ' GLY . 0.0 OUTLIER -99.32 -66.53 0.9 Allowed 'General case' 0 N--CA 1.485 1.3 0 CA-C-N 118.793 1.297 . . . . 70.21 109.525 172.637 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER 170.43 27.31 0.0 OUTLIER 'General case' 0 CA--C 1.573 1.831 0 O-C-N 124.712 1.258 . . . . 74.02 109.626 -171.633 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER 76.86 -22.18 0.29 Allowed 'General case' 0 N--CA 1.501 2.109 0 C-N-CA 125.92 1.688 . . . . 72.04 111.368 -178.324 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 115' ' ' VAL . . . . . . . . . . . . . 33.9 m -124.48 144.51 46.28 Favored Pre-proline 0 C--O 1.247 0.923 0 C-N-CA 124.33 1.052 . . . . 61.44 109.31 -174.866 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 17.8 Cg_exo -68.07 167.29 22.18 Favored 'Trans proline' 0 C--N 1.367 1.545 0 C-N-CA 122.53 2.153 . . . . 63.01 111.606 173.506 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 16.2 m-20 65.36 27.52 11.93 Favored 'General case' 0 N--CA 1.486 1.329 0 C-N-CA 124.31 1.044 . . . . 72.15 110.967 178.806 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -126.3 137.67 30.75 Favored Pre-proline 0 N--CA 1.473 0.705 0 C-N-CA 124.138 0.975 . . . . 65.21 109.617 -178.508 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 119' ' ' PRO . . . . . . . . . . . . . 38.2 Cg_endo -64.2 132.8 35.32 Favored 'Trans proline' 0 C--N 1.377 2.067 0 C-N-CA 122.58 2.187 . . . . 75.42 111.512 -175.252 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 120' ' ' GLY . . . . . 0.675 ' HA2' ' HA ' ' A' ' 112' ' ' MET . . . -59.96 123.59 33.57 Favored Glycine 0 C--N 1.349 1.272 0 O-C-N 124.284 0.99 . . . . 53.33 114.057 -171.077 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . -76.46 175.11 9.5 Favored 'General case' 0 N--CA 1.473 0.695 0 C-N-CA 123.809 0.844 . . . . 50.32 111.607 178.181 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 122' ' ' SER . . . . . . . . . . . . . 20.3 m . . . . . 0 C--O 1.253 1.262 0 CA-C-O 118.547 -0.739 . . . . 64.23 109.482 -178.904 . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 25.9 ttt . . . . . 0 CA--C 1.555 1.162 0 CA-C-O 119.621 -0.228 . . . . 73.5 110.906 . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 4.6 p -53.85 -35.33 61.39 Favored 'General case' 0 N--CA 1.489 1.477 0 C-N-CA 123.501 0.72 . . . . 70.44 112.471 -178.957 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 63.5 p -62.22 -48.07 81.62 Favored 'General case' 0 N--CA 1.48 1.069 0 C-N-CA 123.701 0.8 . . . . 72.32 110.555 176.524 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 22.1 m -66.26 -37.63 85.93 Favored 'General case' 0 CA--C 1.54 0.594 0 CA-C-N 115.023 -0.99 . . . . 75.13 111.194 -179.876 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 78.1 t -65.75 -44.63 93.11 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.936 0 C-N-CA 123.192 0.597 . . . . 54.1 110.433 -179.175 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 11.7 mm-40 -61.54 -41.57 97.54 Favored 'General case' 0 C--N 1.353 0.761 0 O-C-N 123.581 0.551 . . . . 73.43 110.703 173.782 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 44.6 t80 -63.05 -47.85 81.18 Favored 'General case' 0 N--CA 1.481 1.101 0 C-N-CA 123.852 0.861 . . . . 75.44 111.439 -176.958 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 8' ' ' ILE . . . . . 0.434 HD11 HG23 ' A' ' 60' ' ' ILE . 73.1 mt -65.0 -41.54 92.37 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.033 0 C-N-CA 123.682 0.793 . . . . 74.1 109.541 177.472 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 4.0 t-20 -65.76 -29.15 69.62 Favored 'General case' 0 N--CA 1.479 1.022 0 C-N-CA 123.756 0.822 . . . . 72.51 111.104 179.23 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 10' ' ' ARG . . . . . 0.749 ' HB3' HG22 ' A' ' 47' ' ' VAL . 57.6 mtt180 -78.55 -30.64 46.99 Favored 'General case' 0 N--CA 1.469 0.477 0 C-N-CA 123.689 0.796 . . . . 74.13 110.381 177.431 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 11' ' ' TRP . . . . . 0.479 ' HH2' ' HG ' ' A' ' 102' ' ' LEU . 76.8 m95 -74.98 -27.57 60.21 Favored 'General case' 0 N--CA 1.477 0.902 0 CA-C-O 119.492 -0.29 . . . . 61.13 110.945 170.381 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 12' ' ' GLN . . . . . 0.426 ' HG3' ' O ' ' A' ' 8' ' ' ILE . 51.5 mt-30 -64.49 -44.18 91.8 Favored 'General case' 0 C--O 1.212 -0.896 0 N-CA-C 107.744 -1.206 . . . . 64.14 107.744 168.959 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 30.9 tpt180 -59.04 -50.98 72.02 Favored 'General case' 0 CA--C 1.547 0.862 0 O-C-N 124.087 0.867 . . . . 74.35 110.689 -177.222 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 56.4 mt -63.97 -49.53 81.26 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.313 0 C-N-CA 122.666 0.387 . . . . 63.52 110.335 179.187 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 15' ' ' ALA . . . . . 0.558 ' HA ' ' HB ' ' A' ' 71' ' ' THR . . . -59.06 -43.51 91.72 Favored 'General case' 0 N--CA 1.485 1.31 0 C-N-CA 123.864 0.865 . . . . 71.02 112.115 -176.373 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 95.1 mt -77.41 -39.6 46.49 Favored 'General case' 0 N--CA 1.481 1.082 0 CA-C-N 115.248 -0.887 . . . . 75.34 110.658 -174.848 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.509 ' O ' ' HG ' ' A' ' 21' ' ' LEU . 53.9 mt -64.45 -47.04 80.55 Favored 'General case' 0 N--CA 1.483 1.186 0 O-C-N 123.302 0.377 . . . . 75.23 110.511 179.718 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 18' ' ' SER . . . . . 0.424 ' HB3' ' CE1' ' A' ' 40' ' ' TYR . 71.7 p -68.65 -35.5 77.34 Favored 'General case' 0 N--CA 1.477 0.882 0 O-C-N 123.768 0.667 . . . . 71.51 111.143 178.592 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 19' ' ' GLN . . . . . 0.491 ' O ' ' HG2' ' A' ' 23' ' ' GLU . 6.3 tp-100 -62.41 -41.17 98.48 Favored 'General case' 0 C--N 1.357 0.913 0 O-C-N 123.586 0.554 . . . . 74.41 109.878 174.702 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 68.6 m -63.37 -49.19 74.81 Favored 'General case' 0 C--N 1.352 0.702 0 O-C-N 123.818 0.699 . . . . 71.34 109.288 175.564 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 21' ' ' LEU . . . . . 0.509 ' HG ' ' O ' ' A' ' 17' ' ' LEU . 83.8 mt -57.22 -31.53 65.59 Favored 'General case' 0 N--CA 1.479 1.016 0 C-N-CA 123.811 0.844 . . . . 64.33 110.665 179.995 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.553 ' HA ' HD21 ' A' ' 78' ' ' LEU . 37.9 tp -73.33 -52.45 13.84 Favored 'General case' 0 CA--C 1.543 0.674 0 O-C-N 123.862 0.727 . . . . 64.24 110.727 178.491 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 23' ' ' GLU . . . . . 0.573 ' HB3' ' NH1' ' A' ' 27' ' ' ARG . 46.5 mm-40 -51.79 -55.2 21.21 Favored 'General case' 0 N--CA 1.491 1.586 0 CA-C-O 122.159 0.981 . . . . 72.12 110.454 177.734 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 70.4 mt -56.36 -51.36 68.59 Favored 'General case' 0 CA--C 1.545 0.77 0 CA-C-N 112.878 -1.965 . . . . 74.32 110.425 179.79 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 25' ' ' ALA . . . . . 0.504 ' HB2' HD21 ' A' ' 33' ' ' LEU . . . -60.91 -41.52 96.26 Favored 'General case' 0 N--CA 1.49 1.527 0 C-N-CA 123.396 0.679 . . . . 70.42 112.68 -175.962 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 94.6 mt-30 -64.51 -38.22 90.27 Favored 'General case' 0 N--CA 1.478 0.943 0 C-N-CA 123.537 0.735 . . . . 71.3 110.264 179.265 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 27' ' ' ARG . . . . . 0.573 ' NH1' ' HB3' ' A' ' 23' ' ' GLU . 58.0 mtt180 -81.65 -15.66 53.85 Favored 'General case' 0 N--CA 1.488 1.453 0 N-CA-C 112.306 0.484 . . . . 71.23 112.306 175.517 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 88.79 24.93 31.21 Favored Glycine 0 C--N 1.349 1.305 0 N-CA-C 114.527 0.571 . . . . 74.55 114.527 177.417 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 49.7 mm-40 -84.33 60.55 6.05 Favored 'General case' 0 N--CA 1.477 0.895 0 C-N-CA 124.239 1.016 . . . . 64.22 110.699 175.491 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 30' ' ' TRP . . . . . 0.471 ' O ' ' HG ' ' A' ' 34' ' ' LEU . 88.5 m95 -66.17 -30.57 71.07 Favored 'General case' 0 N--CA 1.477 0.88 0 C-N-CA 123.911 0.884 . . . . 74.54 112.575 -171.952 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 4.8 m-20 -61.18 -40.64 94.65 Favored 'General case' 0 N--CA 1.483 1.197 0 C-N-CA 123.332 0.653 . . . . 74.41 110.563 175.642 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 64.2 mt -71.6 -26.54 62.63 Favored 'General case' 0 CA--C 1.543 0.683 0 CA-C-N 115.211 -0.904 . . . . 61.02 110.396 179.842 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 33' ' ' LEU . . . . . 0.504 HD21 ' HB2' ' A' ' 25' ' ' ALA . 7.6 mp -66.29 -44.59 83.11 Favored 'General case' 0 N--CA 1.489 1.492 0 N-CA-C 110.476 -0.194 . . . . 62.54 110.476 169.039 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.471 ' HG ' ' O ' ' A' ' 30' ' ' TRP . 83.0 mt -63.63 -34.53 78.04 Favored 'General case' 0 N--CA 1.48 1.058 0 O-C-N 123.896 0.747 . . . . 74.44 111.124 -178.548 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 96.8 mt-30 -65.71 -58.04 6.62 Favored 'General case' 0 N--CA 1.483 1.186 0 CA-C-O 121.168 0.508 . . . . 63.41 110.033 174.687 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 36' ' ' GLN . . . . . 0.422 ' HB2' HD21 ' A' ' 21' ' ' LEU . 80.1 mm-40 -73.82 -10.39 59.62 Favored 'General case' 0 N--CA 1.477 0.896 0 CA-C-N 114.885 -1.052 . . . . 54.11 112.654 -174.207 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 37.1 tt0 -53.38 -52.31 59.7 Favored 'General case' 0 N--CA 1.475 0.79 0 C-N-CA 124.591 1.156 . . . . 73.44 110.692 175.224 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 46.8 t -58.7 -43.97 88.89 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.141 0 O-C-N 123.76 0.662 . . . . 75.23 110.179 -179.18 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 42.7 m -56.95 -53.23 60.4 Favored 'General case' 0 CA--C 1.546 0.809 0 CA-C-N 115.403 -0.817 . . . . 74.2 111.631 176.211 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 40' ' ' TYR . . . . . 0.424 ' CE1' ' HB3' ' A' ' 18' ' ' SER . 58.2 t80 -63.0 -49.62 73.94 Favored 'General case' 0 N--CA 1.474 0.758 0 C-N-CA 123.797 0.839 . . . . 71.55 111.159 -173.502 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 41' ' ' LEU . . . . . 0.763 ' HB3' HD21 ' A' ' 92' ' ' LEU . 72.2 mt -60.23 -48.34 82.15 Favored 'General case' 0 C--O 1.257 1.486 0 C-N-CA 124.48 1.112 . . . . 72.12 111.285 -178.022 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 49.8 tt0 -61.07 -44.03 98.0 Favored 'General case' 0 N--CA 1.475 0.786 0 CA-C-N 115.557 -0.747 . . . . 73.15 110.43 -179.85 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 43' ' ' SER . . . . . 0.518 ' O ' HG23 ' A' ' 47' ' ' VAL . 69.4 m -60.94 -57.7 11.56 Favored 'General case' 0 C--N 1.354 0.767 0 CA-C-N 115.378 -0.828 . . . . 73.42 111.442 -178.511 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 3.9 tt -58.38 -41.22 80.84 Favored 'Isoleucine or valine' 0 C--O 1.251 1.156 0 C-N-CA 123.266 0.626 . . . . 72.15 111.375 -174.682 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 45' ' ' GLU . . . . . 0.406 ' CG ' HD22 ' A' ' 92' ' ' LEU . 40.9 mm-40 -59.19 -49.8 76.47 Favored 'General case' 0 C--N 1.367 1.333 0 N-CA-C 111.542 0.201 . . . . 75.11 111.542 173.442 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 46' ' ' THR . . . . . 0.49 ' O ' ' HD3' ' A' ' 50' ' ' LYS . 97.3 m -55.72 -41.78 74.36 Favored 'General case' 0 N--CA 1.482 1.155 0 O-C-N 123.958 0.786 . . . . 55.45 111.617 -178.292 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 47' ' ' VAL . . . . . 0.749 HG22 ' HB3' ' A' ' 10' ' ' ARG . 26.2 t -70.05 -37.71 73.04 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.997 0 C-N-CA 122.884 0.474 . . . . 73.33 110.623 -177.94 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 48' ' ' MET . . . . . . . . . . . . . 79.1 mtm -72.22 -19.93 61.64 Favored 'General case' 0 N--CA 1.481 1.113 0 CA-C-N 116.183 -0.462 . . . . 71.21 111.76 175.375 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 48.2 mt-10 -83.02 -7.47 59.66 Favored 'General case' 0 N--CA 1.49 1.57 0 C-N-CA 123.285 0.634 . . . . 74.11 111.759 172.918 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 50' ' ' LYS . . . . . 0.49 ' HD3' ' O ' ' A' ' 46' ' ' THR . 12.7 mptt -95.44 132.0 40.98 Favored 'General case' 0 N--CA 1.482 1.169 0 C-N-CA 123.485 0.714 . . . . 72.52 110.235 177.691 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 34.2 tt0 -68.57 151.99 45.99 Favored 'General case' 0 C--O 1.247 0.923 0 C-N-CA 123.524 0.729 . . . . 74.5 109.389 172.787 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 20.0 m -59.69 118.85 35.3 Favored Pre-proline 0 CA--C 1.556 1.185 0 CA-C-O 118.744 -0.646 . . . . 73.32 109.792 173.471 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 53' ' ' PRO . . . . . 0.511 ' HD2' HD11 ' A' ' 56' ' ' ILE . 31.6 Cg_exo -62.72 153.62 71.1 Favored 'Trans proline' 0 C--N 1.377 2.075 0 C-N-CA 122.602 2.202 . . . . 55.12 112.79 177.844 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 54' ' ' PRO . . . . . 0.445 ' HD3' ' HA ' ' A' ' 53' ' ' PRO . 22.7 Cg_exo -66.98 -47.98 2.14 Favored 'Trans proline' 0 C--N 1.373 1.861 0 C-N-CA 123.199 2.599 . . . . 73.35 112.506 177.591 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . -83.94 59.86 4.91 Favored Glycine 0 C--N 1.346 1.092 0 CA-C-N 115.966 -0.561 . . . . 62.33 114.07 -173.233 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 56' ' ' ILE . . . . . 0.511 HD11 ' HD2' ' A' ' 53' ' ' PRO . 56.1 mt -100.72 116.23 43.79 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.763 0 N-CA-C 108.133 -1.062 . . . . 44.44 108.133 169.971 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 57' ' ' THR . . . . . 0.423 ' H ' HD12 ' A' ' 60' ' ' ILE . 71.6 p -101.73 -166.88 1.34 Allowed 'General case' 0 CA--C 1.545 0.763 0 C-N-CA 124.178 0.991 . . . . 62.32 109.523 177.634 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 16.6 tpt85 -61.25 -63.42 1.29 Allowed 'General case' 0 N--CA 1.474 0.773 0 C-N-CA 123.715 0.806 . . . . 75.11 111.017 -179.828 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 26.0 m -54.73 -38.0 66.6 Favored 'General case' 0 N--CA 1.482 1.142 0 C-N-CA 123.482 0.713 . . . . 62.02 111.778 -178.41 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 60' ' ' ILE . . . . . 0.434 HG23 HD11 ' A' ' 8' ' ' ILE . 80.2 mt -63.51 -46.72 94.35 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.703 0 C-N-CA 123.481 0.712 . . . . 72.14 110.655 178.079 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 61' ' ' GLN . . . . . 0.535 ' HG3' ' HG ' ' A' ' 109' ' ' LEU . 50.9 tt0 -61.77 -39.35 91.36 Favored 'General case' 0 N--CA 1.476 0.849 0 C-N-CA 123.073 0.549 . . . . 63.25 111.106 179.896 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 9.0 m-20 -69.15 -37.42 78.23 Favored 'General case' 0 N--CA 1.479 1.002 0 C-N-CA 123.175 0.59 . . . . 74.02 111.944 179.298 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 63' ' ' MET . . . . . . . . . . . . . 72.1 mtm -68.42 -49.79 57.46 Favored 'General case' 0 N--CA 1.48 1.029 0 C-N-CA 122.41 0.284 . . . . 74.05 110.564 177.477 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 64' ' ' VAL . . . . . 0.513 ' O ' HG13 ' A' ' 68' ' ' ILE . 60.6 t -60.49 -59.76 3.65 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.664 0 C-N-CA 123.873 0.869 . . . . 71.04 110.216 -179.87 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 65' ' ' ALA . . . . . 0.568 ' HB2' HD23 ' A' ' 109' ' ' LEU . . . -60.36 -38.56 84.23 Favored 'General case' 0 N--CA 1.483 1.179 0 O-C-N 123.635 0.584 . . . . 64.02 111.571 -179.24 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -58.59 -42.36 96.06 Favored Glycine 0 C--N 1.35 1.307 0 O-C-N 123.218 0.324 . . . . 70.03 112.457 175.961 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 67' ' ' TYR . . . . . 0.428 ' O ' HG22 ' A' ' 71' ' ' THR . 12.3 m-85 -70.35 -36.26 74.08 Favored 'General case' 0 N--CA 1.473 0.702 0 C-N-CA 123.083 0.553 . . . . 72.12 111.681 177.007 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 68' ' ' ILE . . . . . 0.513 HG13 ' O ' ' A' ' 64' ' ' VAL . 65.0 mt -60.02 -56.61 16.31 Favored 'Isoleucine or valine' 0 C--N 1.361 1.072 0 N-CA-C 108.852 -0.796 . . . . 75.23 108.852 177.785 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 69' ' ' LYS . . . . . 0.498 ' HB2' ' HE2' ' A' ' 106' ' ' TYR . 28.3 tptp -53.69 -47.27 70.63 Favored 'General case' 0 C--N 1.354 0.771 0 O-C-N 124.283 0.989 . . . . 75.42 110.001 179.997 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 10.3 tt0 -58.93 -48.04 82.89 Favored 'General case' 0 C--N 1.35 0.603 0 O-C-N 124.653 1.221 . . . . 75.35 111.364 -176.292 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 71' ' ' THR . . . . . 0.558 ' HB ' ' HA ' ' A' ' 15' ' ' ALA . 10.5 t -76.99 -22.68 52.79 Favored 'General case' 0 N--CA 1.475 0.805 0 O-C-N 123.433 0.458 . . . . 63.45 111.234 -175.949 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 72' ' ' LEU . . . . . 0.512 ' HG ' ' O ' ' A' ' 68' ' ' ILE . 21.1 mt -74.08 -34.81 64.12 Favored 'General case' 0 N--CA 1.476 0.845 0 O-C-N 123.261 0.351 . . . . 63.31 110.261 173.756 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 73.4 m-20 -75.39 -38.44 59.94 Favored 'General case' 0 N--CA 1.473 0.679 0 O-C-N 124.092 0.87 . . . . 73.02 110.535 176.492 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 74' ' ' ASN . . . . . 0.424 ' O ' ' HG ' ' A' ' 78' ' ' LEU . 92.4 m-20 -60.25 -51.87 67.71 Favored 'General case' 0 N--CA 1.48 1.068 0 N-CA-C 109.112 -0.699 . . . . 73.2 109.112 176.819 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 5.4 tt0 -59.95 -42.83 94.9 Favored 'General case' 0 C--N 1.356 0.872 0 CA-C-N 115.518 -0.764 . . . . 75.23 110.869 176.031 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 51.9 tt0 -57.09 -43.84 82.6 Favored 'General case' 0 N--CA 1.486 1.337 0 C-N-CA 123.985 0.914 . . . . 72.0 111.415 -179.201 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 94.5 mt -70.6 -37.32 73.88 Favored 'General case' 0 CA--C 1.536 0.412 0 CA-C-N 115.112 -0.949 . . . . 64.31 110.814 -179.473 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 78' ' ' LEU . . . . . 0.553 HD21 ' HA ' ' A' ' 22' ' ' LEU . 72.2 mt -64.84 -42.21 95.11 Favored 'General case' 0 N--CA 1.481 1.106 0 O-C-N 123.699 0.625 . . . . 75.14 111.419 174.928 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 47.3 mmtm -74.24 -34.84 63.77 Favored 'General case' 0 N--CA 1.476 0.865 0 C-N-CA 123.139 0.576 . . . . 61.14 110.674 -176.148 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -70.71 -37.11 67.08 Favored Glycine 0 C--N 1.347 1.194 0 O-C-N 123.91 0.756 . . . . 71.41 111.672 175.828 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 6.7 tt -65.57 -56.83 10.15 Favored 'General case' 0 N--CA 1.481 1.109 0 C-N-CA 123.839 0.855 . . . . 71.53 108.881 177.373 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 82' ' ' LEU . . . . . 0.431 HD13 ' HG2' ' A' ' 88' ' ' GLU . 80.7 mt -66.36 -22.12 66.25 Favored 'General case' 0 CA--C 1.543 0.696 0 C-N-CA 124.248 1.019 . . . . 61.14 111.934 -178.44 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 25.9 mt-30 60.46 33.3 20.64 Favored 'General case' 0 N--CA 1.487 1.391 0 C-N-CA 124.516 1.127 . . . . 52.44 111.292 178.191 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 16.5 mm-40 -89.2 176.13 7.08 Favored 'General case' 0 N--CA 1.478 0.928 0 C-N-CA 123.42 0.688 . . . . 74.12 111.29 -176.671 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 85' ' ' ARG . . . . . . . . . . . . . 20.3 mmt180 -116.51 38.77 3.33 Favored 'General case' 0 N--CA 1.481 1.077 0 C-N-CA 124.595 1.158 . . . . 71.33 109.006 178.429 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 56.8 mt 67.35 89.56 0.1 Allowed 'General case' 0 C--N 1.361 1.069 0 C-N-CA 124.959 1.304 . . . . 73.42 110.607 -178.003 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 22.9 t70 -160.0 -59.43 0.06 Allowed 'General case' 0 CA--C 1.539 0.524 0 CA-C-N 115.089 -0.959 . . . . 63.23 109.784 -179.644 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 88' ' ' GLU . . . . . 0.431 ' HG2' HD13 ' A' ' 82' ' ' LEU . 7.4 tp10 -48.46 -53.49 17.7 Favored 'General case' 0 N--CA 1.48 1.07 0 O-C-N 124.855 1.347 . . . . 73.53 112.612 -173.053 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 81.8 mt -124.65 52.39 1.54 Allowed 'General case' 0 N--CA 1.477 0.905 0 N-CA-C 108.352 -0.981 . . . . 64.23 108.352 177.794 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 29.9 t -150.4 17.83 0.83 Allowed 'General case' 0 N--CA 1.478 0.958 0 C-N-CA 123.788 0.835 . . . . 62.04 110.486 -176.089 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 24.2 m -75.87 77.4 2.78 Favored 'General case' 0 C--N 1.352 0.709 0 C-N-CA 124.369 1.068 . . . . 75.11 111.256 -175.737 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 92' ' ' LEU . . . . . 0.763 HD21 ' HB3' ' A' ' 41' ' ' LEU . 89.7 mt -141.12 -73.68 0.33 Allowed 'General case' 0 N--CA 1.473 0.681 0 C-N-CA 125.094 1.358 . . . . 73.53 108.493 -178.655 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 38.3 mt -112.72 -20.32 6.28 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.872 0 C-N-CA 124.852 1.261 . . . . 72.03 108.449 175.434 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 102.35 -62.76 0.48 Allowed Glycine 0 C--N 1.353 1.473 0 CA-C-N 115.962 -0.563 . . . . 72.11 111.915 173.972 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 9.9 pt20 -77.25 -171.81 2.2 Favored 'General case' 0 N--CA 1.482 1.165 0 C-N-CA 123.255 0.622 . . . . 61.52 111.935 -176.942 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 71.7 p -74.81 11.67 1.01 Allowed 'General case' 0 N--CA 1.472 0.647 0 CA-C-O 117.847 -1.073 . . . . 74.1 113.797 -174.944 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 96.0 m -48.58 -42.19 33.0 Favored 'General case' 0 N--CA 1.483 1.199 0 C-N-CA 124.173 0.989 . . . . 72.35 112.397 177.528 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 98' ' ' ARG . . . . . 0.569 ' HD2' HD12 ' A' ' 92' ' ' LEU . 18.5 mtm105 -68.11 -53.65 23.81 Favored 'General case' 0 N--CA 1.475 0.815 0 C-N-CA 124.074 0.95 . . . . 73.45 109.696 -176.687 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 7.7 tp-100 -61.93 -35.16 77.57 Favored 'General case' 0 N--CA 1.477 0.913 0 C-N-CA 124.605 1.162 . . . . 70.22 110.617 -178.226 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -72.75 -39.44 66.83 Favored 'General case' 0 N--CA 1.472 0.656 0 C-N-CA 124.645 1.178 . . . . 73.44 108.966 179.734 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 42.6 t -69.65 -38.3 77.07 Favored 'General case' 0 C--N 1.352 0.678 0 C-N-CA 124.008 0.923 . . . . 75.21 111.585 -176.265 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 102' ' ' LEU . . . . . 0.479 ' HG ' ' HH2' ' A' ' 11' ' ' TRP . 10.8 mp -80.8 -32.7 35.2 Favored 'General case' 0 N--CA 1.472 0.628 0 O-C-N 123.551 0.532 . . . . 62.45 110.649 -179.838 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 25.0 t-20 -68.61 -37.34 79.7 Favored 'General case' 0 N--CA 1.486 1.325 0 CA-C-O 120.975 0.416 . . . . 62.15 109.958 172.852 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 104' ' ' ASN . . . . . 0.667 ' HA ' HH21 ' A' ' 108' ' ' ARG . 28.4 t-20 -65.92 -44.84 83.95 Favored 'General case' 0 C--N 1.356 0.89 0 N-CA-C 108.812 -0.811 . . . . 74.33 108.812 174.661 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -56.5 -41.8 77.29 Favored 'General case' 0 C--N 1.346 0.433 0 O-C-N 124.052 0.845 . . . . 75.43 110.973 178.164 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 106' ' ' TYR . . . . . 0.498 ' HE2' ' HB2' ' A' ' 69' ' ' LYS . 17.2 t80 -68.02 -58.32 4.71 Favored 'General case' 0 CA--C 1.547 0.83 0 C-N-CA 123.339 0.656 . . . . 73.23 110.973 -176.642 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -65.34 -37.04 93.45 Favored Glycine 0 C--N 1.353 1.478 0 CA-C-N 115.797 -0.638 . . . . 53.44 112.413 -173.232 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 108' ' ' ARG . . . . . 0.667 HH21 ' HA ' ' A' ' 104' ' ' ASN . 0.0 OUTLIER -80.34 -22.73 41.14 Favored 'General case' 0 CA--C 1.538 0.507 0 C-N-CA 123.514 0.726 . . . . 73.14 110.673 179.422 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 109' ' ' LEU . . . . . 0.568 HD23 ' HB2' ' A' ' 65' ' ' ALA . 41.0 tp -67.15 -37.24 83.45 Favored 'General case' 0 N--CA 1.498 1.974 0 CA-C-O 121.402 0.62 . . . . 73.55 109.543 170.55 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 30.4 t -70.7 -36.15 73.12 Favored 'General case' 0 CA--C 1.55 0.976 0 CA-C-N 114.418 -1.265 . . . . 51.44 110.295 173.529 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . -90.33 -68.25 1.2 Allowed Glycine 0 C--N 1.371 2.509 0 N-CA-C 115.759 1.064 . . . . 70.54 115.759 -176.511 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 112' ' ' MET . . . . . . . . . . . . . 5.5 tmm? -95.97 -62.99 1.2 Allowed 'General case' 0 N--CA 1.498 1.967 0 CA-C-N 118.911 1.356 . . . . 64.23 111.078 -177.49 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 113' ' ' LEU . . . . . 0.406 HD23 ' HA ' ' A' ' 113' ' ' LEU . 5.8 mt 157.47 66.38 0.0 OUTLIER 'General case' 0 N--CA 1.494 1.749 0 C-N-CA 128.141 2.576 . . . . 63.42 107.198 179.526 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 114' ' ' LEU . . . . . 0.47 ' H ' ' HA ' ' A' ' 109' ' ' LEU . 7.1 tt 79.55 -29.25 0.14 Allowed 'General case' 0 N--CA 1.483 1.211 0 C-N-CA 126.958 2.103 . . . . 72.31 112.698 171.12 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 115' ' ' VAL . . . . . . . . . . . . . 18.2 m -124.3 128.03 25.13 Favored Pre-proline 0 CA--C 1.55 0.979 0 C-N-CA 123.424 0.69 . . . . 70.11 110.811 -172.932 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 21.8 Cg_endo -98.34 -173.72 0.17 Allowed 'Trans proline' 0 C--N 1.375 1.938 0 C-N-CA 123.672 2.914 . . . . 72.44 112.587 173.261 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 5.6 m-20 -100.67 -38.21 8.42 Favored 'General case' 0 N--CA 1.488 1.445 0 N-CA-C 108.096 -1.076 . . . . 72.51 108.096 162.458 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -156.22 146.32 15.76 Favored Pre-proline 0 CA--C 1.548 0.884 0 CA-C-N 114.247 -1.342 . . . . 65.5 108.305 176.224 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 119' ' ' PRO . . . . . . . . . . . . . 22.0 Cg_endo -59.83 137.35 75.98 Favored 'Trans proline' 0 C--N 1.373 1.837 0 C-N-CA 122.662 2.241 . . . . 52.13 111.264 173.733 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . -70.89 135.45 24.57 Favored Glycine 0 C--N 1.345 1.039 0 O-C-N 123.539 0.524 . . . . 52.41 113.338 -174.19 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . -108.86 178.21 4.54 Favored 'General case' 0 N--CA 1.479 1.004 0 C-N-CA 124.478 1.111 . . . . 64.14 110.864 178.52 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 122' ' ' SER . . . . . . . . . . . . . 35.6 t . . . . . 0 C--O 1.249 1.061 0 C-N-CA 124.22 1.008 . . . . 54.14 108.291 173.145 . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 18.5 ptt? . . . . . 0 N--CA 1.479 1.001 0 CA-C-O 120.923 0.392 . . . . 64.21 110.739 . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 8.8 t -55.52 -36.22 66.49 Favored 'General case' 0 N--CA 1.487 1.412 0 C-N-CA 123.268 0.627 . . . . 73.12 111.27 -178.205 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 18.4 m -55.11 -50.07 70.16 Favored 'General case' 0 C--N 1.356 0.855 0 C-N-CA 124.382 1.073 . . . . 72.23 110.85 174.416 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 4' ' ' THR . . . . . 0.463 HG21 HD13 ' A' ' 60' ' ' ILE . 24.2 m -69.14 -39.09 79.04 Favored 'General case' 0 C--O 1.217 -0.616 0 CA-C-N 115.19 -0.914 . . . . 73.32 111.741 -177.508 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 74.6 t -61.91 -47.37 93.52 Favored 'Isoleucine or valine' 0 C--O 1.255 1.378 0 C-N-CA 122.698 0.399 . . . . 43.31 110.143 -177.276 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 27.6 mm-40 -61.43 -48.35 81.6 Favored 'General case' 0 C--N 1.351 0.639 0 CA-C-N 115.669 -0.696 . . . . 45.21 110.114 174.862 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 38.4 t80 -54.18 -49.88 68.31 Favored 'General case' 0 N--CA 1.485 1.31 0 C-N-CA 124.633 1.173 . . . . 64.32 111.472 -176.568 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 8' ' ' ILE . . . . . 0.449 HG13 ' O ' ' A' ' 4' ' ' THR . 64.0 mt -64.02 -47.33 90.87 Favored 'Isoleucine or valine' 0 C--N 1.359 0.988 0 C-N-CA 123.506 0.722 . . . . 72.02 110.123 179.624 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 2.9 t-20 -62.15 -28.94 70.0 Favored 'General case' 0 N--CA 1.484 1.251 0 O-C-N 123.559 0.537 . . . . 64.34 111.272 -176.811 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 96.9 mtt180 -72.82 -40.27 65.95 Favored 'General case' 0 CA--C 1.543 0.692 0 C-N-CA 123.803 0.841 . . . . 52.12 110.584 174.347 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 11' ' ' TRP . . . . . . . . . . . . . 84.0 m95 -65.8 -29.96 70.52 Favored 'General case' 0 N--CA 1.486 1.328 0 C-N-CA 122.801 0.441 . . . . 74.2 111.591 172.99 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 12' ' ' GLN . . . . . 0.459 ' HG2' ' CE2' ' A' ' 67' ' ' TYR . 38.2 mt-30 -65.21 -46.29 81.31 Favored 'General case' 0 C--O 1.211 -0.953 0 N-CA-C 107.796 -1.187 . . . . 72.31 107.796 173.352 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 61.6 ttt180 -59.62 -41.27 90.03 Favored 'General case' 0 CA--C 1.547 0.851 0 O-C-N 124.034 0.834 . . . . 63.3 111.71 -179.767 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 77.9 mt -64.41 -49.91 78.65 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.478 0 C-N-CA 123.098 0.559 . . . . 71.31 110.094 178.537 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 15' ' ' ALA . . . . . 0.463 ' HA ' ' HB ' ' A' ' 71' ' ' THR . . . -57.36 -46.55 83.22 Favored 'General case' 0 N--CA 1.478 0.933 0 C-N-CA 124.629 1.172 . . . . 74.3 111.656 178.869 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 89.5 mt -80.17 -34.33 37.63 Favored 'General case' 0 N--CA 1.477 0.896 0 CA-C-N 114.579 -1.191 . . . . 72.23 111.402 -171.968 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.512 ' O ' ' HG ' ' A' ' 21' ' ' LEU . 21.0 mt -67.71 -49.46 62.54 Favored 'General case' 0 N--CA 1.481 1.092 0 N-CA-C 109.642 -0.503 . . . . 73.43 109.642 177.542 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 85.0 p -62.56 -37.72 87.25 Favored 'General case' 0 N--CA 1.478 0.953 0 O-C-N 123.513 0.508 . . . . 64.42 111.052 178.588 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 23.3 tp60 -56.95 -46.92 81.78 Favored 'General case' 0 C--N 1.358 0.951 0 C-N-CA 123.497 0.719 . . . . 74.12 110.159 172.163 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 63.9 m -65.7 -42.11 91.56 Favored 'General case' 0 C--O 1.213 -0.819 0 O-C-N 123.707 0.629 . . . . 75.43 110.688 179.018 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 21' ' ' LEU . . . . . 0.512 ' HG ' ' O ' ' A' ' 17' ' ' LEU . 87.1 mt -63.43 -34.23 77.3 Favored 'General case' 0 N--CA 1.476 0.832 0 C-N-CA 123.56 0.744 . . . . 53.33 109.882 -178.032 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.589 ' HA ' HD21 ' A' ' 78' ' ' LEU . 56.1 tp -66.97 -54.72 19.16 Favored 'General case' 0 C--N 1.352 0.682 0 C-N-CA 123.535 0.734 . . . . 73.43 110.12 176.026 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 9.5 mm-40 -50.82 -52.58 39.82 Favored 'General case' 0 N--CA 1.479 1.01 0 C-N-CA 124.341 1.056 . . . . 71.34 111.439 178.15 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.469 HD22 HD12 ' A' ' 32' ' ' LEU . 62.4 mt -70.15 -34.54 73.15 Favored 'General case' 0 CA--C 1.539 0.557 0 C-N-CA 124.602 1.161 . . . . 74.02 111.078 -173.334 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 25' ' ' ALA . . . . . 0.45 ' HB2' HD21 ' A' ' 33' ' ' LEU . . . -60.64 -44.01 96.89 Favored 'General case' 0 N--CA 1.479 1.012 0 CA-C-O 120.902 0.382 . . . . 34.13 110.65 173.754 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 95.1 mt-30 -69.48 -31.79 70.29 Favored 'General case' 0 CA--C 1.549 0.918 0 CA-C-N 115.303 -0.862 . . . . 55.24 111.518 179.016 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 78.3 mtt180 -90.48 -2.57 57.93 Favored 'General case' 0 N--CA 1.483 1.198 0 C-N-CA 123.756 0.822 . . . . 71.24 112.315 -177.834 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 85.38 10.04 78.12 Favored Glycine 0 N--CA 1.479 1.566 0 N-CA-C 114.433 0.533 . . . . 74.11 114.433 174.891 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 29' ' ' GLU . . . . . 0.422 ' HB2' ' HB3' ' A' ' 24' ' ' LEU . 15.3 mm-40 -90.37 55.08 2.93 Favored 'General case' 0 N--CA 1.478 0.942 0 C-N-CA 124.79 1.236 . . . . 71.44 111.126 178.261 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 30' ' ' TRP . . . . . 0.489 ' HA ' HD13 ' A' ' 33' ' ' LEU . 83.5 m95 -63.02 -23.38 67.43 Favored 'General case' 0 N--CA 1.491 1.58 0 C-N-CA 123.875 0.87 . . . . 71.04 111.6 179.441 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 4.1 m-20 -55.61 -47.83 75.89 Favored 'General case' 0 N--CA 1.473 0.702 0 C-N-CA 124.984 1.314 . . . . 51.43 110.18 175.22 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.469 HD12 HD22 ' A' ' 24' ' ' LEU . 82.0 mt -72.3 -24.33 61.31 Favored 'General case' 0 CA--C 1.544 0.723 0 CA-C-N 114.306 -1.315 . . . . 53.4 110.954 -177.872 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 33' ' ' LEU . . . . . 0.489 HD13 ' HA ' ' A' ' 30' ' ' TRP . 9.4 mp -66.23 -45.18 81.57 Favored 'General case' 0 C--N 1.363 1.184 0 N-CA-C 110.101 -0.333 . . . . 73.23 110.101 171.228 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 88.8 mt -65.54 -38.63 90.17 Favored 'General case' 0 N--CA 1.482 1.136 0 C-N-CA 123.325 0.65 . . . . 72.41 111.784 -178.677 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 95.7 mt-30 -71.09 -49.68 41.81 Favored 'General case' 0 N--CA 1.478 0.938 0 C-N-CA 122.588 0.355 . . . . 74.5 110.681 179.211 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 85.2 mm-40 -73.95 -14.2 61.01 Favored 'General case' 0 N--CA 1.483 1.182 0 C-N-CA 123.102 0.561 . . . . 53.32 112.464 179.314 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 37' ' ' GLU . . . . . 0.453 ' O ' ' HG ' ' A' ' 41' ' ' LEU . 42.9 tt0 -51.92 -52.13 52.1 Favored 'General case' 0 N--CA 1.484 1.236 0 C-N-CA 123.94 0.896 . . . . 73.42 111.32 176.485 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 62.9 t -56.63 -47.84 81.59 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.755 0 O-C-N 123.889 0.743 . . . . 71.53 110.661 -178.856 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 32.0 m -67.04 -37.0 83.31 Favored 'General case' 0 CA--C 1.538 0.508 0 CA-C-N 115.455 -0.793 . . . . 75.55 111.801 -177.695 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 43.8 t80 -70.69 -49.47 46.77 Favored 'General case' 0 N--CA 1.47 0.541 0 C-N-CA 123.248 0.619 . . . . 72.14 110.65 -176.875 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 41' ' ' LEU . . . . . 0.564 HD22 HD22 ' A' ' 92' ' ' LEU . 22.2 mt -68.36 -41.88 80.03 Favored 'General case' 0 N--CA 1.478 0.939 0 O-C-N 123.851 0.719 . . . . 74.13 110.144 -176.749 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 41.1 tt0 -57.43 -56.03 27.16 Favored 'General case' 0 C--N 1.358 0.965 0 O-C-N 123.924 0.765 . . . . 70.54 110.788 176.119 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 43' ' ' SER . . . . . 0.537 ' O ' HG23 ' A' ' 47' ' ' VAL . 73.0 m -57.54 -56.98 14.93 Favored 'General case' 0 C--N 1.352 0.704 0 O-C-N 124.046 0.841 . . . . 74.21 110.692 -177.587 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 14.6 tt -59.2 -40.8 82.01 Favored 'Isoleucine or valine' 0 C--N 1.354 0.803 0 O-C-N 123.799 0.687 . . . . 63.4 111.39 -172.139 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 38.1 mm-40 -64.07 -47.55 79.65 Favored 'General case' 0 C--N 1.358 0.964 0 CA-C-O 119.435 -0.317 . . . . 71.44 111.412 176.429 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 18.3 m -66.53 -27.6 67.89 Favored 'General case' 0 CA--C 1.551 0.983 0 O-C-N 123.457 0.473 . . . . 73.51 111.849 -177.222 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 47' ' ' VAL . . . . . 0.537 HG23 ' O ' ' A' ' 43' ' ' SER . 59.1 t -80.97 -38.37 16.81 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.384 0 C-N-CA 123.335 0.654 . . . . 72.02 110.612 -179.194 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 48' ' ' MET . . . . . . . . . . . . . 68.5 mtm -73.13 -21.9 60.63 Favored 'General case' 0 N--CA 1.486 1.374 0 C-N-CA 122.755 0.422 . . . . 62.45 110.407 172.894 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 17.2 tp10 -88.0 -18.74 28.34 Favored 'General case' 0 N--CA 1.481 1.096 0 C-N-CA 124.251 1.02 . . . . 73.2 110.167 174.793 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 14.2 tppt? -78.36 138.76 38.7 Favored 'General case' 0 C--O 1.24 0.581 0 N-CA-C 109.27 -0.641 . . . . 64.5 109.27 -179.852 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 52.0 tt0 -68.5 124.99 25.08 Favored 'General case' 0 C--O 1.241 0.639 0 CA-C-N 115.423 -0.808 . . . . 71.31 109.558 -177.899 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 52' ' ' THR . . . . . 0.463 HG21 ' HB3' ' A' ' 114' ' ' LEU . 29.7 m -61.08 121.34 61.82 Favored Pre-proline 0 CA--C 1.555 1.155 0 C-N-CA 123.672 0.789 . . . . 73.21 110.612 178.686 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 55.7 Cg_endo -67.19 155.88 68.69 Favored 'Trans proline' 0 C--N 1.376 1.988 0 C-N-CA 122.414 2.076 . . . . 65.23 111.764 176.484 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 18.1 Cg_exo -67.08 -52.87 0.56 Allowed 'Trans proline' 0 C--N 1.376 1.992 0 C-N-CA 122.399 2.066 . . . . 75.32 111.72 177.574 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . -70.11 86.8 0.31 Allowed Glycine 0 C--N 1.349 1.251 0 O-C-N 124.09 0.869 . . . . 63.24 112.912 -175.618 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 56' ' ' ILE . . . . . 0.472 ' O ' ' HB ' ' A' ' 60' ' ' ILE . 71.9 mt -115.5 -50.28 4.82 Favored 'Isoleucine or valine' 0 C--O 1.209 -1.044 0 C-N-CA 124.646 1.178 . . . . 73.21 108.99 176.416 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 10.4 p 60.43 -177.37 0.1 Allowed 'General case' 0 CA--C 1.557 1.23 0 C-N-CA 125.872 1.669 . . . . 53.0 111.077 -178.2 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -55.57 -42.85 75.3 Favored 'General case' 0 N--CA 1.479 1.011 0 C-N-CA 124.345 1.058 . . . . 71.44 110.144 176.168 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 49.3 m -61.76 -53.97 48.83 Favored 'General case' 0 CA--C 1.545 0.788 0 CA-C-N 115.697 -0.683 . . . . 30.1 112.759 -173.264 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 60' ' ' ILE . . . . . 0.472 ' HB ' ' O ' ' A' ' 56' ' ' ILE . 26.1 mt -79.28 -23.74 12.52 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.182 0 N-CA-C 109.631 -0.507 . . . . 70.15 109.631 -174.648 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 61' ' ' GLN . . . . . 0.47 ' HG3' ' HG ' ' A' ' 109' ' ' LEU . 53.2 tt0 -58.75 -48.23 81.92 Favored 'General case' 0 C--N 1.358 0.942 0 N-CA-C 109.866 -0.42 . . . . 75.35 109.866 172.005 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 3.4 m-20 -71.56 -37.68 71.05 Favored 'General case' 0 CA--C 1.547 0.842 0 CA-C-N 115.973 -0.558 . . . . 62.41 112.416 178.616 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 63' ' ' MET . . . . . . . . . . . . . 69.2 mtm -64.93 -59.79 3.78 Favored 'General case' 0 N--CA 1.488 1.466 0 CA-C-N 117.775 0.261 . . . . 70.13 111.284 179.172 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 64' ' ' VAL . . . . . 0.456 ' O ' HG13 ' A' ' 68' ' ' ILE . 55.5 t -57.64 -49.44 80.64 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.033 0 C-N-CA 123.516 0.726 . . . . 74.23 111.984 178.263 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 65' ' ' ALA . . . . . 0.498 ' HB2' HD23 ' A' ' 109' ' ' LEU . . . -64.7 -33.21 75.41 Favored 'General case' 0 N--CA 1.495 1.795 0 CA-C-N 118.977 0.808 . . . . 50.2 111.279 -179.638 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -64.36 -39.02 96.61 Favored Glycine 0 C--N 1.347 1.19 0 N-CA-C 112.182 -0.367 . . . . 52.44 112.182 174.795 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 67' ' ' TYR . . . . . 0.47 ' O ' HG22 ' A' ' 71' ' ' THR . 14.2 m-30 -65.48 -42.6 92.06 Favored 'General case' 0 N--CA 1.471 0.61 0 C-N-CA 123.636 0.774 . . . . 74.13 110.752 175.306 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 68' ' ' ILE . . . . . 0.542 ' O ' ' HG ' ' A' ' 72' ' ' LEU . 78.5 mt -59.34 -49.97 81.57 Favored 'Isoleucine or valine' 0 C--N 1.355 0.836 0 O-C-N 124.619 1.199 . . . . 74.23 109.38 178.689 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 69' ' ' LYS . . . . . 0.576 ' HB2' ' HE2' ' A' ' 106' ' ' TYR . 27.9 tptp -57.37 -46.09 83.76 Favored 'General case' 0 N--CA 1.472 0.666 0 C-N-CA 124.013 0.925 . . . . 74.24 110.393 -179.26 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 53.5 tt0 -59.35 -48.21 82.49 Favored 'General case' 0 C--N 1.354 0.802 0 CA-C-N 115.306 -0.861 . . . . 72.32 111.058 -179.411 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 71' ' ' THR . . . . . 0.47 HG22 ' O ' ' A' ' 67' ' ' TYR . 9.2 t -76.08 -23.74 55.03 Favored 'General case' 0 C--O 1.24 0.584 0 O-C-N 123.401 0.438 . . . . 74.12 110.227 -174.438 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 72' ' ' LEU . . . . . 0.631 ' HA ' HH12 ' A' ' 98' ' ' ARG . 39.5 mt -61.37 -51.73 67.56 Favored 'General case' 0 C--N 1.363 1.158 0 N-CA-C 108.648 -0.871 . . . . 72.42 108.648 171.796 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 28.6 m-20 -64.51 -48.57 74.65 Favored 'General case' 0 N--CA 1.484 1.231 0 O-C-N 123.945 0.778 . . . . 75.51 112.429 179.716 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 94.6 m-20 -52.02 -56.63 13.09 Favored 'General case' 0 N--CA 1.491 1.593 0 C-N-CA 124.03 0.932 . . . . 63.2 110.729 -179.989 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 15.6 tt0 -70.49 -30.52 67.32 Favored 'General case' 0 CA--C 1.551 1.014 0 CA-C-N 114.787 -1.097 . . . . 74.24 110.762 -176.527 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 57.4 tt0 -64.22 -41.26 97.11 Favored 'General case' 0 N--CA 1.487 1.419 0 C-N-CA 123.49 0.716 . . . . 55.11 110.77 176.744 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 95.2 mt -67.26 -38.99 86.03 Favored 'General case' 0 N--CA 1.47 0.57 0 CA-C-N 115.7 -0.682 . . . . 73.42 109.929 178.085 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 78' ' ' LEU . . . . . 0.589 HD21 ' HA ' ' A' ' 22' ' ' LEU . 74.9 mt -58.78 -51.25 70.8 Favored 'General case' 0 C--N 1.357 0.898 0 CA-C-N 115.867 -0.606 . . . . 74.5 111.454 172.042 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 79' ' ' LYS . . . . . 0.563 ' HE2' ' O ' ' A' ' 88' ' ' GLU . 2.9 mptm? -61.33 -38.97 88.81 Favored 'General case' 0 N--CA 1.481 1.122 0 C-N-CA 123.956 0.902 . . . . 73.15 111.313 -179.442 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -67.94 -29.83 73.82 Favored Glycine 0 C--N 1.341 0.857 0 O-C-N 123.738 0.649 . . . . 62.13 112.204 177.429 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 81' ' ' LEU . . . . . 0.431 HD22 ' HH2' ' A' ' 30' ' ' TRP . 4.3 tt -78.2 -39.28 41.13 Favored 'General case' 0 CA--C 1.554 1.115 0 C-N-CA 123.5 0.72 . . . . 72.32 109.582 176.088 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 82' ' ' LEU . . . . . 0.433 ' HG ' ' O ' ' A' ' 78' ' ' LEU . 94.0 mt -77.85 -66.6 0.82 Allowed 'General case' 0 N--CA 1.48 1.073 0 C-N-CA 123.184 0.594 . . . . 74.13 111.057 -171.997 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 15.5 mm100 -147.28 -72.57 0.22 Allowed 'General case' 0 N--CA 1.475 0.821 0 C-N-CA 124.162 0.985 . . . . 74.1 109.308 -170.563 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 84' ' ' GLN . . . . . 0.422 ' HG2' ' HG2' ' A' ' 85' ' ' ARG . 8.4 tt0 -169.01 163.8 11.35 Favored 'General case' 0 CA--C 1.541 0.612 0 C-N-CA 124.209 1.003 . . . . 55.12 108.417 -173.499 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 85' ' ' ARG . . . . . 0.422 ' HG2' ' HG2' ' A' ' 84' ' ' GLN . 4.6 ptp180 -44.84 -35.5 2.8 Favored 'General case' 0 N--CA 1.489 1.502 0 C-N-CA 125.499 1.519 . . . . 73.1 113.865 -179.244 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 86' ' ' LEU . . . . . 0.578 HD22 ' HB3' ' A' ' 96' ' ' SER . 86.0 mt -130.19 98.45 4.73 Favored 'General case' 0 N--CA 1.469 0.487 0 C-N-CA 123.588 0.755 . . . . 70.22 109.218 176.957 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 10.2 t70 -160.63 -89.9 0.03 OUTLIER 'General case' 0 CA--C 1.55 0.974 0 N-CA-C 108.531 -0.914 . . . . 74.02 108.531 174.649 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 88' ' ' GLU . . . . . 0.563 ' O ' ' HE2' ' A' ' 79' ' ' LYS . 48.9 mt-10 -85.89 148.4 25.81 Favored 'General case' 0 N--CA 1.485 1.296 0 C-N-CA 123.598 0.759 . . . . 61.4 109.036 175.559 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 88.5 mt 61.73 20.74 11.63 Favored 'General case' 0 N--CA 1.498 1.93 0 C-N-CA 124.59 1.156 . . . . 43.31 112.265 -179.508 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 20.2 m -112.64 -40.58 4.02 Favored 'General case' 0 N--CA 1.48 1.064 0 C-N-CA 123.635 0.774 . . . . 74.53 110.301 -176.166 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 26.9 m -79.24 92.24 5.09 Favored 'General case' 0 N--CA 1.471 0.602 0 C-N-CA 123.811 0.844 . . . . 74.42 109.786 176.897 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 92' ' ' LEU . . . . . 0.564 HD22 HD22 ' A' ' 41' ' ' LEU . 11.9 mt -90.51 -62.89 1.36 Allowed 'General case' 0 N--CA 1.476 0.875 0 CA-C-N 116.044 -0.525 . . . . 70.0 110.552 -174.461 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 49.4 mt -77.24 -43.52 31.13 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.244 0 N-CA-C 109.076 -0.713 . . . . 72.14 109.076 173.14 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -171.62 -29.41 0.02 OUTLIER Glycine 0 C--N 1.346 1.115 0 CA-C-N 115.14 -0.936 . . . . 72.21 112.289 -179.226 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 14.1 pt20 -140.99 -177.41 5.08 Favored 'General case' 0 N--CA 1.481 1.102 0 C-N-CA 123.61 0.764 . . . . 73.52 110.112 179.544 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 96' ' ' SER . . . . . 0.578 ' HB3' HD22 ' A' ' 86' ' ' LEU . 50.2 m -66.91 83.01 0.11 Allowed 'General case' 0 CA--C 1.541 0.615 0 C-N-CA 124.233 1.013 . . . . 74.33 112.249 -174.618 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 89.7 m -88.12 -41.85 12.75 Favored 'General case' 0 CA--C 1.54 0.558 0 C-N-CA 123.744 0.818 . . . . 64.41 110.075 176.526 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 98' ' ' ARG . . . . . 0.631 HH12 ' HA ' ' A' ' 72' ' ' LEU . 1.7 tmt_? -49.88 -57.65 6.99 Favored 'General case' 0 N--CA 1.478 0.948 0 C-N-CA 125.075 1.35 . . . . 64.2 112.929 -165.57 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 8.9 tt0 -60.51 -52.4 65.35 Favored 'General case' 0 N--CA 1.477 0.916 0 O-C-N 123.789 0.681 . . . . 64.43 110.861 -170.318 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 65.5 tttp -64.78 -42.99 94.65 Favored 'General case' 0 CA--C 1.542 0.673 0 O-C-N 124.15 0.906 . . . . 51.42 111.473 -178.397 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 26.5 t -69.37 -40.24 77.55 Favored 'General case' 0 N--CA 1.467 0.419 0 C-N-CA 123.426 0.691 . . . . 71.11 111.613 -173.122 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 102' ' ' LEU . . . . . 0.49 ' HG ' HG23 ' A' ' 68' ' ' ILE . 3.4 tp -80.38 -34.65 36.19 Favored 'General case' 0 N--CA 1.471 0.6 0 C-N-CA 122.787 0.435 . . . . 62.25 110.47 -176.372 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 7.6 t30 -63.41 -40.03 96.11 Favored 'General case' 0 N--CA 1.479 1.016 0 C-N-CA 122.933 0.493 . . . . 54.41 109.907 172.902 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 12.0 t30 -67.07 -41.28 86.69 Favored 'General case' 0 N--CA 1.473 0.722 0 CA-C-N 115.651 -0.704 . . . . 71.52 110.126 177.188 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -59.14 -45.17 91.66 Favored 'General case' 0 N--CA 1.47 0.566 0 O-C-N 123.598 0.561 . . . . 55.33 110.402 177.44 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 106' ' ' TYR . . . . . 0.576 ' HE2' ' HB2' ' A' ' 69' ' ' LYS . 19.9 t80 -60.71 -55.4 33.67 Favored 'General case' 0 C--N 1.355 0.821 0 O-C-N 124.046 0.841 . . . . 74.41 110.477 178.999 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -66.09 -44.04 92.13 Favored Glycine 0 C--N 1.349 1.302 0 O-C-N 124.318 1.011 . . . . 43.14 112.494 -171.058 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 20.4 mmm180 -67.1 -33.3 75.18 Favored 'General case' 0 CA--C 1.541 0.633 0 C-N-CA 123.258 0.623 . . . . 72.44 111.048 177.512 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 109' ' ' LEU . . . . . 0.535 ' HA ' ' N ' ' A' ' 114' ' ' LEU . 35.6 tp -68.33 -43.43 77.57 Favored 'General case' 0 N--CA 1.485 1.287 0 C-N-CA 122.819 0.448 . . . . 62.1 110.359 176.327 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 33.2 t -68.06 -31.73 71.57 Favored 'General case' 0 CA--C 1.54 0.595 0 CA-C-N 114.701 -1.136 . . . . 70.11 110.296 -178.326 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . -89.64 -65.18 1.25 Allowed Glycine 0 C--N 1.36 1.898 0 CA-C-O 119.109 -0.828 . . . . 73.24 113.941 -179.502 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 112' ' ' MET . . . . . 0.484 ' O ' ' HG ' ' A' ' 113' ' ' LEU . 10.0 tpt -98.1 -72.52 0.65 Allowed 'General case' 0 N--CA 1.486 1.347 0 CA-C-N 118.609 1.204 . . . . 74.11 112.273 174.637 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 113' ' ' LEU . . . . . 0.484 ' HG ' ' O ' ' A' ' 112' ' ' MET . 12.2 mt 171.25 45.88 0.0 OUTLIER 'General case' 0 N--CA 1.505 2.305 0 C-N-CA 125.445 1.498 . . . . 62.44 109.561 -174.406 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 114' ' ' LEU . . . . . 0.535 ' N ' ' HA ' ' A' ' 109' ' ' LEU . 2.1 tt 82.12 -25.32 0.16 Allowed 'General case' 0 N--CA 1.507 2.388 0 C-N-CA 126.633 1.973 . . . . 62.13 111.343 172.075 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 115' ' ' VAL . . . . . 0.418 ' HA ' ' HD3' ' A' ' 116' ' ' PRO . 35.2 m -77.53 129.93 75.65 Favored Pre-proline 0 CA--C 1.552 1.026 0 C-N-CA 123.685 0.794 . . . . 74.44 109.988 -175.841 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 116' ' ' PRO . . . . . 0.418 ' HD3' ' HA ' ' A' ' 115' ' ' VAL . 12.2 Cg_exo -71.53 92.25 0.68 Allowed 'Trans proline' 0 C--N 1.372 1.807 0 C-N-CA 122.91 2.407 . . . . 64.33 110.956 177.178 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 33.8 t70 -171.5 88.22 0.1 Allowed 'General case' 0 C--O 1.241 0.635 0 C-N-CA 124.295 1.038 . . . . 64.24 108.555 -172.717 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -80.69 109.96 15.26 Favored Pre-proline 0 CA--C 1.553 1.085 0 C-N-CA 123.444 0.698 . . . . 72.1 110.413 179.308 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 119' ' ' PRO . . . . . . . . . . . . . 42.9 Cg_endo -99.8 19.09 0.32 Allowed 'Trans proline' 0 C--N 1.375 1.967 0 C-N-CA 123.629 2.886 . . . . 72.34 112.972 -179.824 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . 83.77 -67.23 3.76 Favored Glycine 0 C--N 1.348 1.233 0 N-CA-C 110.599 -1.0 . . . . 71.43 110.599 -168.775 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . -168.09 161.21 12.45 Favored 'General case' 0 N--CA 1.472 0.667 0 C-N-CA 124.557 1.143 . . . . 62.34 109.158 171.381 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 122' ' ' SER . . . . . . . . . . . . . 17.8 m . . . . . 0 C--O 1.253 1.255 0 N-CA-C 109.004 -0.739 . . . . 71.31 109.004 175.749 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 1' ' ' MET . . . . . 0.4 ' O ' HG23 ' A' ' 5' ' ' VAL . 24.6 ptm . . . . . 0 N--CA 1.483 1.221 0 CA-C-O 119.706 -0.188 . . . . 71.02 111.327 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 26.2 p -56.05 -39.65 72.35 Favored 'General case' 0 N--CA 1.484 1.267 0 C-N-CA 123.286 0.634 . . . . 75.24 111.739 -179.934 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 48.3 m -68.46 -30.76 69.7 Favored 'General case' 0 CA--C 1.54 0.593 0 C-N-CA 123.375 0.67 . . . . 65.14 111.637 177.124 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 4' ' ' THR . . . . . 0.516 ' HA ' ' HG3' ' A' ' 53' ' ' PRO . 12.4 m -74.42 -35.99 63.43 Favored 'General case' 0 C--N 1.351 0.668 0 C-N-CA 123.04 0.536 . . . . 73.12 111.226 177.207 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 5' ' ' VAL . . . . . 0.4 HG23 ' O ' ' A' ' 1' ' ' MET . 48.7 t -66.27 -40.29 86.47 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.745 0 N-CA-C 109.248 -0.649 . . . . 73.03 109.248 175.478 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 6' ' ' GLU . . . . . 0.511 ' O ' ' HG3' ' A' ' 10' ' ' ARG . 5.0 tm-20 -65.34 -37.21 86.37 Favored 'General case' 0 CA--C 1.542 0.652 0 CA-C-N 114.466 -1.243 . . . . 65.11 110.062 176.157 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 7' ' ' PHE . . . . . 0.421 ' O ' ' HB2' ' A' ' 10' ' ' ARG . 69.0 t80 -67.88 -44.62 76.63 Favored 'General case' 0 N--CA 1.48 1.069 0 C-N-CA 124.516 1.126 . . . . 63.31 112.103 178.4 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 8' ' ' ILE . . . . . 0.49 HD11 HG23 ' A' ' 60' ' ' ILE . 83.9 mt -65.49 -37.68 80.63 Favored 'Isoleucine or valine' 0 C--O 1.214 -0.813 0 N-CA-C 108.752 -0.832 . . . . 74.45 108.752 175.611 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 28.4 t-20 -65.2 -28.87 69.69 Favored 'General case' 0 N--CA 1.482 1.131 0 C-N-CA 124.594 1.157 . . . . 63.53 110.937 175.762 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . 0.6 ' HB3' HG22 ' A' ' 47' ' ' VAL . 65.4 mtt180 -62.56 -53.78 49.53 Favored 'General case' 0 N--CA 1.484 1.251 0 CA-C-O 121.766 0.793 . . . . 74.24 109.216 172.408 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 11' ' ' TRP . . . . . . . . . . . . . 98.3 m95 -73.89 -20.62 60.35 Favored 'General case' 0 N--CA 1.475 0.801 0 CA-C-N 114.927 -1.033 . . . . 74.23 112.741 -177.963 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . 0.439 ' HG3' ' O ' ' A' ' 8' ' ' ILE . 58.7 mt-30 -72.18 -38.86 69.01 Favored 'General case' 0 C--O 1.214 -0.813 0 N-CA-C 108.795 -0.817 . . . . 60.53 108.795 170.117 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 16.5 tpt180 -58.57 -52.34 66.07 Favored 'General case' 0 CA--C 1.54 0.563 0 O-C-N 123.812 0.695 . . . . 74.03 109.702 178.996 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 14' ' ' ILE . . . . . 0.463 HG22 ' OG1' ' A' ' 71' ' ' THR . 22.8 mt -65.04 -46.83 90.21 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.24 0 O-C-N 123.459 0.474 . . . . 63.12 111.03 179.507 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . 0.568 ' HA ' ' HB ' ' A' ' 71' ' ' THR . . . -58.54 -46.78 86.1 Favored 'General case' 0 N--CA 1.491 1.604 0 C-N-CA 123.703 0.801 . . . . 62.23 111.919 -177.278 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 82.7 mt -70.26 -44.6 68.11 Favored 'General case' 0 N--CA 1.479 1.014 0 CA-C-N 114.891 -1.049 . . . . 75.13 111.101 -176.445 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.496 ' O ' ' HG ' ' A' ' 21' ' ' LEU . 74.3 mt -64.83 -45.29 86.78 Favored 'General case' 0 CA--C 1.544 0.717 0 O-C-N 123.607 0.567 . . . . 74.04 111.092 -179.531 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 18' ' ' SER . . . . . 0.408 ' HB3' ' OH ' ' A' ' 40' ' ' TYR . 80.4 p -64.68 -39.01 92.93 Favored 'General case' 0 N--CA 1.484 1.248 0 C-N-CA 123.159 0.584 . . . . 74.45 111.392 -179.36 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 6.0 tp-100 -58.98 -48.3 82.04 Favored 'General case' 0 C--N 1.354 0.777 0 O-C-N 123.972 0.795 . . . . 74.25 110.079 175.045 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 38.4 m -56.74 -50.97 70.65 Favored 'General case' 0 C--N 1.354 0.793 0 O-C-N 124.14 0.9 . . . . 74.35 110.188 177.517 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . 0.497 HD22 ' HA ' ' A' ' 33' ' ' LEU . 81.1 mt -65.32 -30.23 71.06 Favored 'General case' 0 CA--C 1.538 0.507 0 C-N-CA 123.754 0.822 . . . . 62.43 111.163 -175.497 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.707 ' HA ' HD21 ' A' ' 78' ' ' LEU . 63.9 tp -64.72 -58.13 7.09 Favored 'General case' 0 C--N 1.353 0.752 0 N-CA-C 109.534 -0.543 . . . . 74.34 109.534 176.989 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 39.3 mt-10 -57.12 -47.28 81.49 Favored 'General case' 0 N--CA 1.475 0.779 0 O-C-N 124.396 1.06 . . . . 63.33 110.991 -178.015 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 95.9 mt -64.33 -40.33 95.68 Favored 'General case' 0 N--CA 1.473 0.714 0 C-N-CA 123.899 0.88 . . . . 74.15 111.442 -177.372 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . 0.493 ' HB2' HD21 ' A' ' 33' ' ' LEU . . . -61.42 -44.73 96.62 Favored 'General case' 0 N--CA 1.476 0.863 0 C-N-CA 122.895 0.478 . . . . 43.33 110.847 178.195 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 89.6 mt-30 -64.84 -30.81 71.83 Favored 'General case' 0 N--CA 1.477 0.883 0 O-C-N 124.088 0.868 . . . . 62.43 111.2 178.351 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 53.6 mtt180 -83.16 -5.79 59.25 Favored 'General case' 0 N--CA 1.481 1.106 0 C-N-CA 123.568 0.747 . . . . 73.2 112.071 177.271 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 86.67 7.65 78.21 Favored Glycine 0 C--N 1.349 1.271 0 N-CA-C 114.027 0.371 . . . . 63.35 114.027 178.144 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 11.2 mm-40 -82.37 57.63 3.74 Favored 'General case' 0 CA--C 1.546 0.791 0 C-N-CA 124.281 1.032 . . . . 61.42 111.251 178.382 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 30' ' ' TRP . . . . . 0.401 ' O ' ' HG ' ' A' ' 34' ' ' LEU . 84.7 m95 -63.43 -32.04 73.37 Favored 'General case' 0 N--CA 1.477 0.917 0 C-N-CA 123.656 0.782 . . . . 72.13 110.942 -178.769 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 10.1 m-20 -56.66 -42.17 78.52 Favored 'General case' 0 N--CA 1.476 0.846 0 C-N-CA 124.032 0.933 . . . . 64.51 110.706 177.846 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 83.3 mt -66.12 -34.51 78.21 Favored 'General case' 0 N--CA 1.474 0.742 0 C-N-CA 123.395 0.678 . . . . 60.04 111.199 179.743 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . 0.497 ' HA ' HD22 ' A' ' 21' ' ' LEU . 9.9 mp -66.22 -39.61 89.71 Favored 'General case' 0 N--CA 1.481 1.101 0 C-N-CA 122.563 0.345 . . . . 64.14 110.299 173.023 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.401 ' HG ' ' O ' ' A' ' 30' ' ' TRP . 84.9 mt -73.66 -22.94 59.81 Favored 'General case' 0 N--CA 1.478 0.945 0 C-N-CA 123.504 0.722 . . . . 72.33 111.661 -179.091 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 48.7 mt-30 -85.98 -32.73 21.37 Favored 'General case' 0 N--CA 1.486 1.372 0 C-N-CA 123.515 0.726 . . . . 61.35 110.774 176.09 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 25.5 mm-40 -86.19 -12.66 49.2 Favored 'General case' 0 N--CA 1.479 1.02 0 C-N-CA 124.017 0.927 . . . . 72.5 111.521 176.136 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . 0.476 ' O ' ' HG ' ' A' ' 41' ' ' LEU . 36.3 tt0 -44.57 -65.0 0.58 Allowed 'General case' 0 N--CA 1.477 0.889 0 C-N-CA 124.543 1.137 . . . . 53.34 113.055 -178.531 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 93.2 t -65.49 -33.26 62.44 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.692 0 C-N-CA 122.955 0.502 . . . . 61.32 110.866 -175.911 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 57.7 m -63.85 -38.31 90.62 Favored 'General case' 0 N--CA 1.476 0.831 0 C-N-CA 123.069 0.548 . . . . 75.54 111.415 175.406 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 40' ' ' TYR . . . . . 0.408 ' OH ' ' HB3' ' A' ' 18' ' ' SER . 42.4 t80 -78.11 -43.04 30.09 Favored 'General case' 0 C--N 1.344 0.348 0 C-N-CA 123.326 0.65 . . . . 72.34 110.547 -174.705 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . 0.476 ' HG ' ' O ' ' A' ' 37' ' ' GLU . 63.2 mt -64.95 -41.52 95.42 Favored 'General case' 0 C--O 1.245 0.854 0 O-C-N 123.955 0.785 . . . . 63.13 109.554 178.529 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 53.9 tt0 -56.71 -53.4 58.22 Favored 'General case' 0 C--N 1.358 0.962 0 CA-C-N 115.157 -0.929 . . . . 71.41 110.014 173.713 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 43' ' ' SER . . . . . 0.562 ' O ' HG23 ' A' ' 47' ' ' VAL . 71.5 m -56.45 -57.16 13.51 Favored 'General case' 0 C--N 1.35 0.607 0 O-C-N 124.216 0.947 . . . . 72.05 111.658 -178.606 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 16.8 tt -61.03 -41.03 87.64 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.812 0 O-C-N 123.728 0.642 . . . . 72.33 111.335 -172.328 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 30.6 mt-10 -72.24 -37.07 69.23 Favored 'General case' 0 N--CA 1.477 0.89 0 N-CA-C 111.975 0.361 . . . . 74.14 111.975 178.824 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 46' ' ' THR . . . . . 0.505 ' O ' ' HB2' ' A' ' 50' ' ' LYS . 96.0 m -57.65 -40.2 78.74 Favored 'General case' 0 N--CA 1.486 1.36 0 C-N-CA 123.008 0.523 . . . . 61.53 110.589 174.424 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 47' ' ' VAL . . . . . 0.6 HG22 ' HB3' ' A' ' 10' ' ' ARG . 87.3 t -68.69 -49.56 63.49 Favored 'Isoleucine or valine' 0 C--O 1.243 0.724 0 C-N-CA 124.201 1.001 . . . . 51.24 111.371 -179.517 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 48' ' ' MET . . . . . . . . . . . . . 78.6 mtm -62.12 -43.74 98.18 Favored 'General case' 0 N--CA 1.482 1.165 0 O-C-N 123.877 0.735 . . . . 72.4 111.399 -176.608 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 46.0 mt-10 -85.02 4.12 35.36 Favored 'General case' 0 N--CA 1.476 0.84 0 C-N-CA 123.721 0.808 . . . . 63.05 111.944 -174.779 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . 0.505 ' HB2' ' O ' ' A' ' 46' ' ' THR . 1.5 tppt? -103.62 135.82 44.49 Favored 'General case' 0 N--CA 1.476 0.834 0 N-CA-C 109.56 -0.533 . . . . 73.44 109.56 179.117 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 9.0 tt0 -69.42 148.61 49.35 Favored 'General case' 0 CA--C 1.547 0.831 0 C-N-CA 123.653 0.781 . . . . 75.04 111.856 -169.615 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 15.9 m -68.68 130.58 91.78 Favored Pre-proline 0 CA--C 1.554 1.104 0 C-N-CA 124.511 1.124 . . . . 65.54 110.461 176.548 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 53' ' ' PRO . . . . . 0.516 ' HG3' ' HA ' ' A' ' 4' ' ' THR . 94.7 Cg_endo -75.38 155.89 41.25 Favored 'Trans proline' 0 CA--C 1.557 1.662 0 C-N-CA 122.591 2.194 . . . . 75.31 112.289 178.0 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_endo -70.03 -46.86 0.97 Allowed 'Trans proline' 0 C--N 1.369 1.643 0 C-N-CA 122.764 2.31 . . . . 61.21 113.413 179.029 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . -79.92 70.74 2.85 Favored Glycine 0 C--N 1.348 1.227 0 N-CA-C 114.336 0.495 . . . . 75.44 114.336 -170.179 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 56' ' ' ILE . . . . . 0.715 HG21 HD11 ' A' ' 113' ' ' LEU . 8.3 mm -101.75 142.86 15.5 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.906 0 C-N-CA 124.012 0.925 . . . . 61.45 108.781 175.518 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 72.9 p -113.18 174.32 5.96 Favored 'General case' 0 N--CA 1.478 0.93 0 N-CA-C 109.005 -0.739 . . . . 74.41 109.005 170.134 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 16.0 tpt180 -59.13 -42.74 91.36 Favored 'General case' 0 N--CA 1.478 0.934 0 C-N-CA 123.128 0.571 . . . . 70.04 109.584 176.197 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 19.8 m -56.64 -50.61 71.54 Favored 'General case' 0 C--N 1.356 0.88 0 C-N-CA 123.972 0.909 . . . . 75.42 111.082 176.733 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 60' ' ' ILE . . . . . 0.494 HD13 HG21 ' A' ' 4' ' ' THR . 99.1 mt -60.28 -42.17 89.61 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.809 0 O-C-N 123.972 0.795 . . . . 75.23 110.985 179.483 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 54.7 tt0 -58.73 -47.34 84.93 Favored 'General case' 0 CA--C 1.542 0.656 0 C-N-CA 123.51 0.724 . . . . 72.31 110.785 -179.715 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 14.4 m-20 -72.77 -32.82 65.89 Favored 'General case' 0 N--CA 1.48 1.027 0 N-CA-C 112.827 0.677 . . . . 64.23 112.827 -178.077 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 63' ' ' MET . . . . . . . . . . . . . 58.7 mtm -74.48 -41.82 60.08 Favored 'General case' 0 N--CA 1.485 1.317 0 CA-C-N 117.568 0.167 . . . . 74.44 110.938 179.673 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 64' ' ' VAL . . . . . 0.496 ' O ' HG13 ' A' ' 68' ' ' ILE . 56.1 t -64.0 -54.14 35.21 Favored 'Isoleucine or valine' 0 C--N 1.352 0.71 0 C-N-CA 123.492 0.717 . . . . 72.32 109.616 176.253 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -62.04 -32.7 73.24 Favored 'General case' 0 N--CA 1.477 0.923 0 O-C-N 123.639 0.587 . . . . 75.31 111.129 178.306 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -63.26 -40.2 98.75 Favored Glycine 0 C--N 1.348 1.205 0 N-CA-C 111.689 -0.564 . . . . 53.32 111.689 174.627 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 16.8 m-30 -75.21 -32.3 61.13 Favored 'General case' 0 C--N 1.352 0.685 0 C-N-CA 123.573 0.749 . . . . 73.23 111.722 178.702 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 68' ' ' ILE . . . . . 0.512 ' O ' ' HG ' ' A' ' 72' ' ' LEU . 62.1 mt -63.17 -56.15 19.05 Favored 'Isoleucine or valine' 0 C--N 1.357 0.903 0 N-CA-C 107.979 -1.119 . . . . 70.32 107.979 175.345 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 51.7 tptt -53.11 -43.51 66.94 Favored 'General case' 0 N--CA 1.477 0.896 0 C-N-CA 124.622 1.169 . . . . 75.21 111.527 177.481 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 61.5 tt0 -59.9 -52.39 65.63 Favored 'General case' 0 N--CA 1.472 0.629 0 CA-C-N 115.731 -0.668 . . . . 70.23 111.249 179.982 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 71' ' ' THR . . . . . 0.568 ' HB ' ' HA ' ' A' ' 15' ' ' ALA . 11.4 t -74.95 -27.07 60.03 Favored 'General case' 0 C--N 1.35 0.619 0 O-C-N 123.285 0.366 . . . . 73.34 110.275 -173.703 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 72' ' ' LEU . . . . . 0.512 ' HG ' ' O ' ' A' ' 68' ' ' ILE . 19.4 mt -61.78 -55.41 30.39 Favored 'General case' 0 C--N 1.358 0.949 0 N-CA-C 108.872 -0.788 . . . . 75.15 108.872 175.19 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -67.83 -41.95 82.24 Favored 'General case' 0 N--CA 1.479 0.982 0 N-CA-C 113.937 1.088 . . . . 74.21 113.937 -175.916 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 94.7 m-20 -60.88 -55.41 33.32 Favored 'General case' 0 N--CA 1.493 1.714 0 CA-C-O 121.869 0.842 . . . . 74.21 110.121 177.299 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . 0.518 ' O ' ' HG2' ' A' ' 79' ' ' LYS . 62.5 tt0 -70.08 -19.9 63.24 Favored 'General case' 0 CA--C 1.549 0.936 0 CA-C-N 114.516 -1.22 . . . . 64.01 110.801 -178.876 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 76' ' ' GLN . . . . . 0.428 ' HB2' ' O ' ' A' ' 72' ' ' LEU . 10.0 tt0 -72.92 -41.12 64.89 Favored 'General case' 0 N--CA 1.489 1.512 0 C-N-CA 123.127 0.571 . . . . 64.03 109.879 176.602 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 93.3 mt -59.58 -41.4 90.15 Favored 'General case' 0 N--CA 1.474 0.77 0 O-C-N 123.938 0.774 . . . . 73.42 109.467 172.926 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . 0.707 HD21 ' HA ' ' A' ' 22' ' ' LEU . 70.1 mt -58.16 -51.25 70.49 Favored 'General case' 0 N--CA 1.478 0.947 0 CA-C-N 115.611 -0.722 . . . . 63.15 111.972 170.87 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 79' ' ' LYS . . . . . 0.518 ' HG2' ' O ' ' A' ' 75' ' ' GLU . 41.3 mmtm -57.1 -42.58 81.03 Favored 'General case' 0 N--CA 1.481 1.105 0 C-N-CA 123.495 0.718 . . . . 74.45 110.827 -176.662 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -67.26 -40.63 92.17 Favored Glycine 0 C--N 1.344 1.004 0 O-C-N 124.583 1.177 . . . . 42.31 113.001 179.259 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 3.1 tt -64.49 -48.3 75.69 Favored 'General case' 0 N--CA 1.475 0.805 0 C-N-CA 123.895 0.878 . . . . 74.55 109.375 179.301 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 85.7 mt . . . . . 0 CA--C 1.543 0.685 0 C-N-CA 124.391 1.076 . . . . 73.42 111.708 -171.885 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 85.1 mt . . . . . 0 N--CA 1.474 0.764 0 N-CA-C 108.364 -0.976 . . . . 73.3 108.364 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 49.8 mt -120.71 13.34 6.35 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.605 0 CA-C-O 122.003 0.906 . . . . 70.34 109.186 176.865 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 87.37 -11.91 64.33 Favored Glycine 0 N--CA 1.475 1.285 0 CA-C-N 116.042 -0.526 . . . . 64.42 113.967 -178.567 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 33.7 tt0 -132.77 174.1 10.67 Favored 'General case' 0 N--CA 1.477 0.894 0 N-CA-C 108.395 -0.965 . . . . 73.03 108.395 -178.398 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 45.6 m -62.6 81.74 0.02 OUTLIER 'General case' 0 N--CA 1.477 0.893 0 C-N-CA 123.936 0.894 . . . . 60.24 111.62 177.247 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 35.4 m -72.27 -43.33 64.43 Favored 'General case' 0 C--O 1.224 -0.289 0 CA-C-N 115.143 -0.935 . . . . 64.31 109.615 175.748 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 98' ' ' ARG . . . . . 0.495 ' NH1' ' HB3' ' A' ' 75' ' ' GLU . 6.9 ttp180 -59.92 -48.53 81.34 Favored 'General case' 0 CA--C 1.536 0.431 0 O-C-N 124.215 0.947 . . . . 52.54 112.705 -169.417 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 1.5 tm0? -62.96 -55.41 26.1 Favored 'General case' 0 N--CA 1.472 0.651 0 N-CA-C 109.595 -0.52 . . . . 61.14 109.595 -175.071 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 65.4 tttp -56.5 -54.2 48.59 Favored 'General case' 0 CA--C 1.543 0.7 0 O-C-N 123.963 0.789 . . . . 73.22 111.105 -179.868 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 46.8 t -67.53 -55.58 12.94 Favored 'General case' 0 CA--C 1.538 0.516 0 C-N-CA 123.686 0.794 . . . . 64.45 112.022 -171.775 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 8.0 mp -76.83 -30.54 56.4 Favored 'General case' 0 N--CA 1.485 1.282 0 N-CA-C 112.518 0.562 . . . . 63.14 112.518 -172.142 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 8.2 t30 -75.64 -41.87 53.03 Favored 'General case' 0 N--CA 1.485 1.316 0 CA-C-N 118.34 0.518 . . . . 63.51 110.257 177.46 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 104' ' ' ASN . . . . . 0.478 ' O ' ' HG2' ' A' ' 108' ' ' ARG . 28.0 t-20 -62.8 -44.28 96.57 Favored 'General case' 0 N--CA 1.481 1.084 0 N-CA-C 109.165 -0.68 . . . . 54.35 109.165 173.725 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -59.62 -38.27 80.88 Favored 'General case' 0 C--N 1.353 0.745 0 C-N-CA 123.843 0.857 . . . . 55.21 111.436 178.561 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 106' ' ' TYR . . . . . . . . . . . . . 4.3 t80 -61.0 -48.64 80.89 Favored 'General case' 0 CA--C 1.54 0.583 0 N-CA-C 108.738 -0.838 . . . . 75.31 108.738 175.104 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -61.93 -36.86 93.46 Favored Glycine 0 C--N 1.353 1.474 0 O-C-N 123.845 0.716 . . . . 64.14 112.786 -179.813 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 108' ' ' ARG . . . . . 0.478 ' HG2' ' O ' ' A' ' 104' ' ' ASN . 34.1 mmt180 -70.59 -40.38 73.28 Favored 'General case' 0 N--CA 1.473 0.679 0 C-N-CA 123.177 0.591 . . . . 61.21 110.035 -179.79 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 109' ' ' LEU . . . . . 0.413 ' HA ' ' N ' ' A' ' 114' ' ' LEU . 59.7 tp -66.75 -39.66 87.99 Favored 'General case' 0 N--CA 1.48 1.064 0 C-N-CA 123.741 0.816 . . . . 72.53 110.271 178.924 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 23.3 t -76.03 -27.76 57.44 Favored 'General case' 0 CA--C 1.543 0.696 0 CA-C-N 114.888 -1.051 . . . . 63.42 110.397 -179.802 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . -90.03 -67.04 1.21 Allowed Glycine 0 C--N 1.361 1.941 0 CA-C-O 119.194 -0.781 . . . . 61.14 113.698 -177.665 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 112' ' ' MET . . . . . . . . . . . . . 3.1 tmm? -97.15 -66.14 0.92 Allowed 'General case' 0 N--CA 1.481 1.088 0 CA-C-N 118.369 1.085 . . . . 75.21 110.605 179.289 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 113' ' ' LEU . . . . . 0.715 HD11 HG21 ' A' ' 56' ' ' ILE . 19.7 tp 160.21 54.35 0.0 OUTLIER 'General case' 0 N--CA 1.489 1.498 0 C-N-CA 126.378 1.871 . . . . 74.24 108.501 -178.501 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 114' ' ' LEU . . . . . 0.413 ' N ' ' HA ' ' A' ' 109' ' ' LEU . 22.3 tp . . . . . 0 CA--C 1.543 0.702 0 C-N-CA 125.764 1.626 . . . . 72.53 111.911 176.271 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 25.3 ttt . . . . . 0 CA--C 1.553 1.078 0 CA-C-O 119.495 -0.288 . . . . 61.41 110.856 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 37.1 p -56.03 -49.08 74.68 Favored 'General case' 0 N--CA 1.487 1.405 0 N-CA-C 112.704 0.631 . . . . 72.14 112.704 -172.142 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 55.2 m -68.41 -26.67 65.65 Favored 'General case' 0 N--CA 1.483 1.183 0 C-N-CA 122.459 0.304 . . . . 73.42 111.774 -178.597 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 4' ' ' THR . . . . . 0.515 HG21 HD13 ' A' ' 60' ' ' ILE . 28.2 m -75.02 -41.3 59.56 Favored 'General case' 0 C--N 1.349 0.566 0 C-N-CA 123.191 0.596 . . . . 73.42 110.755 177.37 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 87.9 t -68.32 -36.36 74.7 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.817 0 C-N-CA 123.381 0.673 . . . . 65.11 109.438 177.361 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 42.2 mm-40 -62.37 -46.62 87.82 Favored 'General case' 0 N--CA 1.478 0.931 0 C-N-CA 123.761 0.824 . . . . 74.34 110.566 173.252 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 31.0 t80 -64.93 -47.91 76.0 Favored 'General case' 0 N--CA 1.475 0.821 0 O-C-N 123.989 0.805 . . . . 74.32 110.603 -175.878 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 8' ' ' ILE . . . . . 0.499 HD11 HG23 ' A' ' 60' ' ' ILE . 77.4 mt -65.75 -36.96 78.81 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.856 0 C-N-CA 123.607 0.763 . . . . 70.43 110.439 178.577 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 26.0 t-20 -73.29 -27.8 61.75 Favored 'General case' 0 N--CA 1.489 1.489 0 C-N-CA 123.201 0.6 . . . . 73.25 111.195 -179.681 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . 0.587 ' HB3' HG22 ' A' ' 47' ' ' VAL . 62.7 mtt85 -72.11 -37.43 69.51 Favored 'General case' 0 CA--C 1.54 0.595 0 C-N-CA 123.054 0.542 . . . . 71.44 109.754 173.038 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 11' ' ' TRP . . . . . . . . . . . . . 86.5 m95 -76.14 -20.92 57.17 Favored 'General case' 0 N--CA 1.475 0.824 0 CA-C-N 116.043 -0.526 . . . . 70.13 111.549 172.012 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 53.5 mt-30 -68.15 -46.38 70.93 Favored 'General case' 0 C--N 1.359 0.982 0 N-CA-C 107.553 -1.276 . . . . 65.12 107.553 168.839 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . 0.668 ' HE ' HD11 ' A' ' 17' ' ' LEU . 16.2 tpt180 -59.02 -46.66 87.64 Favored 'General case' 0 CA--C 1.548 0.868 0 O-C-N 123.8 0.688 . . . . 74.41 110.927 -177.622 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 14' ' ' ILE . . . . . 0.441 HD13 HG13 ' A' ' 44' ' ' ILE . 56.8 mt -66.21 -52.81 43.5 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.095 0 O-C-N 123.201 0.313 . . . . 72.44 110.607 177.8 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . 0.569 ' HA ' ' HB ' ' A' ' 71' ' ' THR . . . -56.56 -45.15 81.43 Favored 'General case' 0 N--CA 1.488 1.436 0 C-N-CA 123.828 0.851 . . . . 34.12 111.794 -177.032 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 97.0 mt -78.58 -40.6 34.23 Favored 'General case' 0 N--CA 1.481 1.119 0 CA-C-N 114.923 -1.035 . . . . 72.45 111.39 -171.904 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.668 HD11 ' HE ' ' A' ' 13' ' ' ARG . 30.3 mt -64.0 -51.3 64.89 Favored 'General case' 0 C--N 1.36 1.05 0 CA-C-O 119.166 -0.445 . . . . 74.1 110.478 177.536 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 80.5 p -62.31 -36.47 82.25 Favored 'General case' 0 N--CA 1.478 0.945 0 O-C-N 123.789 0.681 . . . . 75.04 111.123 -179.94 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 19' ' ' GLN . . . . . 0.502 HE21 ' NE2' ' A' ' 70' ' ' GLN . 6.7 tp-100 -62.19 -44.39 96.68 Favored 'General case' 0 C--N 1.358 0.976 0 C-N-CA 123.288 0.635 . . . . 72.42 110.305 175.105 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 63.4 m -62.04 -43.84 97.97 Favored 'General case' 0 C--O 1.214 -0.782 0 O-C-N 123.918 0.761 . . . . 63.43 109.663 176.975 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . 0.714 HD22 ' HA ' ' A' ' 33' ' ' LEU . 52.4 mt -64.15 -31.92 73.3 Favored 'General case' 0 C--N 1.351 0.638 0 C-N-CA 123.268 0.627 . . . . 75.24 110.54 -178.009 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.721 ' HA ' HD21 ' A' ' 78' ' ' LEU . 50.7 tp -66.85 -54.64 20.38 Favored 'General case' 0 N--CA 1.48 1.039 0 C-N-CA 123.096 0.558 . . . . 55.11 110.082 176.173 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . 0.412 ' HB3' ' NH1' ' A' ' 27' ' ' ARG . 11.6 mm-40 -52.69 -52.48 55.81 Favored 'General case' 0 CA--C 1.547 0.858 0 C-N-CA 124.593 1.157 . . . . 74.15 111.414 177.935 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . 0.448 HD22 HD12 ' A' ' 32' ' ' LEU . 77.8 mt -63.45 -43.78 96.39 Favored 'General case' 0 CA--C 1.538 0.516 0 CA-C-N 114.485 -1.234 . . . . 65.34 110.941 -176.752 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . 0.516 ' HB2' HD21 ' A' ' 33' ' ' LEU . . . -58.28 -48.35 80.75 Favored 'General case' 0 N--CA 1.483 1.214 0 C-N-CA 123.264 0.625 . . . . 62.33 110.884 -179.838 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 96.3 mt-30 -63.77 -37.46 87.46 Favored 'General case' 0 CA--C 1.545 0.777 0 CA-C-N 114.815 -1.084 . . . . 74.3 110.904 179.716 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 27' ' ' ARG . . . . . 0.412 ' NH1' ' HB3' ' A' ' 23' ' ' GLU . 78.2 mtt180 -87.97 3.78 47.41 Favored 'General case' 0 N--CA 1.482 1.152 0 C-N-CA 123.793 0.837 . . . . 74.2 112.793 -178.222 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 83.97 12.12 77.57 Favored Glycine 0 C--N 1.351 1.405 0 N-CA-C 115.06 0.784 . . . . 75.42 115.06 171.876 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 29' ' ' GLU . . . . . 0.433 ' HB2' ' HB3' ' A' ' 24' ' ' LEU . 14.3 mm-40 -91.02 50.71 1.82 Allowed 'General case' 0 CA--C 1.55 0.977 0 C-N-CA 124.649 1.18 . . . . 70.44 110.464 176.053 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 30' ' ' TRP . . . . . 0.602 ' HA ' HD13 ' A' ' 33' ' ' LEU . 75.3 m95 -64.55 -26.67 68.52 Favored 'General case' 0 N--CA 1.485 1.295 0 C-N-CA 123.204 0.601 . . . . 75.13 111.005 -178.257 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 8.8 m-20 -57.03 -42.81 81.13 Favored 'General case' 0 N--CA 1.478 0.927 0 C-N-CA 123.274 0.63 . . . . 63.22 110.393 172.98 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 0.448 HD12 HD22 ' A' ' 24' ' ' LEU . 76.1 mt -72.08 -18.93 61.89 Favored 'General case' 0 CA--C 1.547 0.839 0 CA-C-N 116.237 -0.438 . . . . 72.42 111.354 -178.882 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . 0.714 ' HA ' HD22 ' A' ' 21' ' ' LEU . 10.2 mp -69.37 -46.95 65.73 Favored 'General case' 0 N--CA 1.485 1.307 0 N-CA-C 109.254 -0.647 . . . . 65.53 109.254 167.317 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 59.8 mt -61.41 -38.68 87.97 Favored 'General case' 0 N--CA 1.483 1.212 0 O-C-N 123.99 0.807 . . . . 74.21 111.306 179.291 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -69.05 -45.27 70.83 Favored 'General case' 0 N--CA 1.481 1.116 0 C-N-CA 123.955 0.902 . . . . 75.32 111.34 -179.996 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 36' ' ' GLN . . . . . 0.485 ' HB2' HD21 ' A' ' 21' ' ' LEU . 87.1 mm-40 -81.42 -15.35 55.4 Favored 'General case' 0 N--CA 1.487 1.423 0 C-N-CA 122.791 0.436 . . . . 63.14 111.634 -178.282 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . 0.416 ' O ' ' HG ' ' A' ' 41' ' ' LEU . 24.1 tt0 -45.81 -65.97 0.47 Allowed 'General case' 0 N--CA 1.48 1.048 0 C-N-CA 124.849 1.259 . . . . 72.25 113.282 -176.559 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 48.9 t -61.62 -35.44 67.22 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.087 0 C-N-CA 123.682 0.793 . . . . 54.13 111.104 -170.472 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 49.1 m -65.57 -49.29 69.38 Favored 'General case' 0 CA--C 1.54 0.563 0 C-N-CA 123.788 0.835 . . . . 74.23 110.729 176.573 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 38.0 t80 -60.99 -40.51 93.74 Favored 'General case' 0 N--CA 1.48 1.032 0 C-N-CA 124.203 1.001 . . . . 74.14 110.982 -178.862 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . 0.672 ' HB3' HD21 ' A' ' 92' ' ' LEU . 69.7 mt -70.14 -48.31 57.96 Favored 'General case' 0 C--O 1.252 1.185 0 O-C-N 124.613 1.195 . . . . 75.4 111.761 -175.292 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 46.6 tt0 -63.27 -39.48 94.7 Favored 'General case' 0 CA--C 1.551 1.015 0 CA-C-N 115.592 -0.731 . . . . 72.45 109.831 177.644 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 43' ' ' SER . . . . . 0.561 ' O ' HG23 ' A' ' 47' ' ' VAL . 67.2 m -61.96 -56.39 19.61 Favored 'General case' 0 C--N 1.356 0.862 0 C-N-CA 123.28 0.632 . . . . 51.54 111.022 178.27 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 44' ' ' ILE . . . . . 0.441 HG13 HD13 ' A' ' 14' ' ' ILE . 11.5 tt -58.04 -42.16 82.18 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.36 0 C-N-CA 123.729 0.812 . . . . 52.04 110.977 -173.756 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 72.1 mm-40 -60.81 -48.45 81.75 Favored 'General case' 0 C--N 1.362 1.151 0 O-C-N 123.492 0.495 . . . . 54.33 111.272 175.174 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 66.9 m -57.06 -39.12 74.29 Favored 'General case' 0 N--CA 1.489 1.515 0 C-N-CA 122.991 0.516 . . . . 75.34 111.895 178.971 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 47' ' ' VAL . . . . . 0.587 HG22 ' HB3' ' A' ' 10' ' ' ARG . 43.3 t -65.98 -44.75 92.16 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.173 0 C-N-CA 123.302 0.641 . . . . 45.54 110.377 -178.479 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 48' ' ' MET . . . . . 0.562 ' SD ' ' HB2' ' A' ' 101' ' ' SER . 75.2 mtm -69.75 -27.23 64.77 Favored 'General case' 0 N--CA 1.485 1.276 0 CA-C-N 116.093 -0.503 . . . . 70.1 111.8 179.221 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 38.5 mt-10 -71.22 -24.47 62.21 Favored 'General case' 0 N--CA 1.481 1.107 0 C-N-CA 123.037 0.535 . . . . 74.2 111.319 173.868 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -87.04 142.5 27.89 Favored 'General case' 0 N--CA 1.478 0.974 0 C-N-CA 123.203 0.601 . . . . 73.43 110.28 -178.944 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 8.8 tt0 -85.56 158.52 20.11 Favored 'General case' 0 N--CA 1.474 0.755 0 C-N-CA 123.761 0.824 . . . . 72.12 110.017 -178.921 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 52' ' ' THR . . . . . 0.451 ' OG1' ' HB3' ' A' ' 114' ' ' LEU . 22.0 m -78.36 129.87 73.52 Favored Pre-proline 0 CA--C 1.546 0.823 0 C-N-CA 123.119 0.567 . . . . 72.13 110.263 175.514 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 53' ' ' PRO . . . . . 0.51 ' HG3' ' HA ' ' A' ' 4' ' ' THR . 56.8 Cg_endo -67.01 157.88 59.56 Favored 'Trans proline' 0 C--N 1.376 2.022 0 C-N-CA 123.2 2.6 . . . . 54.31 112.652 177.754 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 38.8 Cg_endo -65.49 -45.54 6.83 Favored 'Trans proline' 0 C--N 1.375 1.948 0 C-N-CA 122.843 2.362 . . . . 72.2 112.75 176.397 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . -69.2 78.8 0.3 Allowed Glycine 0 C--N 1.359 1.843 0 O-C-N 123.765 0.666 . . . . 63.51 114.054 -175.488 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 23.8 mm -117.91 136.39 55.26 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.575 0 C-N-CA 124.752 1.221 . . . . 71.44 108.337 178.444 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 72.2 p -106.66 179.12 4.36 Favored 'General case' 0 N--CA 1.473 0.717 0 N-CA-C 108.537 -0.912 . . . . 50.21 108.537 168.121 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 29.8 tpt180 -65.96 -43.36 88.16 Favored 'General case' 0 CA--C 1.54 0.588 0 N-CA-C 109.819 -0.437 . . . . 72.24 109.819 174.549 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 71.4 p -62.64 -42.45 99.61 Favored 'General case' 0 CA--C 1.545 0.762 0 C-N-CA 123.5 0.72 . . . . 71.4 110.934 -179.544 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 60' ' ' ILE . . . . . 0.515 HD13 HG21 ' A' ' 4' ' ' THR . 93.9 mt -59.81 -45.65 94.56 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.019 0 C-N-CA 123.806 0.842 . . . . 61.1 110.513 173.762 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 64.5 tt0 -59.91 -37.39 79.28 Favored 'General case' 0 N--CA 1.478 0.932 0 C-N-CA 123.875 0.87 . . . . 74.24 111.104 179.657 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 70.5 m-20 -71.21 -39.44 71.74 Favored 'General case' 0 N--CA 1.481 1.112 0 C-N-CA 123.383 0.673 . . . . 61.11 111.02 179.085 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 63' ' ' MET . . . . . . . . . . . . . 71.0 mtm -71.31 -41.58 69.72 Favored 'General case' 0 N--CA 1.481 1.099 0 C-N-CA 122.923 0.489 . . . . 54.44 111.649 -178.997 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 64' ' ' VAL . . . . . 0.456 ' O ' HG13 ' A' ' 68' ' ' ILE . 85.8 t -67.9 -55.69 15.8 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.755 0 N-CA-C 109.531 -0.544 . . . . 54.01 109.531 179.497 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . 0.594 ' HB2' HD23 ' A' ' 109' ' ' LEU . . . -63.07 -28.38 70.04 Favored 'General case' 0 N--CA 1.488 1.472 0 O-C-N 123.351 0.407 . . . . 54.01 110.849 178.594 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -67.02 -40.79 93.32 Favored Glycine 0 C--N 1.35 1.345 0 O-C-N 123.562 0.539 . . . . 53.22 112.519 175.531 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 16.6 m-30 -72.54 -38.82 67.91 Favored 'General case' 0 N--CA 1.48 1.074 0 C-N-CA 123.328 0.651 . . . . 65.53 110.988 178.189 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 68' ' ' ILE . . . . . 0.558 ' O ' ' HG ' ' A' ' 72' ' ' LEU . 78.3 mt -57.96 -50.43 77.93 Favored 'Isoleucine or valine' 0 C--N 1.353 0.736 0 O-C-N 124.575 1.172 . . . . 41.31 108.361 173.783 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 69' ' ' LYS . . . . . 0.597 ' HB2' ' HE2' ' A' ' 106' ' ' TYR . 0.7 OUTLIER -57.83 -49.07 77.92 Favored 'General case' 0 C--N 1.353 0.757 0 C-N-CA 123.886 0.874 . . . . 73.14 110.673 -178.847 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 70' ' ' GLN . . . . . 0.502 ' NE2' HE21 ' A' ' 19' ' ' GLN . 58.9 tt0 -58.25 -44.88 88.53 Favored 'General case' 0 N--CA 1.471 0.593 0 O-C-N 124.705 1.253 . . . . 75.51 110.784 -176.984 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 71' ' ' THR . . . . . 0.569 ' HB ' ' HA ' ' A' ' 15' ' ' ALA . 12.8 t -76.93 -22.43 53.31 Favored 'General case' 0 C--O 1.21 -0.999 0 CA-C-O 118.846 -0.597 . . . . 73.31 110.344 -177.965 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 72' ' ' LEU . . . . . 0.731 HD21 ' HB3' ' A' ' 102' ' ' LEU . 40.5 mt -72.23 -32.98 67.21 Favored 'General case' 0 N--CA 1.49 1.57 0 CA-C-N 118.136 0.426 . . . . 75.5 110.789 173.5 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 38.8 m-20 -64.13 -49.87 70.47 Favored 'General case' 0 N--CA 1.477 0.91 0 N-CA-C 108.542 -0.91 . . . . 61.31 108.542 172.071 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 70.5 m-20 -62.28 -37.08 84.12 Favored 'General case' 0 N--CA 1.478 0.964 0 CA-C-N 115.037 -0.983 . . . . 71.3 111.566 179.96 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . 0.435 ' HG2' ' O ' ' A' ' 71' ' ' THR . 17.2 mm-40 -66.47 -51.62 54.89 Favored 'General case' 0 N--CA 1.481 1.094 0 C-N-CA 123.316 0.646 . . . . 54.35 110.275 178.667 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 9.1 tt0 -58.09 -48.85 78.9 Favored 'General case' 0 N--CA 1.475 0.818 0 O-C-N 123.492 0.495 . . . . 75.3 110.807 -177.778 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 96.8 mt -63.63 -57.13 11.03 Favored 'General case' 0 N--CA 1.471 0.625 0 O-C-N 123.975 0.797 . . . . 73.52 111.043 -176.959 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . 0.721 HD21 ' HA ' ' A' ' 22' ' ' LEU . 82.4 mt -63.54 -66.47 0.54 Allowed 'General case' 0 N--CA 1.481 1.107 0 O-C-N 123.553 0.533 . . . . 73.41 111.785 -178.514 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 33.0 mmtp -59.54 -35.15 73.66 Favored 'General case' 0 N--CA 1.475 0.793 0 O-C-N 124.219 0.95 . . . . 71.22 110.928 -173.808 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -66.69 -40.26 93.91 Favored Glycine 0 C--N 1.355 1.606 0 O-C-N 123.526 0.516 . . . . 71.41 113.019 175.069 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 8.2 tt -66.21 -36.96 84.42 Favored 'General case' 0 N--CA 1.485 1.322 0 C-N-CA 123.465 0.706 . . . . 75.24 109.737 177.092 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 95.1 mt . . . . . 0 N--CA 1.473 0.71 0 C-N-CA 123.955 0.902 . . . . 73.31 111.328 -175.516 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 92' ' ' LEU . . . . . 0.672 HD21 ' HB3' ' A' ' 41' ' ' LEU . 94.7 mt . . . . . 0 CA--C 1.537 0.463 0 CA-C-O 120.6 0.238 . . . . 63.44 110.607 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 42.6 mt -124.46 65.87 0.3 Allowed 'Isoleucine or valine' 0 CA--C 1.546 0.811 0 N-CA-C 107.537 -1.282 . . . . 71.24 107.537 172.621 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 48.39 -87.53 0.01 OUTLIER Glycine 0 C--N 1.363 2.081 0 CA-C-N 114.219 -1.355 . . . . 65.24 115.157 172.322 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 5.8 pm0 -66.49 -173.52 0.22 Allowed 'General case' 0 N--CA 1.477 0.878 0 C-N-CA 124.564 1.145 . . . . 74.1 111.461 178.628 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 44.5 m -80.42 38.57 0.43 Allowed 'General case' 0 CA--C 1.545 0.78 0 N-CA-C 113.289 0.848 . . . . 60.31 113.289 -173.037 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 39.1 m -49.48 -61.12 2.28 Favored 'General case' 0 N--CA 1.48 1.026 0 C-N-CA 124.014 0.926 . . . . 64.42 110.828 173.028 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 98' ' ' ARG . . . . . 0.642 ' HD2' ' HB2' ' A' ' 92' ' ' LEU . 0.0 OUTLIER -47.62 -56.07 7.99 Favored 'General case' 0 CA--C 1.552 1.036 0 C-N-CA 125.955 1.702 . . . . 74.42 113.533 178.306 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 31.0 mm-40 -66.28 -43.65 85.78 Favored 'General case' 0 N--CA 1.482 1.157 0 C-N-CA 122.968 0.507 . . . . 74.52 111.068 -175.375 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 13.8 tmtt? -63.36 -38.13 89.97 Favored 'General case' 0 C--O 1.217 -0.629 0 CA-C-N 114.897 -1.047 . . . . 74.02 110.638 178.579 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 101' ' ' SER . . . . . 0.562 ' HB2' ' SD ' ' A' ' 48' ' ' MET . 73.1 m -78.33 -32.15 49.06 Favored 'General case' 0 N--CA 1.479 0.981 0 C-N-CA 123.08 0.552 . . . . 74.11 112.076 -172.9 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 102' ' ' LEU . . . . . 0.731 ' HB3' HD21 ' A' ' 72' ' ' LEU . 10.0 mp -71.29 -43.3 67.41 Favored 'General case' 0 N--CA 1.483 1.184 0 N-CA-C 110.074 -0.343 . . . . 62.11 110.074 172.561 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 8.9 t30 -64.08 -41.01 97.47 Favored 'General case' 0 N--CA 1.481 1.079 0 CA-C-O 121.159 0.504 . . . . 75.23 110.507 176.625 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 7.2 t30 -64.05 -39.3 93.77 Favored 'General case' 0 N--CA 1.478 0.958 0 C-N-CA 124.397 1.079 . . . . 75.22 109.469 176.54 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -59.41 -48.39 81.82 Favored 'General case' 0 C--N 1.347 0.467 0 O-C-N 124.049 0.843 . . . . 74.32 110.444 178.598 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 106' ' ' TYR . . . . . 0.597 ' HE2' ' HB2' ' A' ' 69' ' ' LYS . 20.0 t80 -59.47 -56.32 23.44 Favored 'General case' 0 CA--C 1.55 0.957 0 O-C-N 123.867 0.73 . . . . 73.1 111.074 179.8 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -69.0 -41.01 83.62 Favored Glycine 0 C--N 1.347 1.194 0 O-C-N 123.989 0.805 . . . . 70.34 113.302 -171.272 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 5.5 mmp_? -68.91 -33.91 74.53 Favored 'General case' 0 C--N 1.349 0.578 0 CA-C-O 119.258 -0.401 . . . . 65.2 110.455 177.42 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 109' ' ' LEU . . . . . 0.594 HD23 ' HB2' ' A' ' 65' ' ' ALA . 47.3 tp -61.56 -44.8 96.37 Favored 'General case' 0 N--CA 1.482 1.162 0 CA-C-O 120.888 0.375 . . . . 61.0 110.301 175.388 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 10.9 t -69.58 -34.28 73.91 Favored 'General case' 0 CA--C 1.554 1.127 0 CA-C-N 114.749 -1.114 . . . . 51.2 110.938 -179.043 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . -91.2 -63.27 1.19 Allowed Glycine 0 C--N 1.357 1.735 0 N-CA-C 114.454 0.542 . . . . 63.24 114.454 -177.649 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 112' ' ' MET . . . . . . . . . . . . . 3.8 mmm -93.13 -68.92 0.77 Allowed 'General case' 0 N--CA 1.489 1.481 0 CA-C-N 117.454 0.627 . . . . 72.31 112.021 -178.578 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 23.8 tp 174.01 13.41 0.0 OUTLIER 'General case' 0 N--CA 1.492 1.635 0 C-N-CA 125.172 1.389 . . . . 61.32 110.018 178.28 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 114' ' ' LEU . . . . . 0.451 ' HB3' ' OG1' ' A' ' 52' ' ' THR . 2.5 tt . . . . . 0 N--CA 1.5 2.063 0 C-N-CA 126.683 1.993 . . . . 52.15 109.842 -170.321 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 1' ' ' MET . . . . . 0.45 ' HG3' HG23 ' A' ' 5' ' ' VAL . 16.7 ptt? . . . . . 0 N--CA 1.486 1.329 0 CA-C-O 120.683 0.278 . . . . 72.1 110.65 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 9.2 t -54.6 -40.32 68.74 Favored 'General case' 0 N--CA 1.483 1.216 0 C-N-CA 123.353 0.661 . . . . 74.22 112.725 -172.766 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 17.2 m -72.46 -32.42 66.23 Favored 'General case' 0 N--CA 1.479 1.019 0 C-N-CA 123.247 0.619 . . . . 73.03 111.4 -178.758 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 52.5 m -74.57 -39.11 62.45 Favored 'General case' 0 C--O 1.217 -0.64 0 C-N-CA 123.07 0.548 . . . . 53.41 110.295 178.233 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 5' ' ' VAL . . . . . 0.45 HG23 ' HG3' ' A' ' 1' ' ' MET . 90.2 t -63.77 -40.48 89.2 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.905 0 C-N-CA 123.309 0.644 . . . . 64.04 109.297 176.581 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 33.9 mm-40 -57.1 -51.98 67.11 Favored 'General case' 0 N--CA 1.473 0.685 0 O-C-N 123.939 0.774 . . . . 63.34 110.625 171.228 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 42.6 t80 -61.88 -43.86 97.99 Favored 'General case' 0 CA--C 1.552 1.027 0 C-N-CA 124.106 0.962 . . . . 74.22 111.337 -173.464 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 8' ' ' ILE . . . . . 0.445 HD11 HG23 ' A' ' 60' ' ' ILE . 77.5 mt -63.84 -45.19 97.76 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.873 0 C-N-CA 123.772 0.829 . . . . 64.01 109.357 176.473 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 28.5 t-20 -67.09 -27.41 67.33 Favored 'General case' 0 N--CA 1.479 0.991 0 C-N-CA 123.834 0.854 . . . . 75.35 111.54 -177.25 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . 0.536 ' HB3' HG22 ' A' ' 47' ' ' VAL . 50.8 mtt180 -81.46 -28.02 34.34 Favored 'General case' 0 CA--C 1.543 0.684 0 C-N-CA 123.394 0.678 . . . . 74.24 110.191 176.477 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 11' ' ' TRP . . . . . . . . . . . . . 61.2 m95 -74.53 -28.21 60.87 Favored 'General case' 0 N--CA 1.474 0.774 0 CA-C-O 119.313 -0.375 . . . . 73.25 110.828 167.663 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . 0.49 ' HG2' ' CE2' ' A' ' 67' ' ' TYR . 41.1 mt-30 -67.52 -38.79 84.76 Favored 'General case' 0 C--N 1.358 0.956 0 N-CA-C 108.064 -1.087 . . . . 62.31 108.064 170.165 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 32.2 tpt180 -57.1 -55.54 33.38 Favored 'General case' 0 CA--C 1.542 0.643 0 CA-C-N 115.328 -0.851 . . . . 73.43 109.984 179.753 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 14' ' ' ILE . . . . . 0.431 HG22 ' OG1' ' A' ' 71' ' ' THR . 19.1 mt -64.81 -45.97 93.41 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.357 0 O-C-N 122.938 0.148 . . . . 73.25 111.001 179.806 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . 0.601 ' HA ' ' HB ' ' A' ' 71' ' ' THR . . . -58.05 -48.52 79.84 Favored 'General case' 0 N--CA 1.487 1.399 0 C-N-CA 124.406 1.082 . . . . 64.31 112.154 -176.426 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 87.0 mt -78.64 -37.44 42.09 Favored 'General case' 0 N--CA 1.48 1.051 0 CA-C-N 114.902 -1.045 . . . . 73.53 110.903 -173.085 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.508 ' O ' ' HG ' ' A' ' 21' ' ' LEU . 59.0 mt -62.46 -48.1 81.12 Favored 'General case' 0 N--CA 1.479 0.976 0 O-C-N 123.344 0.403 . . . . 70.34 110.461 176.816 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 78.5 p -64.63 -38.34 90.68 Favored 'General case' 0 N--CA 1.475 0.808 0 C-N-CA 123.01 0.524 . . . . 62.55 111.125 -179.804 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 7.0 tp-100 -60.83 -42.33 97.52 Favored 'General case' 0 C--N 1.354 0.782 0 O-C-N 123.704 0.628 . . . . 64.14 110.625 175.207 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 48.6 m -60.89 -48.77 80.31 Favored 'General case' 0 C--N 1.346 0.441 0 O-C-N 123.391 0.432 . . . . 65.33 110.071 175.611 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . 0.549 HD22 ' HA ' ' A' ' 33' ' ' LEU . 59.2 mt -64.8 -26.91 68.55 Favored 'General case' 0 N--CA 1.471 0.624 0 C-N-CA 123.62 0.768 . . . . 71.41 110.836 -178.114 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.636 ' HA ' HD21 ' A' ' 78' ' ' LEU . 46.0 tp -68.07 -58.35 4.64 Favored 'General case' 0 C--N 1.35 0.599 0 C-N-CA 123.376 0.67 . . . . 71.43 109.564 176.767 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 41.0 mt-10 -53.91 -46.03 71.34 Favored 'General case' 0 N--CA 1.48 1.031 0 C-N-CA 124.147 0.979 . . . . 75.24 111.073 -179.955 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . 0.5 ' HB3' ' HB2' ' A' ' 29' ' ' GLU . 96.0 mt -67.08 -46.89 72.9 Favored 'General case' 0 CA--C 1.538 0.511 0 CA-C-N 114.661 -1.154 . . . . 43.53 111.455 -176.623 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . 0.435 ' HB2' HD21 ' A' ' 33' ' ' LEU . . . -64.16 -34.25 77.65 Favored 'General case' 0 N--CA 1.484 1.25 0 CA-C-N 117.971 0.351 . . . . 63.11 111.501 -179.555 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 98.0 mt-30 -63.65 -38.43 91.09 Favored 'General case' 0 N--CA 1.482 1.143 0 C-N-CA 123.333 0.653 . . . . 64.5 110.61 173.681 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 97.2 mtt180 -75.78 -17.39 59.89 Favored 'General case' 0 N--CA 1.483 1.197 0 C-N-CA 123.161 0.584 . . . . 70.21 111.868 174.775 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 92.3 20.79 34.31 Favored Glycine 0 C--N 1.346 1.127 0 N-CA-C 112.727 -0.149 . . . . 10.3 112.727 179.078 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 29' ' ' GLU . . . . . 0.5 ' HB2' ' HB3' ' A' ' 24' ' ' LEU . 49.3 mm-40 -84.54 68.77 10.44 Favored 'General case' 0 C--O 1.238 0.452 0 C-N-CA 124.312 1.045 . . . . 74.42 110.871 -179.775 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 30' ' ' TRP . . . . . . . . . . . . . 24.8 m95 -63.68 -42.18 98.07 Favored 'General case' 0 N--CA 1.475 0.788 0 CA-C-N 115.114 -0.948 . . . . 74.21 111.097 -176.134 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 9.8 m-20 -60.62 -41.68 95.33 Favored 'General case' 0 N--CA 1.478 0.971 0 C-N-CA 123.48 0.712 . . . . 74.22 110.893 -178.813 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 0.503 HD23 ' NE2' ' A' ' 35' ' ' GLN . 72.6 mt -64.47 -37.03 86.11 Favored 'General case' 0 N--CA 1.478 0.941 0 O-C-N 123.61 0.569 . . . . 62.34 111.211 -178.907 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . 0.549 ' HA ' HD22 ' A' ' 21' ' ' LEU . 10.7 mp -61.74 -46.92 87.54 Favored 'General case' 0 N--CA 1.486 1.325 0 CA-C-O 120.719 0.295 . . . . 74.12 110.24 172.365 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 91.2 mt -67.66 -26.97 66.47 Favored 'General case' 0 CA--C 1.549 0.915 0 C-N-CA 123.482 0.713 . . . . 64.4 112.18 -177.227 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 35' ' ' GLN . . . . . 0.503 ' NE2' HD23 ' A' ' 32' ' ' LEU . 48.5 mt-30 -77.96 -36.78 48.72 Favored 'General case' 0 N--CA 1.48 1.035 0 C-N-CA 123.304 0.642 . . . . 74.13 110.619 176.705 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 30.9 mm-40 -82.79 -15.24 52.47 Favored 'General case' 0 N--CA 1.483 1.188 0 C-N-CA 123.09 0.556 . . . . 70.21 111.532 177.931 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . 0.428 ' O ' ' HG ' ' A' ' 41' ' ' LEU . 31.8 tt0 -45.49 -57.47 4.1 Favored 'General case' 0 N--CA 1.481 1.086 0 C-N-CA 124.681 1.192 . . . . 73.51 112.972 -174.823 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 46.1 t -58.04 -39.88 74.31 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.143 0 C-N-CA 123.344 0.658 . . . . 74.55 111.378 -175.514 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 74.3 m -68.38 -43.7 76.78 Favored 'General case' 0 N--CA 1.474 0.739 0 C-N-CA 123.097 0.559 . . . . 72.13 111.272 179.189 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 40' ' ' TYR . . . . . 0.408 ' O ' HG22 ' A' ' 44' ' ' ILE . 34.9 t80 -64.96 -47.51 77.36 Favored 'General case' 0 N--CA 1.471 0.61 0 O-C-N 123.824 0.703 . . . . 71.1 110.059 -177.128 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . 0.428 ' HG ' ' O ' ' A' ' 37' ' ' GLU . 57.8 mt -59.81 -50.53 73.46 Favored 'General case' 0 C--N 1.351 0.667 0 O-C-N 124.636 1.21 . . . . 73.24 110.082 178.952 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 53.4 tt0 -60.22 -41.72 93.69 Favored 'General case' 0 N--CA 1.476 0.87 0 O-C-N 123.637 0.585 . . . . 72.34 111.497 -178.442 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 43' ' ' SER . . . . . 0.487 ' O ' HG23 ' A' ' 47' ' ' VAL . 70.2 m -60.85 -60.38 3.88 Favored 'General case' 0 N--CA 1.471 0.591 0 C-N-CA 123.169 0.588 . . . . 75.31 110.641 -179.102 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 44' ' ' ILE . . . . . 0.458 HG12 ' HE2' ' A' ' 48' ' ' MET . 16.3 tt -63.37 -30.33 49.5 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.977 0 O-C-N 123.808 0.692 . . . . 72.42 111.321 -175.57 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 9.6 mm-40 -59.38 -55.12 38.7 Favored 'General case' 0 N--CA 1.481 1.103 0 C-N-CA 123.301 0.64 . . . . 65.41 110.796 171.226 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 46' ' ' THR . . . . . 0.411 ' O ' ' HB2' ' A' ' 50' ' ' LYS . 19.9 m -67.18 -23.8 65.8 Favored 'General case' 0 CA--C 1.55 0.967 0 CA-C-N 115.656 -0.702 . . . . 71.11 111.652 -174.369 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 47' ' ' VAL . . . . . 0.536 HG22 ' HB3' ' A' ' 10' ' ' ARG . 40.4 t -83.28 -35.82 12.2 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.086 0 C-N-CA 122.618 0.367 . . . . 72.33 111.143 176.532 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 48' ' ' MET . . . . . 0.458 ' HE2' HG12 ' A' ' 44' ' ' ILE . 74.6 mtm -70.13 -34.93 73.69 Favored 'General case' 0 N--CA 1.49 1.567 0 C-N-CA 122.504 0.321 . . . . 54.52 111.476 179.398 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 10.9 pt-20 -78.01 -22.53 49.16 Favored 'General case' 0 N--CA 1.478 0.964 0 C-N-CA 122.347 0.259 . . . . 74.22 110.443 175.776 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . 0.411 ' HB2' ' O ' ' A' ' 46' ' ' THR . 15.0 tppt? -69.21 133.77 48.39 Favored 'General case' 0 N--CA 1.473 0.686 0 C-N-CA 123.61 0.764 . . . . 74.04 111.117 -174.207 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 8.3 tt0 -83.72 128.41 34.51 Favored 'General case' 0 C--O 1.239 0.535 0 N-CA-C 108.886 -0.783 . . . . 71.14 108.886 174.757 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 17.1 m -70.36 134.29 86.95 Favored Pre-proline 0 CA--C 1.551 0.99 0 C-N-CA 124.058 0.943 . . . . 62.45 110.658 178.995 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 24.2 Cg_exo -66.5 152.52 80.65 Favored 'Trans proline' 0 C--N 1.378 2.089 0 C-N-CA 121.908 1.739 . . . . 74.55 111.961 171.954 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 21.3 Cg_exo -67.36 -46.78 2.61 Favored 'Trans proline' 0 C--N 1.372 1.809 0 C-N-CA 122.998 2.465 . . . . 64.11 111.685 173.354 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . -66.22 81.28 0.1 Allowed Glycine 0 C--N 1.351 1.396 0 O-C-N 124.112 0.882 . . . . 61.01 113.455 -178.651 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 56' ' ' ILE . . . . . 0.553 ' HB ' HD11 ' A' ' 113' ' ' LEU . 6.9 mt -137.87 117.6 15.37 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.515 0 C-N-CA 125.54 1.536 . . . . 75.12 107.702 178.325 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 57' ' ' THR . . . . . 0.499 ' H ' HD12 ' A' ' 60' ' ' ILE . 47.4 p -78.01 -178.26 5.44 Favored 'General case' 0 N--CA 1.473 0.682 0 C-N-CA 123.863 0.865 . . . . 71.45 110.482 -179.271 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 28.4 tpt180 -65.19 -45.17 85.88 Favored 'General case' 0 CA--C 1.542 0.644 0 CA-C-N 116.248 -0.433 . . . . 71.44 110.019 174.881 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 40.3 m -58.53 -42.46 87.82 Favored 'General case' 0 N--CA 1.485 1.276 0 CA-C-O 121.405 0.621 . . . . 71.52 111.096 179.732 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 60' ' ' ILE . . . . . 0.499 HD12 ' H ' ' A' ' 57' ' ' THR . 83.7 mt -66.68 -41.19 87.73 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.522 0 CA-C-N 115.073 -0.967 . . . . 62.04 110.104 178.25 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 58.9 tt0 -62.17 -36.22 81.19 Favored 'General case' 0 CA--C 1.547 0.844 0 C-N-CA 123.393 0.677 . . . . 73.44 110.43 177.332 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 65.9 m-20 -66.05 -46.55 77.39 Favored 'General case' 0 N--CA 1.48 1.057 0 C-N-CA 123.288 0.635 . . . . 65.41 110.764 178.518 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 63' ' ' MET . . . . . . . . . . . . . 71.1 mtm -65.74 -51.9 55.5 Favored 'General case' 0 N--CA 1.482 1.175 0 O-C-N 123.557 0.536 . . . . 43.41 111.16 -179.007 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 64' ' ' VAL . . . . . 0.516 ' O ' HG13 ' A' ' 68' ' ' ILE . 77.1 t -57.98 -56.17 17.41 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.725 0 C-N-CA 123.955 0.902 . . . . 64.32 110.809 179.997 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . 0.482 ' HB2' HD23 ' A' ' 109' ' ' LEU . . . -59.14 -42.2 90.13 Favored 'General case' 0 N--CA 1.487 1.41 0 C-N-CA 123.05 0.54 . . . . 33.52 110.767 179.837 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -56.34 -42.69 89.36 Favored Glycine 0 C--N 1.344 1.026 0 O-C-N 124.153 0.908 . . . . 34.02 112.12 176.814 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 67' ' ' TYR . . . . . 0.49 ' CE2' ' HG2' ' A' ' 12' ' ' GLN . 16.7 m-30 -70.7 -37.79 73.6 Favored 'General case' 0 N--CA 1.478 0.945 0 C-N-CA 123.847 0.859 . . . . 75.03 111.946 179.09 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 68' ' ' ILE . . . . . 0.516 HG13 ' O ' ' A' ' 64' ' ' VAL . 64.7 mt -58.44 -58.88 4.69 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.027 0 O-C-N 124.169 0.918 . . . . 75.34 108.851 179.185 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 69' ' ' LYS . . . . . 0.482 ' HB2' ' HE2' ' A' ' 106' ' ' TYR . 20.1 ttpp -60.63 -41.12 94.23 Favored 'General case' 0 C--N 1.347 0.462 0 O-C-N 124.151 0.907 . . . . 61.42 110.243 -179.143 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 62.3 tt0 -57.02 -47.98 79.59 Favored 'General case' 0 N--CA 1.478 0.95 0 C-N-CA 123.538 0.735 . . . . 71.21 111.406 -178.788 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 71' ' ' THR . . . . . 0.601 ' HB ' ' HA ' ' A' ' 15' ' ' ALA . 9.1 t -77.64 -25.47 49.7 Favored 'General case' 0 C--N 1.351 0.647 0 N-CA-C 110.07 -0.345 . . . . 73.53 110.07 -175.469 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 72' ' ' LEU . . . . . 0.475 ' HG ' ' O ' ' A' ' 68' ' ' ILE . 37.5 mt -67.75 -38.8 83.95 Favored 'General case' 0 C--O 1.209 -1.07 0 O-C-N 123.507 0.504 . . . . 74.21 110.107 171.026 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 75.2 m-20 -73.62 -41.22 63.08 Favored 'General case' 0 N--CA 1.484 1.234 0 C-N-CA 123.53 0.732 . . . . 65.22 110.995 -178.544 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 74' ' ' ASN . . . . . 0.437 ' HA ' HD22 ' A' ' 22' ' ' LEU . 86.4 m-20 -61.79 -52.11 65.55 Favored 'General case' 0 N--CA 1.475 0.804 0 O-C-N 123.911 0.757 . . . . 63.33 109.558 178.491 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . 0.421 ' O ' ' HG2' ' A' ' 79' ' ' LYS . 17.3 tt0 -76.58 -19.22 58.11 Favored 'General case' 0 CA--C 1.552 1.042 0 CA-C-N 115.642 -0.708 . . . . 73.22 111.688 -178.101 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 9.8 tt0 -68.65 -46.74 68.37 Favored 'General case' 0 N--CA 1.488 1.448 0 N-CA-C 109.547 -0.538 . . . . 75.05 109.547 173.6 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 92.3 mt -61.26 -38.87 88.26 Favored 'General case' 0 C--N 1.346 0.449 0 CA-C-N 115.661 -0.699 . . . . 60.2 109.623 174.449 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . 0.636 HD21 ' HA ' ' A' ' 22' ' ' LEU . 50.3 mt -59.07 -42.64 90.87 Favored 'General case' 0 C--N 1.358 0.962 0 O-C-N 123.92 0.762 . . . . 75.12 111.833 172.805 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 79' ' ' LYS . . . . . 0.421 ' HG2' ' O ' ' A' ' 75' ' ' GLU . 28.9 mmtm -57.08 -47.15 81.71 Favored 'General case' 0 N--CA 1.482 1.135 0 N-CA-C 109.735 -0.469 . . . . 74.02 109.735 176.608 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -67.6 -28.75 73.56 Favored Glycine 0 C--N 1.344 0.998 0 O-C-N 124.518 1.136 . . . . 40.35 114.17 178.754 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 5.8 tt -85.43 -39.56 17.4 Favored 'General case' 0 N--CA 1.478 0.925 0 C-N-CA 124.309 1.044 . . . . 72.51 110.528 -173.279 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 67.5 mt . . . . . 0 CA--C 1.548 0.885 0 C-N-CA 123.704 0.801 . . . . 72.24 111.265 -169.847 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 92' ' ' LEU . . . . . 0.473 HD12 ' HG2' ' A' ' 98' ' ' ARG . 80.7 mt . . . . . 0 N--CA 1.476 0.861 0 N-CA-C 108.492 -0.929 . . . . 52.4 108.492 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 28.3 mt -45.84 -43.83 4.55 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.819 0 C-N-CA 123.87 0.868 . . . . 73.54 110.535 171.629 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -171.09 158.96 30.74 Favored Glycine 0 C--O 1.252 1.225 0 CA-C-N 114.227 -1.352 . . . . 72.12 111.167 175.162 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 4.9 pm0 -55.56 127.34 29.3 Favored 'General case' 0 CA--C 1.552 1.056 0 C-N-CA 124.248 1.019 . . . . 71.34 110.126 172.224 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 20.1 t 76.52 -46.29 0.52 Allowed 'General case' 0 N--CA 1.487 1.397 0 C-N-CA 125.618 1.567 . . . . 73.43 113.824 178.126 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 6.5 t -52.4 -32.32 38.4 Favored 'General case' 0 N--CA 1.491 1.583 0 C-N-CA 123.947 0.899 . . . . 71.2 112.624 -169.163 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 98' ' ' ARG . . . . . 0.473 ' HG2' HD12 ' A' ' 92' ' ' LEU . 0.0 OUTLIER -68.12 -33.84 75.26 Favored 'General case' 0 CA--C 1.55 0.961 0 O-C-N 123.875 0.734 . . . . 75.2 112.852 -175.076 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 27.4 mt-30 -66.51 -39.65 88.79 Favored 'General case' 0 N--CA 1.481 1.118 0 N-CA-C 109.176 -0.675 . . . . 71.43 109.176 175.649 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.29 -35.69 81.04 Favored 'General case' 0 C--O 1.214 -0.779 0 CA-C-N 115.153 -0.93 . . . . 73.11 110.497 172.697 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 62.4 m -63.53 -45.12 92.06 Favored 'General case' 0 N--CA 1.479 0.987 0 C-N-CA 123.152 0.581 . . . . 71.2 111.292 -177.226 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 9.1 mp -76.17 -38.79 56.18 Favored 'General case' 0 N--CA 1.485 1.323 0 O-C-N 123.186 0.304 . . . . 75.14 111.494 179.103 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 4.4 t-20 -63.52 -40.32 96.72 Favored 'General case' 0 N--CA 1.486 1.342 0 CA-C-O 121.244 0.545 . . . . 50.52 110.684 177.374 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 26.1 t-20 -72.27 -38.77 68.76 Favored 'General case' 0 N--CA 1.471 0.584 0 CA-C-N 115.271 -0.877 . . . . 72.52 109.492 178.876 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -62.59 -31.36 72.18 Favored 'General case' 0 N--CA 1.476 0.848 0 C-N-CA 123.408 0.683 . . . . 64.31 111.079 175.863 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 106' ' ' TYR . . . . . 0.482 ' HE2' ' HB2' ' A' ' 69' ' ' LYS . 2.9 t80 -67.71 -50.56 56.85 Favored 'General case' 0 C--N 1.35 0.628 0 N-CA-C 108.921 -0.77 . . . . 72.32 108.921 175.808 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -62.86 -30.3 76.75 Favored Glycine 0 C--N 1.351 1.381 0 O-C-N 123.608 0.568 . . . . 74.51 113.107 177.377 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 1.2 mpt_? -77.14 -29.43 54.65 Favored 'General case' 0 N--CA 1.468 0.461 0 C-N-CA 123.985 0.914 . . . . 72.03 110.185 176.67 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 109' ' ' LEU . . . . . 0.492 HD13 ' HB2' ' A' ' 114' ' ' LEU . 34.6 tp -71.7 -34.92 70.03 Favored 'General case' 0 N--CA 1.479 1.018 0 N-CA-C 109.393 -0.595 . . . . 74.54 109.393 175.08 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 47.9 t -66.04 -42.93 88.93 Favored 'General case' 0 CA--C 1.54 0.578 0 CA-C-N 114.912 -1.04 . . . . 53.25 109.819 173.52 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . -90.27 -68.07 1.21 Allowed Glycine 0 C--N 1.364 2.138 0 CA-C-O 119.027 -0.874 . . . . 61.24 114.8 -175.816 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 112' ' ' MET . . . . . . . . . . . . . 2.8 tmm? -97.85 -66.33 0.91 Allowed 'General case' 0 N--CA 1.488 1.447 0 CA-C-N 118.647 1.224 . . . . 72.53 113.049 -174.078 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 113' ' ' LEU . . . . . 0.553 HD11 ' HB ' ' A' ' 56' ' ' ILE . 0.2 OUTLIER 171.39 50.29 0.0 OUTLIER 'General case' 0 N--CA 1.495 1.786 0 C-N-CA 124.324 1.049 . . . . 70.12 109.866 178.164 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 114' ' ' LEU . . . . . 0.492 ' HB2' HD13 ' A' ' 109' ' ' LEU . 6.0 tt . . . . . 0 N--CA 1.501 2.088 0 C-N-CA 126.136 1.774 . . . . 33.43 112.17 175.608 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 1' ' ' MET . . . . . 0.443 ' HG2' HG23 ' A' ' 5' ' ' VAL . 25.1 ttt . . . . . 0 CA--C 1.554 1.106 0 CA-C-O 119.738 -0.173 . . . . 62.21 110.938 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 39.8 p -51.29 -40.39 58.87 Favored 'General case' 0 N--CA 1.486 1.357 0 C-N-CA 123.802 0.841 . . . . 71.32 112.638 -174.643 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 79.6 p -64.88 -41.98 95.19 Favored 'General case' 0 C--N 1.357 0.895 0 O-C-N 123.456 0.472 . . . . 73.24 110.436 -178.268 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 4' ' ' THR . . . . . 0.476 ' HA ' ' HG2' ' A' ' 53' ' ' PRO . 33.5 m -67.57 -47.08 70.83 Favored 'General case' 0 C--N 1.356 0.878 0 O-C-N 123.632 0.582 . . . . 70.44 111.278 178.968 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 5' ' ' VAL . . . . . 0.443 HG23 ' HG2' ' A' ' 1' ' ' MET . 64.1 t -60.39 -43.27 93.55 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.411 0 C-N-CA 123.546 0.738 . . . . 71.2 110.708 -178.606 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 6' ' ' GLU . . . . . 0.464 ' O ' ' HG3' ' A' ' 10' ' ' ARG . 3.2 tm-20 -71.87 -34.2 69.02 Favored 'General case' 0 CA--C 1.54 0.594 0 CA-C-N 114.727 -1.124 . . . . 75.1 109.822 -178.014 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 59.4 t80 -67.72 -39.22 84.31 Favored 'General case' 0 CA--C 1.553 1.064 0 C-N-CA 123.578 0.751 . . . . 74.33 110.807 176.545 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 8' ' ' ILE . . . . . 0.41 HG13 ' O ' ' A' ' 4' ' ' THR . 87.8 mt -64.07 -39.94 87.28 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.965 0 N-CA-C 109.058 -0.719 . . . . 74.13 109.058 174.054 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 3.8 t-20 -66.63 -30.74 71.08 Favored 'General case' 0 C--N 1.354 0.779 0 O-C-N 123.919 0.762 . . . . 53.53 110.57 179.434 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . 0.464 ' HG3' ' O ' ' A' ' 6' ' ' GLU . 85.4 mtt180 -64.58 -46.08 84.27 Favored 'General case' 0 N--CA 1.477 0.91 0 C-N-CA 123.211 0.605 . . . . 62.31 109.745 173.349 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 11' ' ' TRP . . . . . 0.453 ' CD1' HG13 ' A' ' 64' ' ' VAL . 81.5 m95 -65.65 -31.73 72.92 Favored 'General case' 0 N--CA 1.48 1.033 0 O-C-N 123.618 0.574 . . . . 73.01 111.962 176.629 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . 0.429 ' HG2' ' CE2' ' A' ' 67' ' ' TYR . 55.3 mt-30 -61.6 -45.86 92.3 Favored 'General case' 0 C--N 1.354 0.776 0 N-CA-C 108.685 -0.857 . . . . 73.44 108.685 172.718 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . 0.438 ' NH2' ' HB3' ' A' ' 39' ' ' SER . 14.0 tpt180 -61.41 -49.41 76.97 Favored 'General case' 0 CA--C 1.545 0.788 0 O-C-N 123.832 0.708 . . . . 73.14 110.907 -178.221 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 14' ' ' ILE . . . . . 0.471 HD11 HG21 ' A' ' 47' ' ' VAL . 54.3 mt -62.75 -47.99 90.25 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.409 0 C-N-CA 122.658 0.383 . . . . 71.42 110.57 -178.785 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . 0.551 ' HA ' ' HB ' ' A' ' 71' ' ' THR . . . -59.07 -45.72 90.11 Favored 'General case' 0 N--CA 1.477 0.924 0 C-N-CA 124.148 0.979 . . . . 73.44 111.388 -178.249 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 94.5 mt -76.34 -34.13 58.98 Favored 'General case' 0 N--CA 1.482 1.17 0 O-C-N 124.344 1.028 . . . . 72.44 111.499 -175.885 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.474 ' O ' ' HG ' ' A' ' 21' ' ' LEU . 34.2 mt -64.09 -56.83 12.13 Favored 'General case' 0 N--CA 1.476 0.864 0 N-CA-C 109.242 -0.651 . . . . 72.04 109.242 176.868 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 69.0 p -63.03 -32.01 73.28 Favored 'General case' 0 N--CA 1.475 0.777 0 O-C-N 124.223 0.952 . . . . 54.5 111.582 -178.78 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 19' ' ' GLN . . . . . 0.408 HE21 ' NE2' ' A' ' 70' ' ' GLN . 6.7 tp-100 -59.63 -51.95 67.62 Favored 'General case' 0 N--CA 1.478 0.971 0 C-N-CA 123.662 0.785 . . . . 75.32 109.861 172.716 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 51.3 m -60.15 -41.97 93.88 Favored 'General case' 0 C--O 1.215 -0.759 0 O-C-N 124.163 0.914 . . . . 74.43 110.314 177.045 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . 0.572 HD22 ' HA ' ' A' ' 33' ' ' LEU . 35.2 mt -67.65 -33.34 74.76 Favored 'General case' 0 C--N 1.348 0.527 0 C-N-CA 123.035 0.534 . . . . 75.23 110.849 -176.459 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.556 ' HA ' HD21 ' A' ' 78' ' ' LEU . 47.8 tp -69.83 -49.95 47.54 Favored 'General case' 0 C--O 1.244 0.771 0 O-C-N 123.74 0.65 . . . . 74.22 109.939 179.041 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . 0.565 ' HB3' ' HE ' ' A' ' 27' ' ' ARG . 42.5 mt-10 -55.21 -60.48 3.33 Favored 'General case' 0 C--N 1.352 0.678 0 O-C-N 124.219 0.949 . . . . 71.12 110.37 176.941 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . 0.486 HD23 ' HD2' ' A' ' 27' ' ' ARG . 79.1 mt -61.36 -32.19 72.09 Favored 'General case' 0 CA--C 1.542 0.639 0 C-N-CA 124.652 1.181 . . . . 74.24 111.847 -176.543 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . 0.469 ' HB2' HD21 ' A' ' 33' ' ' LEU . . . -61.22 -49.07 78.62 Favored 'General case' 0 N--CA 1.482 1.131 0 CA-C-O 120.873 0.368 . . . . 70.43 110.191 174.912 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 95.2 mt-30 -72.11 -22.99 61.25 Favored 'General case' 0 CA--C 1.549 0.924 0 CA-C-N 115.017 -0.992 . . . . 54.11 111.759 -179.216 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 27' ' ' ARG . . . . . 0.565 ' HE ' ' HB3' ' A' ' 23' ' ' GLU . 47.2 mtt-85 -80.52 -10.03 59.75 Favored 'General case' 0 N--CA 1.485 1.324 0 C-N-CA 123.638 0.775 . . . . 63.54 110.95 174.179 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 83.39 9.0 84.28 Favored Glycine 0 C--N 1.348 1.228 0 C-N-CA 122.673 0.178 . . . . 72.11 113.316 -178.8 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 20.9 mm-40 -86.56 55.08 3.4 Favored 'General case' 0 CA--C 1.547 0.846 0 C-N-CA 125.306 1.442 . . . . 51.22 110.777 178.836 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 30' ' ' TRP . . . . . 0.439 ' O ' ' HG ' ' A' ' 34' ' ' LEU . 86.4 m95 -63.13 -29.03 70.47 Favored 'General case' 0 N--CA 1.481 1.089 0 C-N-CA 123.681 0.792 . . . . 54.53 111.313 -177.654 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 20.1 m-20 -53.6 -48.93 68.8 Favored 'General case' 0 N--CA 1.48 1.069 0 C-N-CA 123.608 0.763 . . . . 72.1 110.131 175.43 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 0.466 HD12 HD22 ' A' ' 24' ' ' LEU . 34.7 mt -63.97 -30.67 71.73 Favored 'General case' 0 CA--C 1.542 0.654 0 CA-C-N 115.094 -0.957 . . . . 64.2 111.063 -176.242 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . 0.572 ' HA ' HD22 ' A' ' 21' ' ' LEU . 9.8 mp -63.96 -46.3 85.26 Favored 'General case' 0 N--CA 1.477 0.91 0 O-C-N 123.585 0.553 . . . . 75.03 110.159 171.327 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.439 ' HG ' ' O ' ' A' ' 30' ' ' TRP . 64.6 mt -63.37 -30.78 71.86 Favored 'General case' 0 N--CA 1.484 1.269 0 C-N-CA 123.367 0.667 . . . . 72.04 112.21 -177.862 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 1.3 mp0 -74.24 -49.06 24.87 Favored 'General case' 0 N--CA 1.485 1.284 0 C-N-CA 122.526 0.33 . . . . 73.11 111.009 173.798 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 36' ' ' GLN . . . . . 0.505 ' HB2' HD21 ' A' ' 21' ' ' LEU . 84.5 mm-40 -69.42 -14.44 62.9 Favored 'General case' 0 N--CA 1.48 1.034 0 C-N-CA 123.41 0.684 . . . . 74.23 111.966 179.617 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . 0.478 ' O ' ' HG ' ' A' ' 41' ' ' LEU . 28.2 tt0 -48.04 -54.62 12.43 Favored 'General case' 0 N--CA 1.481 1.086 0 C-N-CA 124.903 1.281 . . . . 65.33 111.876 178.536 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 59.6 t -57.4 -45.38 85.5 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.998 0 C-N-CA 123.973 0.909 . . . . 74.03 110.726 -176.494 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . 0.438 ' HB3' ' NH2' ' A' ' 13' ' ' ARG . 41.5 m -67.08 -36.88 82.95 Favored 'General case' 0 CA--C 1.542 0.643 0 CA-C-N 114.792 -1.095 . . . . 65.21 111.401 179.056 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 76.5 t80 -69.2 -46.94 66.22 Favored 'General case' 0 N--CA 1.477 0.896 0 C-N-CA 123.745 0.818 . . . . 72.51 110.291 -176.255 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . 0.478 ' HG ' ' O ' ' A' ' 37' ' ' GLU . 73.9 mt -58.31 -52.18 66.69 Favored 'General case' 0 C--N 1.355 0.807 0 O-C-N 124.672 1.233 . . . . 53.14 109.13 176.773 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 50.3 tt0 -54.76 -48.22 72.92 Favored 'General case' 0 C--N 1.354 0.779 0 O-C-N 124.003 0.814 . . . . 75.11 111.498 -178.232 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 43' ' ' SER . . . . . 0.472 ' O ' HG23 ' A' ' 47' ' ' VAL . 68.1 m -61.41 -59.7 4.85 Favored 'General case' 0 CA--C 1.545 0.767 0 C-N-CA 123.069 0.548 . . . . 44.22 111.259 -178.263 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 12.6 tt -59.95 -39.37 79.96 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.145 0 O-C-N 123.821 0.701 . . . . 74.35 111.319 -172.914 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 18.3 mm-40 -65.25 -54.34 30.82 Favored 'General case' 0 N--CA 1.475 0.796 0 C-N-CA 123.554 0.741 . . . . 73.12 110.892 177.673 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 46' ' ' THR . . . . . 0.446 ' O ' ' HD3' ' A' ' 50' ' ' LYS . 87.9 m -56.47 -31.46 64.04 Favored 'General case' 0 N--CA 1.489 1.502 0 C-N-CA 123.469 0.708 . . . . 43.21 111.925 -177.831 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 47' ' ' VAL . . . . . 0.472 HG23 ' O ' ' A' ' 43' ' ' SER . 60.9 t -76.21 -46.33 33.63 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.821 0 CA-C-N 116.848 -0.16 . . . . 74.35 111.212 177.332 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 48' ' ' MET . . . . . . . . . . . . . 70.6 mtm -74.6 -21.07 59.66 Favored 'General case' 0 N--CA 1.487 1.392 0 N-CA-C 112.811 0.671 . . . . 75.24 112.811 -175.842 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 50.7 mt-10 -83.14 -37.3 23.9 Favored 'General case' 0 N--CA 1.488 1.455 0 C-N-CA 122.699 0.4 . . . . 75.23 111.07 177.681 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . 0.446 ' HD3' ' O ' ' A' ' 46' ' ' THR . 13.6 mptt -91.45 147.02 23.33 Favored 'General case' 0 N--CA 1.475 0.8 0 CA-C-N 115.67 -0.696 . . . . 64.52 110.036 -170.485 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 7.6 tt0 -71.83 136.52 47.04 Favored 'General case' 0 CA--C 1.539 0.539 0 CA-C-N 115.013 -0.994 . . . . 73.4 110.757 -173.655 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 52' ' ' THR . . . . . 0.77 HG21 ' HB3' ' A' ' 114' ' ' LEU . 59.9 m -70.44 133.16 87.22 Favored Pre-proline 0 CA--C 1.555 1.168 0 CA-C-N 115.263 -0.88 . . . . 74.14 110.109 173.313 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 53' ' ' PRO . . . . . 0.476 ' HG2' ' HA ' ' A' ' 4' ' ' THR . 45.4 Cg_exo -58.62 151.98 59.08 Favored 'Trans proline' 0 C--N 1.383 2.356 0 C-N-CA 122.379 2.053 . . . . 73.12 113.162 177.63 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 54' ' ' PRO . . . . . 0.427 ' HD3' ' HA ' ' A' ' 53' ' ' PRO . 18.5 Cg_exo -68.68 -46.96 1.52 Allowed 'Trans proline' 0 C--N 1.375 1.972 0 C-N-CA 122.963 2.442 . . . . 71.24 110.994 172.827 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . -68.99 87.18 0.22 Allowed Glycine 0 C--N 1.349 1.268 0 CA-C-N 114.928 -1.033 . . . . 70.32 113.134 -179.164 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 80.3 mt -128.15 123.99 61.54 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.639 0 C-N-CA 124.574 1.15 . . . . 53.21 108.005 173.891 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 57' ' ' THR . . . . . 0.462 ' H ' HD12 ' A' ' 60' ' ' ILE . 31.9 p -85.2 179.23 7.27 Favored 'General case' 0 N--CA 1.473 0.703 0 N-CA-C 109.31 -0.626 . . . . 61.44 109.31 176.249 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 39.1 tpt85 -64.43 -47.04 80.63 Favored 'General case' 0 CA--C 1.541 0.606 0 C-N-CA 122.917 0.487 . . . . 73.44 109.772 176.176 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 17.7 m -60.84 -41.61 96.17 Favored 'General case' 0 N--CA 1.475 0.811 0 C-N-CA 123.683 0.793 . . . . 52.05 111.35 179.517 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 60' ' ' ILE . . . . . 0.462 HD12 ' H ' ' A' ' 57' ' ' THR . 98.1 mt -64.28 -42.04 94.22 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.95 0 C-N-CA 123.242 0.617 . . . . 72.21 110.43 177.826 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 49.0 tt0 -58.08 -42.23 85.11 Favored 'General case' 0 CA--C 1.544 0.72 0 O-C-N 123.801 0.688 . . . . 74.14 110.548 176.359 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 35.4 m-20 -68.82 -39.31 80.08 Favored 'General case' 0 N--CA 1.48 1.026 0 C-N-CA 123.214 0.606 . . . . 72.4 112.078 -179.608 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 63' ' ' MET . . . . . . . . . . . . . 71.6 mtm -68.68 -46.17 69.77 Favored 'General case' 0 N--CA 1.482 1.175 0 O-C-N 123.322 0.389 . . . . 63.45 110.691 -179.821 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 64' ' ' VAL . . . . . 0.529 ' O ' HG13 ' A' ' 68' ' ' ILE . 70.6 t -63.91 -60.05 3.34 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.558 0 CA-C-N 115.175 -0.92 . . . . 54.1 109.916 178.827 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . 0.57 ' HB2' HD23 ' A' ' 109' ' ' LEU . . . -60.92 -29.55 69.67 Favored 'General case' 0 N--CA 1.493 1.689 0 C-N-CA 123.298 0.639 . . . . 53.24 112.018 -179.054 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -67.0 -42.1 92.78 Favored Glycine 0 C--N 1.345 1.073 0 O-C-N 123.66 0.6 . . . . 65.42 111.928 176.018 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 67' ' ' TYR . . . . . 0.429 ' CE2' ' HG2' ' A' ' 12' ' ' GLN . 9.8 m-30 -75.89 -29.34 58.42 Favored 'General case' 0 N--CA 1.473 0.701 0 C-N-CA 123.046 0.539 . . . . 74.22 112.276 177.289 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 68' ' ' ILE . . . . . 0.539 ' O ' ' HG ' ' A' ' 72' ' ' LEU . 47.3 mt -64.03 -50.01 79.04 Favored 'Isoleucine or valine' 0 C--N 1.355 0.845 0 N-CA-C 107.251 -1.388 . . . . 73.35 107.251 172.306 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 69' ' ' LYS . . . . . 0.565 ' HB2' ' HE2' ' A' ' 106' ' ' TYR . 48.0 tttp -52.11 -48.46 64.77 Favored 'General case' 0 N--CA 1.481 1.098 0 C-N-CA 123.967 0.907 . . . . 55.11 111.149 176.432 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 70' ' ' GLN . . . . . 0.408 ' NE2' HE21 ' A' ' 19' ' ' GLN . 60.7 tt0 -59.53 -46.38 89.04 Favored 'General case' 0 C--N 1.348 0.505 0 O-C-N 124.534 1.146 . . . . 72.55 110.41 -176.398 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 71' ' ' THR . . . . . 0.551 ' HB ' ' HA ' ' A' ' 15' ' ' ALA . 12.3 t -78.8 -18.74 53.63 Favored 'General case' 0 C--O 1.215 -0.752 0 CA-C-O 118.525 -0.75 . . . . 74.34 110.906 -177.91 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 72' ' ' LEU . . . . . 0.539 ' HG ' ' O ' ' A' ' 68' ' ' ILE . 37.6 mt -76.63 -33.42 58.35 Favored 'General case' 0 N--CA 1.491 1.611 0 CA-C-N 118.447 0.567 . . . . 64.44 110.791 173.596 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 50.8 m-20 -69.71 -49.01 57.43 Favored 'General case' 0 N--CA 1.476 0.855 0 N-CA-C 109.114 -0.698 . . . . 64.12 109.114 175.025 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 78.6 m-20 -57.86 -41.72 82.99 Favored 'General case' 0 N--CA 1.48 1.031 0 O-C-N 124.12 0.888 . . . . 73.13 110.714 175.522 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . 0.458 ' O ' ' HG2' ' A' ' 79' ' ' LYS . 11.2 tp10 -53.91 -61.64 2.17 Favored 'General case' 0 N--CA 1.485 1.284 0 C-N-CA 125.389 1.476 . . . . 54.42 110.697 176.234 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 9.1 tt0 -58.13 -46.77 85.03 Favored 'General case' 0 CA--C 1.543 0.702 0 O-C-N 124.056 0.848 . . . . 73.23 111.107 -174.094 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 95.2 mt -67.18 -40.25 86.55 Favored 'General case' 0 CA--C 1.545 0.751 0 CA-C-N 115.535 -0.757 . . . . 60.03 111.607 -176.538 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . 0.556 HD21 ' HA ' ' A' ' 22' ' ' LEU . 15.9 mt -65.79 -46.23 79.47 Favored 'General case' 0 N--CA 1.478 0.944 0 O-C-N 123.442 0.464 . . . . 75.21 111.807 -179.031 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 79' ' ' LYS . . . . . 0.458 ' HG2' ' O ' ' A' ' 75' ' ' GLU . 22.8 mmtp -70.57 -32.92 70.51 Favored 'General case' 0 N--CA 1.481 1.1 0 CA-C-O 121.002 0.429 . . . . 75.4 109.947 -178.438 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -64.67 -28.8 73.77 Favored Glycine 0 C--N 1.345 1.076 0 CA-C-N 114.594 -1.185 . . . . 75.11 112.983 172.354 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -83.79 -38.99 20.57 Favored 'General case' 0 CA--C 1.558 1.256 0 C-N-CA 123.46 0.704 . . . . 72.21 110.527 176.813 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 78.9 mt . . . . . 0 N--CA 1.483 1.21 0 C-N-CA 123.546 0.738 . . . . 71.31 111.634 -172.624 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 92' ' ' LEU . . . . . 0.506 ' N ' ' HG ' ' A' ' 96' ' ' SER . 90.8 mt . . . . . 0 CA--C 1.549 0.908 0 CA-C-O 120.362 0.125 . . . . 55.03 111.248 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 5.9 mt -99.34 35.06 0.22 Allowed 'Isoleucine or valine' 0 N--CA 1.484 1.247 0 N-CA-C 108.34 -0.985 . . . . 64.43 108.34 -179.69 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 74.21 -70.87 1.53 Allowed Glycine 0 C--N 1.349 1.298 0 N-CA-C 109.255 -1.538 . . . . 74.31 109.255 -163.928 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 50.5 mt-30 -69.76 97.13 1.04 Allowed 'General case' 0 C--N 1.349 0.587 0 N-CA-C 108.038 -1.097 . . . . 74.12 108.038 161.782 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 96' ' ' SER . . . . . 0.506 ' HG ' ' N ' ' A' ' 92' ' ' LEU . 17.3 m -71.69 90.29 1.05 Allowed 'General case' 0 CA--C 1.535 0.376 0 N-CA-C 109.176 -0.676 . . . . 75.23 109.176 178.707 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 11.3 t -85.96 44.34 1.12 Allowed 'General case' 0 CA--C 1.557 1.25 0 C-N-CA 123.825 0.85 . . . . 74.34 110.111 -179.182 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 98' ' ' ARG . . . . . 0.452 ' HD2' ' H ' ' A' ' 98' ' ' ARG . 0.2 OUTLIER -58.98 -53.35 59.37 Favored 'General case' 0 CA--C 1.548 0.891 0 C-N-CA 123.974 0.91 . . . . 74.12 110.86 -174.161 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 33.9 tt0 -72.61 -50.15 27.26 Favored 'General case' 0 C--N 1.346 0.441 0 C-N-CA 123.836 0.854 . . . . 65.22 109.508 -175.399 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 71.0 mmtt -60.44 -55.47 33.14 Favored 'General case' 0 N--CA 1.472 0.674 0 O-C-N 123.971 0.795 . . . . 71.14 110.501 -173.245 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 39.0 t -72.28 -44.25 63.05 Favored 'General case' 0 CA--C 1.546 0.825 0 O-C-N 124.062 0.851 . . . . 63.14 112.344 -174.526 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 6.4 tp -72.38 -38.24 68.53 Favored 'General case' 0 N--CA 1.49 1.563 0 CA-C-N 118.532 0.605 . . . . 72.23 110.617 -174.505 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 66.5 t30 -77.59 -24.89 49.61 Favored 'General case' 0 N--CA 1.478 0.949 0 CA-C-N 116.435 -0.348 . . . . 64.31 110.682 177.237 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 47.9 t30 -66.74 -38.29 86.36 Favored 'General case' 0 N--CA 1.488 1.445 0 C-N-CA 122.864 0.465 . . . . 71.14 109.818 171.201 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -61.34 -47.81 84.18 Favored 'General case' 0 C--N 1.352 0.7 0 O-C-N 123.896 0.748 . . . . 73.54 109.96 174.621 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 106' ' ' TYR . . . . . 0.565 ' HE2' ' HB2' ' A' ' 69' ' ' LYS . 4.6 t80 -55.93 -53.42 57.09 Favored 'General case' 0 CA--C 1.55 0.956 0 O-C-N 124.248 0.968 . . . . 73.5 111.06 176.354 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -68.5 -37.97 86.05 Favored Glycine 0 C--N 1.349 1.266 0 O-C-N 123.781 0.676 . . . . 63.45 113.268 -172.043 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 38.3 ttp-105 -71.01 -32.59 69.43 Favored 'General case' 0 CA--C 1.543 0.707 0 C-N-CA 123.665 0.786 . . . . 62.35 109.779 177.395 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 109' ' ' LEU . . . . . 0.57 HD23 ' HB2' ' A' ' 65' ' ' ALA . 47.9 tp -66.99 -46.14 75.5 Favored 'General case' 0 N--CA 1.481 1.103 0 C-N-CA 123.297 0.639 . . . . 73.11 110.778 175.129 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 23.0 t -67.83 -35.43 78.58 Favored 'General case' 0 CA--C 1.543 0.681 0 O-C-N 124.147 0.904 . . . . 51.5 110.229 -178.643 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . -84.26 -63.93 1.62 Allowed Glycine 0 C--N 1.36 1.874 0 CA-C-O 119.274 -0.737 . . . . 65.13 113.28 -176.363 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 112' ' ' MET . . . . . 0.452 ' O ' ' HB2' ' A' ' 113' ' ' LEU . 2.0 tmm? -95.24 -66.24 0.92 Allowed 'General case' 0 N--CA 1.487 1.393 0 CA-C-N 118.496 1.148 . . . . 70.02 110.351 179.586 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 113' ' ' LEU . . . . . 0.452 ' HB2' ' O ' ' A' ' 112' ' ' MET . 14.8 tp 164.4 28.17 0.0 OUTLIER 'General case' 0 N--CA 1.505 2.309 0 C-N-CA 125.445 1.498 . . . . 72.11 110.472 179.269 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 114' ' ' LEU . . . . . 0.77 ' HB3' HG21 ' A' ' 52' ' ' THR . 0.5 OUTLIER . . . . . 0 N--CA 1.501 2.12 0 C-N-CA 125.553 1.541 . . . . 71.23 111.215 -178.569 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 12.4 tpt . . . . . 0 N--CA 1.478 0.971 0 CA-C-O 119.045 -0.502 . . . . 62.31 111.548 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 46.7 p -55.46 -41.35 72.8 Favored 'General case' 0 N--CA 1.484 1.228 0 C-N-CA 122.754 0.422 . . . . 74.44 112.075 -175.94 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 14.7 m -58.35 -42.32 86.66 Favored 'General case' 0 N--CA 1.48 1.03 0 C-N-CA 123.299 0.64 . . . . 73.24 111.121 177.629 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 56.9 m -68.77 -40.62 79.6 Favored 'General case' 0 CA--C 1.544 0.744 0 C-N-CA 123.552 0.741 . . . . 65.35 111.38 177.908 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 88.4 t -63.46 -40.78 90.31 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.021 0 C-N-CA 123.06 0.544 . . . . 53.24 110.127 179.943 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 6' ' ' GLU . . . . . 0.428 ' O ' ' HG3' ' A' ' 10' ' ' ARG . 50.3 mm-40 -71.68 -35.07 70.18 Favored 'General case' 0 N--CA 1.469 0.502 0 O-C-N 123.718 0.636 . . . . 70.33 111.031 178.599 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 55.4 t80 -67.62 -45.06 76.49 Favored 'General case' 0 CA--C 1.551 1.0 0 C-N-CA 123.031 0.533 . . . . 74.43 110.529 179.62 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 8' ' ' ILE . . . . . 0.521 HD11 HG23 ' A' ' 60' ' ' ILE . 90.2 mt -62.97 -40.24 88.25 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.811 0 C-N-CA 123.621 0.768 . . . . 73.4 109.381 173.677 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 20.9 t-20 -61.79 -33.35 73.95 Favored 'General case' 0 N--CA 1.481 1.117 0 C-N-CA 124.063 0.945 . . . . 73.13 111.239 177.227 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . 0.654 ' HB3' HG22 ' A' ' 47' ' ' VAL . 64.0 mtt85 -68.59 -40.48 80.48 Favored 'General case' 0 CA--C 1.536 0.442 0 C-N-CA 123.124 0.569 . . . . 73.33 110.377 175.565 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 11' ' ' TRP . . . . . 0.427 ' CD1' HG13 ' A' ' 64' ' ' VAL . 74.8 m95 -69.84 -32.12 70.35 Favored 'General case' 0 N--CA 1.479 1.011 0 N-CA-C 112.14 0.422 . . . . 75.21 112.14 174.931 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . 0.411 ' HG3' ' O ' ' A' ' 8' ' ' ILE . 52.9 mt-30 -63.23 -42.02 99.18 Favored 'General case' 0 N--CA 1.472 0.637 0 N-CA-C 108.701 -0.851 . . . . 73.33 108.701 172.302 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 15.5 tpt180 -63.31 -50.69 69.05 Favored 'General case' 0 CA--C 1.541 0.605 0 CA-C-N 115.174 -0.921 . . . . 63.14 110.587 -177.091 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 14' ' ' ILE . . . . . 0.517 HD11 HG21 ' A' ' 47' ' ' VAL . 70.2 mt -63.11 -44.06 99.27 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.062 0 C-N-CA 123.456 0.702 . . . . 71.43 110.653 -179.041 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . 0.587 ' HA ' ' HB ' ' A' ' 71' ' ' THR . . . -61.21 -50.79 71.69 Favored 'General case' 0 N--CA 1.479 0.991 0 C-N-CA 124.073 0.949 . . . . 73.41 111.964 -179.672 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 97.9 mt -76.61 -35.17 58.25 Favored 'General case' 0 N--CA 1.48 1.057 0 CA-C-N 114.795 -1.093 . . . . 63.5 111.516 -172.655 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.498 ' O ' ' HG ' ' A' ' 21' ' ' LEU . 45.7 mt -66.43 -47.8 72.06 Favored 'General case' 0 N--CA 1.473 0.707 0 CA-C-O 118.971 -0.537 . . . . 75.01 109.947 175.9 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 98.2 p -65.67 -30.73 71.47 Favored 'General case' 0 N--CA 1.487 1.421 0 C-N-CA 122.611 0.364 . . . . 75.12 111.246 179.151 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 19' ' ' GLN . . . . . 0.663 ' HA ' HD22 ' A' ' 74' ' ' ASN . 6.3 tp-100 -59.31 -49.63 77.08 Favored 'General case' 0 C--N 1.354 0.799 0 O-C-N 123.737 0.648 . . . . 74.41 109.303 171.134 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 44.6 m -62.65 -41.73 99.21 Favored 'General case' 0 CA--C 1.542 0.644 0 CA-C-N 115.233 -0.894 . . . . 75.05 111.163 178.179 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . 0.498 ' HG ' ' O ' ' A' ' 17' ' ' LEU . 80.2 mt -63.26 -39.83 95.72 Favored 'General case' 0 N--CA 1.478 0.967 0 C-N-CA 123.64 0.776 . . . . 72.42 110.087 -177.421 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.566 ' HA ' HD21 ' A' ' 78' ' ' LEU . 55.6 tp -64.29 -54.77 28.01 Favored 'General case' 0 CA--C 1.539 0.546 0 CA-C-N 115.628 -0.715 . . . . 71.43 110.224 178.058 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 47.3 mt-10 -54.17 -50.82 66.12 Favored 'General case' 0 N--CA 1.483 1.186 0 C-N-CA 123.862 0.865 . . . . 74.41 111.279 -178.954 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . 0.441 ' HB3' ' HB2' ' A' ' 29' ' ' GLU . 91.7 mt -63.47 -40.28 96.69 Favored 'General case' 0 N--CA 1.47 0.554 0 CA-C-N 115.012 -0.995 . . . . 65.23 111.067 -177.363 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . 0.424 ' HB2' HD21 ' A' ' 33' ' ' LEU . . . -59.91 -40.6 89.37 Favored 'General case' 0 N--CA 1.482 1.161 0 C-N-CA 123.137 0.575 . . . . 70.01 111.352 176.813 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 86.7 mt-30 -64.42 -35.8 82.08 Favored 'General case' 0 N--CA 1.48 1.067 0 C-N-CA 123.899 0.88 . . . . 73.2 110.975 175.776 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 57.7 mtt180 -82.35 -6.79 59.49 Favored 'General case' 0 N--CA 1.482 1.134 0 C-N-CA 123.914 0.886 . . . . 74.11 112.021 179.36 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 84.09 9.77 81.73 Favored Glycine 0 C--N 1.352 1.441 0 N-CA-C 113.587 0.195 . . . . 65.13 113.587 -179.916 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 29' ' ' GLU . . . . . 0.441 ' HB2' ' HB3' ' A' ' 24' ' ' LEU . 40.4 mm-40 -85.5 54.28 3.06 Favored 'General case' 0 CA--C 1.546 0.793 0 C-N-CA 124.626 1.17 . . . . 64.13 111.168 179.629 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 30' ' ' TRP . . . . . 0.492 ' O ' ' HG ' ' A' ' 34' ' ' LEU . 96.0 m95 -64.79 -28.8 69.82 Favored 'General case' 0 N--CA 1.475 0.781 0 C-N-CA 123.402 0.681 . . . . 74.32 111.797 -176.869 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 11.1 m-20 -59.54 -39.46 84.04 Favored 'General case' 0 N--CA 1.486 1.352 0 C-N-CA 123.23 0.612 . . . . 74.44 110.439 178.456 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 88.0 mt -67.82 -31.45 71.3 Favored 'General case' 0 CA--C 1.543 0.679 0 CA-C-N 115.255 -0.884 . . . . 74.11 110.963 179.135 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . 0.447 HD13 ' HA ' ' A' ' 30' ' ' TRP . 9.2 mp -65.44 -43.7 89.62 Favored 'General case' 0 N--CA 1.488 1.45 0 N-CA-C 110.051 -0.351 . . . . 72.54 110.051 171.627 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.492 ' HG ' ' O ' ' A' ' 30' ' ' TRP . 49.0 mt -66.3 -33.19 75.19 Favored 'General case' 0 N--CA 1.477 0.914 0 O-C-N 123.989 0.806 . . . . 70.21 111.442 -176.844 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 98.1 mt-30 -74.07 -53.88 9.02 Favored 'General case' 0 N--CA 1.477 0.903 0 C-N-CA 123.414 0.686 . . . . 54.25 110.294 177.04 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 83.5 mm-40 -63.86 -18.1 63.82 Favored 'General case' 0 N--CA 1.484 1.225 0 O-C-N 123.773 0.67 . . . . 73.23 111.637 178.848 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . 0.561 ' O ' ' HG ' ' A' ' 41' ' ' LEU . 30.3 tt0 -48.97 -60.97 2.32 Favored 'General case' 0 C--N 1.361 1.094 0 C-N-CA 124.523 1.129 . . . . 72.35 111.523 178.995 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 58.1 t -60.76 -40.59 85.48 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.291 0 O-C-N 123.787 0.679 . . . . 70.23 111.45 -173.973 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 50.8 m -62.22 -39.75 93.82 Favored 'General case' 0 CA--C 1.545 0.784 0 C-N-CA 123.382 0.673 . . . . 63.43 110.794 175.478 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 37.9 t80 -70.94 -40.15 72.22 Favored 'General case' 0 C--N 1.35 0.598 0 C-N-CA 124.274 1.029 . . . . 71.12 110.357 -176.976 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . 0.561 ' HG ' ' O ' ' A' ' 37' ' ' GLU . 67.3 mt -61.11 -51.07 70.68 Favored 'General case' 0 C--N 1.355 0.845 0 O-C-N 124.291 0.995 . . . . 73.12 108.623 178.773 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 50.8 tt0 -56.51 -42.03 77.69 Favored 'General case' 0 CA--C 1.544 0.735 0 CA-C-N 114.659 -1.155 . . . . 74.22 110.65 178.303 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 43' ' ' SER . . . . . 0.558 ' O ' HG23 ' A' ' 47' ' ' VAL . 68.8 m -61.54 -62.82 1.55 Allowed 'General case' 0 C--N 1.357 0.898 0 C-N-CA 122.959 0.504 . . . . 72.53 110.968 179.345 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 13.7 tt -64.02 -35.35 73.26 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.914 0 C-N-CA 123.836 0.854 . . . . 64.21 111.477 -169.882 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 10.7 mm-40 -65.86 -49.25 68.82 Favored 'General case' 0 C--N 1.348 0.528 0 CA-C-N 115.873 -0.603 . . . . 74.35 110.317 175.332 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 60.9 m -53.64 -39.94 65.43 Favored 'General case' 0 N--CA 1.484 1.239 0 O-C-N 123.864 0.727 . . . . 50.15 111.163 177.784 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 47' ' ' VAL . . . . . 0.654 HG22 ' HB3' ' A' ' 10' ' ' ARG . 20.9 t -68.56 -49.09 68.4 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.004 0 C-N-CA 123.104 0.562 . . . . 71.42 111.575 -178.228 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 48' ' ' MET . . . . . . . . . . . . . 70.3 mtm -75.62 -14.38 60.37 Favored 'General case' 0 N--CA 1.483 1.187 0 C-N-CA 122.507 0.323 . . . . 62.13 111.761 -177.784 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 47.0 mt-10 -95.98 -11.98 25.71 Favored 'General case' 0 N--CA 1.481 1.089 0 C-N-CA 123.724 0.81 . . . . 75.13 110.555 171.82 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 14.9 tppt? -87.2 132.94 33.72 Favored 'General case' 0 N--CA 1.472 0.628 0 N-CA-C 108.883 -0.784 . . . . 74.41 108.883 177.331 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 3.4 tt0 -66.83 131.22 45.45 Favored 'General case' 0 C--O 1.242 0.683 0 N-CA-C 108.961 -0.755 . . . . 74.15 108.961 174.634 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 22.1 m -69.25 127.09 93.08 Favored Pre-proline 0 CA--C 1.551 0.995 0 O-C-N 123.579 0.55 . . . . 72.1 109.555 175.905 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_endo -66.32 155.02 71.98 Favored 'Trans proline' 0 C--N 1.377 2.079 0 C-N-CA 122.258 1.972 . . . . 71.13 112.031 178.97 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 17.4 Cg_exo -67.85 -47.74 1.75 Allowed 'Trans proline' 0 C--N 1.372 1.798 0 C-N-CA 122.941 2.427 . . . . 75.1 111.653 177.406 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . -63.2 85.0 0.05 OUTLIER Glycine 0 C--N 1.353 1.48 0 O-C-N 124.411 1.07 . . . . 62.35 113.593 -177.413 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 59.2 mt -133.69 102.12 4.4 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.683 0 C-N-CA 124.764 1.226 . . . . 75.42 108.399 178.081 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 57' ' ' THR . . . . . 0.425 ' H ' HD12 ' A' ' 60' ' ' ILE . 40.8 p -82.42 -173.62 4.69 Favored 'General case' 0 N--CA 1.471 0.601 0 C-N-CA 123.652 0.781 . . . . 64.1 110.31 175.192 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 22.0 tpt180 -63.01 -48.82 77.14 Favored 'General case' 0 CA--C 1.54 0.596 0 C-N-CA 123.608 0.763 . . . . 72.25 110.665 179.711 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 20.3 m -56.89 -43.98 81.86 Favored 'General case' 0 N--CA 1.479 1.017 0 C-N-CA 123.43 0.692 . . . . 65.42 111.375 179.389 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 60' ' ' ILE . . . . . 0.521 HG23 HD11 ' A' ' 8' ' ' ILE . 69.6 mt -64.08 -42.27 95.09 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.808 0 CA-C-N 115.114 -0.948 . . . . 74.11 110.328 178.728 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 60.4 tt0 -61.23 -41.27 96.58 Favored 'General case' 0 CA--C 1.546 0.79 0 C-N-CA 124.09 0.956 . . . . 71.4 111.087 179.729 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 14.1 m-20 -68.27 -43.3 78.11 Favored 'General case' 0 N--CA 1.479 0.986 0 C-N-CA 123.235 0.614 . . . . 73.55 111.632 179.503 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 63' ' ' MET . . . . . . . . . . . . . 73.3 mtm -65.88 -51.3 59.92 Favored 'General case' 0 N--CA 1.482 1.129 0 O-C-N 123.206 0.316 . . . . 54.41 111.109 179.864 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 64' ' ' VAL . . . . . 0.498 ' O ' HG13 ' A' ' 68' ' ' ILE . 53.1 t -59.98 -61.12 1.63 Allowed 'Isoleucine or valine' 0 CA--C 1.543 0.703 0 C-N-CA 123.707 0.803 . . . . 73.21 110.692 -179.522 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -64.67 -32.33 73.94 Favored 'General case' 0 N--CA 1.483 1.181 0 C-N-CA 122.697 0.399 . . . . 55.24 111.706 -176.708 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -65.94 -38.78 94.51 Favored Glycine 0 C--N 1.349 1.271 0 O-C-N 123.412 0.445 . . . . 30.25 112.049 177.798 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 67' ' ' TYR . . . . . 0.439 ' O ' HG22 ' A' ' 71' ' ' THR . 8.1 m-85 -74.9 -34.39 62.16 Favored 'General case' 0 N--CA 1.469 0.524 0 C-N-CA 123.439 0.696 . . . . 75.42 111.971 177.973 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 68' ' ' ILE . . . . . 0.549 ' O ' ' HG ' ' A' ' 72' ' ' LEU . 48.1 mt -61.93 -52.69 57.54 Favored 'Isoleucine or valine' 0 C--N 1.36 1.061 0 N-CA-C 108.353 -0.98 . . . . 61.43 108.353 174.369 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 69' ' ' LYS . . . . . 0.575 ' HB2' ' HE2' ' A' ' 106' ' ' TYR . 12.1 tmtt? -53.83 -47.76 70.58 Favored 'General case' 0 N--CA 1.479 1.017 0 C-N-CA 124.542 1.137 . . . . 75.13 109.772 -179.408 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 58.0 tt0 -55.49 -54.39 44.43 Favored 'General case' 0 C--N 1.347 0.485 0 CA-C-N 114.951 -1.022 . . . . 62.34 111.974 179.626 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 71' ' ' THR . . . . . 0.587 ' HB ' ' HA ' ' A' ' 15' ' ' ALA . 10.1 t -71.48 -27.09 62.99 Favored 'General case' 0 C--O 1.251 1.169 0 CA-C-N 116.22 -0.445 . . . . 74.21 110.891 -171.816 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 72' ' ' LEU . . . . . 0.549 ' HG ' ' O ' ' A' ' 68' ' ' ILE . 43.0 mt -62.07 -55.66 26.75 Favored 'General case' 0 C--N 1.358 0.955 0 O-C-N 123.789 0.681 . . . . 71.31 109.876 173.622 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -56.29 -52.56 64.06 Favored 'General case' 0 N--CA 1.489 1.487 0 O-C-N 124.253 0.971 . . . . 74.32 111.982 -179.787 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 74' ' ' ASN . . . . . 0.663 HD22 ' HA ' ' A' ' 19' ' ' GLN . 2.7 m-20 -58.74 -55.23 37.72 Favored 'General case' 0 C--O 1.248 0.992 0 O-C-N 124.036 0.835 . . . . 74.22 111.528 -174.786 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . 0.554 ' O ' ' HG2' ' A' ' 79' ' ' LYS . 14.5 tt0 -76.85 -15.4 59.72 Favored 'General case' 0 CA--C 1.545 0.763 0 CA-C-O 118.778 -0.63 . . . . 64.32 111.047 -177.107 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 76' ' ' GLN . . . . . 0.41 ' HA ' ' HG2' ' A' ' 79' ' ' LYS . 9.9 tt0 -69.46 -38.57 77.83 Favored 'General case' 0 N--CA 1.487 1.424 0 CA-C-N 118.464 0.575 . . . . 45.34 110.243 171.43 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 96.4 mt -60.62 -40.57 92.39 Favored 'General case' 0 N--CA 1.472 0.67 0 CA-C-N 115.592 -0.731 . . . . 63.34 109.087 171.031 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . 0.566 HD21 ' HA ' ' A' ' 22' ' ' LEU . 88.3 mt -63.76 -36.03 82.55 Favored 'General case' 0 CA--C 1.55 0.95 0 CA-C-O 118.44 -0.79 . . . . 71.12 112.262 171.634 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 79' ' ' LYS . . . . . 0.642 ' HE2' ' HB2' ' A' ' 99' ' ' GLN . 48.5 mmtm -59.34 -42.01 90.52 Favored 'General case' 0 N--CA 1.5 2.029 0 CA-C-N 119.032 0.833 . . . . 74.21 110.093 178.191 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -69.0 -43.08 74.84 Favored Glycine 0 C--N 1.349 1.297 0 CA-C-N 114.596 -1.184 . . . . 52.21 112.995 177.566 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -72.29 -33.04 67.12 Favored 'General case' 0 CA--C 1.555 1.169 0 C-N-CA 123.345 0.658 . . . . 73.51 110.436 -174.927 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 80.3 mt . . . . . 0 N--CA 1.477 0.894 0 C-N-CA 123.35 0.66 . . . . 53.12 111.053 -178.516 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 92' ' ' LEU . . . . . 0.496 ' HB2' ' HB ' ' A' ' 97' ' ' THR . 92.5 mt . . . . . 0 CA--C 1.543 0.697 0 CA-C-O 120.38 0.133 . . . . 71.31 111.294 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 39.0 mt -117.4 76.67 0.49 Allowed 'Isoleucine or valine' 0 CA--C 1.547 0.848 0 N-CA-C 109.042 -0.725 . . . . 71.2 109.042 -178.07 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 76.5 -77.03 1.45 Allowed Glycine 0 C--N 1.35 1.359 0 CA-C-N 115.388 -0.824 . . . . 71.31 113.604 174.272 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 2.9 mp0 -89.7 -173.13 3.82 Favored 'General case' 0 N--CA 1.478 0.952 0 C-N-CA 124.186 0.994 . . . . 75.04 110.364 178.71 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 58.8 m -63.27 95.8 0.1 Allowed 'General case' 0 CA--C 1.544 0.714 0 CA-C-N 115.063 -0.971 . . . . 61.13 110.367 174.618 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 97' ' ' THR . . . . . 0.496 ' HB ' ' HB2' ' A' ' 92' ' ' LEU . 87.3 m -100.37 -45.12 5.69 Favored 'General case' 0 C--O 1.215 -0.736 0 CA-C-N 114.796 -1.093 . . . . 73.24 111.272 -173.282 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 2.4 tmt_? -48.78 -58.24 5.11 Favored 'General case' 0 N--CA 1.482 1.165 0 C-N-CA 124.651 1.18 . . . . 71.3 112.077 -167.703 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 99' ' ' GLN . . . . . 0.642 ' HB2' ' HE2' ' A' ' 79' ' ' LYS . 48.3 tt0 -71.97 -43.81 64.57 Favored 'General case' 0 N--CA 1.472 0.659 0 N-CA-C 110.063 -0.347 . . . . 73.14 110.063 -169.729 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 29.4 ttpp -68.14 -47.38 68.25 Favored 'General case' 0 CA--C 1.546 0.802 0 C-N-CA 124.314 1.046 . . . . 64.15 111.192 -175.075 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 38.6 t -68.06 -42.6 80.22 Favored 'General case' 0 N--CA 1.472 0.671 0 C-N-CA 124.186 0.994 . . . . 62.34 110.729 -177.538 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 7.1 tp -74.56 -31.45 62.09 Favored 'General case' 0 CA--C 1.549 0.922 0 O-C-N 123.329 0.393 . . . . 71.21 111.187 -176.718 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 9.8 t30 -66.93 -41.89 86.25 Favored 'General case' 0 N--CA 1.48 1.059 0 C-N-CA 123.55 0.74 . . . . 44.43 109.696 173.938 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 27.7 t-20 -71.58 -28.88 64.13 Favored 'General case' 0 CA--C 1.54 0.568 0 CA-C-N 115.374 -0.83 . . . . 72.15 110.434 177.353 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -67.25 -38.79 85.74 Favored 'General case' 0 N--CA 1.48 1.037 0 C-N-CA 123.233 0.613 . . . . 74.54 110.454 176.627 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 106' ' ' TYR . . . . . 0.575 ' HE2' ' HB2' ' A' ' 69' ' ' LYS . 1.0 OUTLIER -61.21 -47.49 85.88 Favored 'General case' 0 C--N 1.355 0.814 0 N-CA-C 108.816 -0.809 . . . . 74.41 108.816 171.216 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -57.87 -40.69 93.47 Favored Glycine 0 C--N 1.351 1.386 0 O-C-N 123.732 0.645 . . . . 63.52 112.781 179.446 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 2.5 mmp_? -68.14 -34.17 75.84 Favored 'General case' 0 C--N 1.345 0.377 0 C-N-CA 123.508 0.723 . . . . 73.31 110.036 177.063 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 109' ' ' LEU . . . . . 0.445 ' HA ' ' N ' ' A' ' 114' ' ' LEU . 53.1 tp -68.37 -32.64 72.87 Favored 'General case' 0 N--CA 1.482 1.167 0 C-N-CA 123.174 0.589 . . . . 70.12 111.114 177.659 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 33.5 t -72.45 -42.49 64.95 Favored 'General case' 0 CA--C 1.541 0.598 0 CA-C-N 115.66 -0.7 . . . . 32.52 109.803 177.747 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . -88.71 -61.73 1.42 Allowed Glycine 0 C--N 1.355 1.611 0 C-N-CA 121.144 -0.551 . . . . 42.13 114.127 -175.773 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 112' ' ' MET . . . . . . . . . . . . . 2.2 mmm -93.72 -66.65 0.91 Allowed 'General case' 0 N--CA 1.486 1.338 0 CA-C-N 117.927 0.863 . . . . 71.34 112.904 -176.245 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 113' ' ' LEU . . . . . 0.424 ' HA ' HD23 ' A' ' 113' ' ' LEU . 6.6 mt 157.27 44.77 0.0 OUTLIER 'General case' 0 N--CA 1.503 2.183 0 C-N-CA 126.364 1.866 . . . . 64.23 108.6 -174.191 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 114' ' ' LEU . . . . . 0.445 ' N ' ' HA ' ' A' ' 109' ' ' LEU . 1.0 OUTLIER . . . . . 0 N--CA 1.503 2.194 0 C-N-CA 125.387 1.475 . . . . 74.1 111.788 174.703 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 1' ' ' MET . . . . . 0.516 ' HG3' HG23 ' A' ' 5' ' ' VAL . 21.0 ptt? . . . . . 0 N--CA 1.486 1.339 0 CA-C-O 120.963 0.411 . . . . 44.23 110.5 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 43.8 m -54.98 -61.32 2.39 Favored 'General case' 0 N--CA 1.482 1.141 0 C-N-CA 123.571 0.748 . . . . 53.04 112.344 -172.107 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 17.0 m -63.78 -28.66 70.02 Favored 'General case' 0 N--CA 1.478 0.962 0 C-N-CA 123.529 0.732 . . . . 74.04 112.341 -174.726 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 23.6 m -77.96 -36.56 48.98 Favored 'General case' 0 CA--C 1.549 0.934 0 C-N-CA 123.421 0.688 . . . . 51.23 111.569 -179.665 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 5' ' ' VAL . . . . . 0.516 HG23 ' HG3' ' A' ' 1' ' ' MET . 51.5 t -71.08 -38.62 72.22 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.107 0 C-N-CA 122.851 0.46 . . . . 73.44 110.143 175.76 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 6' ' ' GLU . . . . . 0.54 ' HB3' ' NH1' ' A' ' 10' ' ' ARG . 45.6 mm-40 -60.83 -45.38 94.68 Favored 'General case' 0 N--CA 1.478 0.931 0 O-C-N 123.639 0.587 . . . . 74.4 110.128 173.48 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 81.8 t80 -53.09 -58.75 5.94 Favored 'General case' 0 CA--C 1.549 0.934 0 C-N-CA 125.242 1.417 . . . . 73.2 111.534 176.646 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 8' ' ' ILE . . . . . 0.454 ' O ' ' HG3' ' A' ' 12' ' ' GLN . 70.6 mt -61.1 -45.78 97.91 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.015 0 O-C-N 123.766 0.666 . . . . 74.14 110.559 -178.78 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 4.3 t-20 -64.89 -29.54 70.5 Favored 'General case' 0 N--CA 1.482 1.132 0 C-N-CA 123.539 0.736 . . . . 65.55 111.379 -175.814 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . 0.593 ' HB3' HG22 ' A' ' 47' ' ' VAL . 68.3 mtt85 -78.55 -32.17 47.74 Favored 'General case' 0 CA--C 1.541 0.627 0 C-N-CA 122.986 0.514 . . . . 70.4 111.214 176.571 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 11' ' ' TRP . . . . . . . . . . . . . 85.5 m95 -71.01 -29.92 66.0 Favored 'General case' 0 N--CA 1.487 1.399 0 CA-C-N 117.53 0.15 . . . . 75.3 111.007 169.987 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . 0.578 ' HG2' ' CE2' ' A' ' 67' ' ' TYR . 42.9 mt-30 -63.61 -46.81 84.05 Favored 'General case' 0 C--N 1.357 0.928 0 N-CA-C 108.329 -0.989 . . . . 65.14 108.329 170.78 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 11.9 tpt180 -55.77 -49.45 73.12 Favored 'General case' 0 CA--C 1.544 0.73 0 O-C-N 124.375 1.047 . . . . 74.41 111.513 -179.118 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 54.1 mt -63.69 -45.07 98.41 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.292 0 O-C-N 123.271 0.357 . . . . 65.4 110.301 179.25 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . 0.594 ' HA ' ' HB ' ' A' ' 71' ' ' THR . . . -56.46 -45.45 80.87 Favored 'General case' 0 N--CA 1.485 1.321 0 C-N-CA 123.959 0.904 . . . . 43.54 111.664 178.572 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . 0.404 ' HG ' ' O ' ' A' ' 12' ' ' GLN . 95.9 mt -79.38 -35.75 40.28 Favored 'General case' 0 N--CA 1.478 0.933 0 CA-C-N 114.562 -1.199 . . . . 72.13 111.233 -172.352 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.472 ' O ' ' HG ' ' A' ' 21' ' ' LEU . 45.6 mt -66.21 -51.84 53.74 Favored 'General case' 0 N--CA 1.476 0.849 0 O-C-N 123.655 0.597 . . . . 74.44 109.774 178.518 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 88.4 p -62.21 -38.47 89.3 Favored 'General case' 0 N--CA 1.479 0.981 0 C-N-CA 123.229 0.612 . . . . 72.12 111.031 179.457 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 19' ' ' GLN . . . . . 0.4 HE21 ' NE2' ' A' ' 70' ' ' GLN . 6.7 tp-100 -58.61 -48.97 79.2 Favored 'General case' 0 C--N 1.356 0.867 0 O-C-N 123.873 0.733 . . . . 74.42 110.858 174.311 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . 0.412 ' O ' ' HG ' ' A' ' 24' ' ' LEU . 69.2 m -61.09 -46.6 89.98 Favored 'General case' 0 C--O 1.213 -0.851 0 O-C-N 124.053 0.846 . . . . 61.44 110.159 178.609 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . 0.472 ' HG ' ' O ' ' A' ' 17' ' ' LEU . 68.5 mt -68.44 -27.53 66.26 Favored 'General case' 0 CA--C 1.537 0.471 0 C-N-CA 123.328 0.651 . . . . 73.04 111.125 -175.469 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.686 ' HA ' HD21 ' A' ' 78' ' ' LEU . 46.4 tp -71.67 -48.36 48.07 Favored 'General case' 0 N--CA 1.477 0.875 0 N-CA-C 109.372 -0.603 . . . . 32.44 109.372 176.639 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . 0.432 ' HB3' ' NH1' ' A' ' 27' ' ' ARG . 45.1 mt-10 -54.51 -55.14 32.19 Favored 'General case' 0 N--CA 1.479 0.984 0 O-C-N 124.3 1.0 . . . . 62.53 110.365 175.656 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . 0.412 ' HG ' ' O ' ' A' ' 20' ' ' SER . 92.5 mt -61.13 -45.7 93.58 Favored 'General case' 0 CA--C 1.541 0.632 0 CA-C-N 114.683 -1.144 . . . . 62.55 111.356 -176.445 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . 0.515 ' HB2' HD21 ' A' ' 33' ' ' LEU . . . -59.62 -46.65 88.36 Favored 'General case' 0 N--CA 1.482 1.142 0 C-N-CA 122.969 0.507 . . . . 51.5 111.609 -178.94 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 95.1 mt-30 -72.4 -23.04 61.04 Favored 'General case' 0 CA--C 1.549 0.905 0 CA-C-N 115.589 -0.732 . . . . 65.44 111.551 -179.174 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 27' ' ' ARG . . . . . 0.432 ' NH1' ' HB3' ' A' ' 23' ' ' GLU . 88.9 mtt180 -88.63 4.85 45.59 Favored 'General case' 0 N--CA 1.487 1.387 0 C-N-CA 123.537 0.735 . . . . 74.21 111.776 174.304 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 77.76 9.18 87.07 Favored Glycine 0 C--N 1.352 1.466 0 N-CA-C 114.122 0.409 . . . . 62.43 114.122 177.117 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 29' ' ' GLU . . . . . 0.46 ' HB3' HD12 ' A' ' 32' ' ' LEU . 18.1 mm-40 -86.04 49.65 1.82 Allowed 'General case' 0 CA--C 1.556 1.18 0 C-N-CA 124.296 1.038 . . . . 64.2 110.259 178.287 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 30' ' ' TRP . . . . . 0.485 ' HA ' HD13 ' A' ' 33' ' ' LEU . 74.8 m95 -62.5 -30.47 71.3 Favored 'General case' 0 N--CA 1.485 1.297 0 C-N-CA 123.376 0.67 . . . . 73.34 111.027 -176.406 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 17.2 m-20 -56.27 -44.72 80.01 Favored 'General case' 0 N--CA 1.472 0.657 0 C-N-CA 123.781 0.833 . . . . 52.25 111.019 176.225 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 0.46 HD12 ' HB3' ' A' ' 29' ' ' GLU . 96.2 mt -64.21 -30.1 71.17 Favored 'General case' 0 CA--C 1.552 1.033 0 CA-C-N 115.755 -0.657 . . . . 72.11 110.927 -179.912 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . 0.515 HD21 ' HB2' ' A' ' 25' ' ' ALA . 8.4 mp -66.75 -41.93 86.99 Favored 'General case' 0 N--CA 1.491 1.584 0 C-N-CA 122.536 0.335 . . . . 70.1 110.574 171.389 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 71.8 mt -59.61 -45.43 91.97 Favored 'General case' 0 N--CA 1.484 1.241 0 C-N-CA 123.106 0.563 . . . . 74.4 111.456 -179.217 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 10.4 mp0 -71.22 -28.16 64.0 Favored 'General case' 0 N--CA 1.483 1.213 0 C-N-CA 123.188 0.595 . . . . 71.33 111.875 177.466 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 86.3 mm-40 -88.88 -11.72 43.81 Favored 'General case' 0 N--CA 1.485 1.311 0 N-CA-C 112.907 0.706 . . . . 64.52 112.907 179.027 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . 0.451 ' O ' ' HG ' ' A' ' 41' ' ' LEU . 38.5 tt0 -47.52 -59.66 3.08 Favored 'General case' 0 N--CA 1.481 1.118 0 C-N-CA 124.109 0.964 . . . . 72.44 112.394 -178.696 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 73.9 t -57.52 -41.06 78.1 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.28 0 C-N-CA 123.255 0.622 . . . . 72.22 111.375 -179.365 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 42.9 m -61.98 -43.74 98.19 Favored 'General case' 0 CA--C 1.543 0.71 0 C-N-CA 123.36 0.664 . . . . 62.11 111.431 179.351 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 47.6 t80 -69.34 -48.5 61.2 Favored 'General case' 0 N--CA 1.468 0.469 0 CA-C-N 115.567 -0.742 . . . . 72.13 110.471 -176.476 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . 0.472 HD22 HD21 ' A' ' 92' ' ' LEU . 46.5 mt -66.08 -44.51 84.25 Favored 'General case' 0 CA--C 1.538 0.502 0 O-C-N 124.485 1.116 . . . . 65.01 110.408 -176.371 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 48.3 tt0 -58.95 -49.95 75.89 Favored 'General case' 0 N--CA 1.473 0.681 0 O-C-N 123.695 0.622 . . . . 73.14 110.132 178.576 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 43' ' ' SER . . . . . 0.563 ' O ' HG23 ' A' ' 47' ' ' VAL . 69.5 m -58.93 -55.29 37.02 Favored 'General case' 0 C--N 1.354 0.761 0 O-C-N 123.803 0.689 . . . . 64.31 111.808 -178.989 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 10.1 tt -60.38 -42.44 90.9 Favored 'Isoleucine or valine' 0 CA--C 1.557 1.236 0 C-N-CA 122.854 0.461 . . . . 73.3 111.395 -173.994 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . 0.434 ' O ' ' HG3' ' A' ' 49' ' ' GLU . 8.6 mm-40 -61.57 -49.25 77.42 Favored 'General case' 0 N--CA 1.48 1.066 0 C-N-CA 123.056 0.542 . . . . 72.21 111.035 176.224 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 46' ' ' THR . . . . . 0.542 ' O ' ' HD3' ' A' ' 50' ' ' LYS . 95.9 m -57.53 -43.12 84.08 Favored 'General case' 0 N--CA 1.479 1.003 0 C-N-CA 123.802 0.841 . . . . 63.55 111.825 -177.141 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 47' ' ' VAL . . . . . 0.593 HG22 ' HB3' ' A' ' 10' ' ' ARG . 30.5 t -67.82 -42.56 86.07 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.717 0 C-N-CA 122.868 0.467 . . . . 73.34 110.163 -179.543 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 48' ' ' MET . . . . . . . . . . . . . 79.1 mtm -70.58 -15.57 62.77 Favored 'General case' 0 N--CA 1.48 1.074 0 N-CA-C 112.286 0.476 . . . . 75.14 112.286 177.809 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . 0.434 ' HG3' ' O ' ' A' ' 45' ' ' GLU . 62.5 mt-10 -73.29 -35.99 66.22 Favored 'General case' 0 N--CA 1.488 1.463 0 CA-C-N 118.152 0.433 . . . . 61.44 111.436 171.664 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . 0.542 ' HD3' ' O ' ' A' ' 46' ' ' THR . 10.8 mptt -78.32 135.86 37.59 Favored 'General case' 0 N--CA 1.483 1.2 0 C-N-CA 123.162 0.585 . . . . 74.31 111.192 -170.552 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 8.0 tt0 -69.15 148.29 50.13 Favored 'General case' 0 N--CA 1.474 0.747 0 C-N-CA 124.276 1.03 . . . . 71.51 110.791 177.632 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 25.1 m -65.7 127.03 92.75 Favored Pre-proline 0 CA--C 1.555 1.137 0 C-N-CA 123.893 0.877 . . . . 61.44 110.643 178.296 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 15.3 Cg_exo -69.84 151.32 68.56 Favored 'Trans proline' 0 C--N 1.38 2.235 0 C-N-CA 121.912 1.741 . . . . 64.43 111.372 173.01 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 41.7 Cg_endo -67.81 -44.12 4.5 Favored 'Trans proline' 0 C--N 1.372 1.774 0 C-N-CA 122.999 2.466 . . . . 74.5 112.035 173.832 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . -76.68 66.86 2.68 Favored Glycine 0 C--N 1.352 1.427 0 CA-C-N 116.029 -0.532 . . . . 50.02 113.645 -178.349 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 56' ' ' ILE . . . . . 0.426 HG23 HG22 ' A' ' 60' ' ' ILE . 58.2 mt -110.0 106.45 20.75 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.653 0 N-CA-C 107.41 -1.329 . . . . 73.22 107.41 170.107 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 57' ' ' THR . . . . . 0.434 ' H ' HD12 ' A' ' 60' ' ' ILE . 31.2 p -75.08 178.8 5.41 Favored 'General case' 0 N--CA 1.473 0.723 0 C-N-CA 122.911 0.484 . . . . 73.35 110.244 -179.314 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 40.8 tpt85 -64.08 -46.53 83.88 Favored 'General case' 0 N--CA 1.471 0.606 0 C-N-CA 123.273 0.629 . . . . 70.05 109.961 -179.964 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 31.8 m -63.01 -40.57 98.17 Favored 'General case' 0 CA--C 1.547 0.827 0 CA-C-N 115.596 -0.729 . . . . 70.22 111.34 178.264 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 60' ' ' ILE . . . . . 0.434 HD12 ' H ' ' A' ' 57' ' ' THR . 74.8 mt -63.16 -41.41 92.72 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.163 0 C-N-CA 122.962 0.505 . . . . 60.44 110.608 176.064 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 61.1 tt0 -59.82 -42.65 93.99 Favored 'General case' 0 N--CA 1.476 0.859 0 C-N-CA 123.641 0.776 . . . . 73.3 110.429 179.493 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 50.0 m-20 -68.23 -45.65 72.7 Favored 'General case' 0 N--CA 1.48 1.025 0 O-C-N 123.563 0.54 . . . . 75.02 112.227 178.374 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 63' ' ' MET . . . . . . . . . . . . . 65.4 mtm -64.24 -49.93 69.99 Favored 'General case' 0 N--CA 1.486 1.337 0 C-N-CA 122.331 0.253 . . . . 72.31 110.876 -177.281 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 64' ' ' VAL . . . . . 0.503 ' O ' HG13 ' A' ' 68' ' ' ILE . 82.1 t -60.46 -54.99 27.5 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.815 0 O-C-N 124.171 0.919 . . . . 64.14 110.945 178.238 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -65.99 -28.8 69.15 Favored 'General case' 0 N--CA 1.494 1.765 0 CA-C-N 118.492 0.587 . . . . 74.5 112.083 -178.817 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -69.23 -38.86 82.63 Favored Glycine 0 C--N 1.343 0.966 0 N-CA-C 111.386 -0.685 . . . . 71.31 111.386 176.407 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 67' ' ' TYR . . . . . 0.578 ' CE2' ' HG2' ' A' ' 12' ' ' GLN . 10.8 m-85 -71.0 -36.01 72.29 Favored 'General case' 0 N--CA 1.467 0.413 0 C-N-CA 123.605 0.762 . . . . 64.11 111.134 175.059 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 68' ' ' ILE . . . . . 0.562 ' O ' ' HG ' ' A' ' 72' ' ' LEU . 60.8 mt -63.18 -48.54 87.14 Favored 'Isoleucine or valine' 0 C--N 1.36 1.042 0 N-CA-C 108.649 -0.871 . . . . 73.2 108.649 176.22 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 69' ' ' LYS . . . . . 0.616 ' HB2' ' HE2' ' A' ' 106' ' ' TYR . 0.7 OUTLIER -57.67 -48.22 80.12 Favored 'General case' 0 C--N 1.356 0.861 0 C-N-CA 123.58 0.752 . . . . 72.3 110.297 -179.06 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 70' ' ' GLN . . . . . 0.4 ' NE2' HE21 ' A' ' 19' ' ' GLN . 59.7 tt0 -60.22 -45.7 92.32 Favored 'General case' 0 C--N 1.347 0.489 0 O-C-N 124.491 1.119 . . . . 65.52 110.979 -179.026 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 71' ' ' THR . . . . . 0.594 ' HB ' ' HA ' ' A' ' 15' ' ' ALA . 15.1 t -77.9 -22.97 48.87 Favored 'General case' 0 C--N 1.354 0.779 0 CA-C-O 119.329 -0.367 . . . . 74.12 110.257 -175.554 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 72' ' ' LEU . . . . . 0.562 ' HG ' ' O ' ' A' ' 68' ' ' ILE . 28.6 mt -63.81 -50.94 66.97 Favored 'General case' 0 C--N 1.359 0.986 0 N-CA-C 108.524 -0.917 . . . . 74.13 108.524 171.831 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 73' ' ' ASP . . . . . 0.477 ' O ' ' HG ' ' A' ' 77' ' ' LEU . 60.6 m-20 -62.4 -53.75 50.42 Favored 'General case' 0 N--CA 1.476 0.842 0 O-C-N 124.363 1.039 . . . . 72.32 111.264 -178.349 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 74' ' ' ASN . . . . . 0.469 ' HA ' HD22 ' A' ' 22' ' ' LEU . 74.7 m-20 -54.32 -53.93 47.25 Favored 'General case' 0 N--CA 1.487 1.403 0 C-N-CA 123.647 0.779 . . . . 61.43 110.825 -178.904 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 43.1 tt0 -66.47 -31.03 71.51 Favored 'General case' 0 CA--C 1.549 0.942 0 C-N-CA 123.802 0.841 . . . . 70.15 111.548 -178.46 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 76' ' ' GLN . . . . . 0.495 ' HB2' ' O ' ' A' ' 72' ' ' LEU . 8.1 tt0 -74.86 -36.36 62.32 Favored 'General case' 0 N--CA 1.482 1.155 0 N-CA-C 109.906 -0.405 . . . . 52.3 109.906 -178.597 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . 0.477 ' HG ' ' O ' ' A' ' 73' ' ' ASP . 89.5 mt -67.38 -40.7 85.7 Favored 'General case' 0 C--N 1.351 0.654 0 O-C-N 123.84 0.712 . . . . 64.25 109.347 176.602 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . 0.686 HD21 ' HA ' ' A' ' 22' ' ' LEU . 73.0 mt -63.82 -62.85 1.38 Allowed 'General case' 0 N--CA 1.482 1.131 0 C-N-CA 123.915 0.886 . . . . 44.33 112.242 177.739 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 79' ' ' LYS . . . . . 0.443 ' HA ' HD12 ' A' ' 82' ' ' LEU . 1.0 OUTLIER -66.43 -32.89 74.54 Favored 'General case' 0 N--CA 1.476 0.873 0 C-N-CA 123.558 0.743 . . . . 72.2 110.479 -174.442 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -65.85 -40.68 95.65 Favored Glycine 0 C--N 1.349 1.262 0 CA-C-N 115.832 -0.622 . . . . 62.31 112.353 173.843 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 81' ' ' LEU . . . . . 0.433 ' HB2' ' O ' ' A' ' 77' ' ' LEU . 6.0 tt -62.13 -40.22 95.18 Favored 'General case' 0 N--CA 1.487 1.377 0 C-N-CA 124.217 1.007 . . . . 72.13 109.612 175.743 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 82' ' ' LEU . . . . . 0.443 HD12 ' HA ' ' A' ' 79' ' ' LYS . 99.1 mt . . . . . 0 C--N 1.358 0.96 0 O-C-N 124.07 0.856 . . . . 72.42 110.11 -179.391 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 92' ' ' LEU . . . . . 0.472 HD21 HD22 ' A' ' 41' ' ' LEU . 59.5 mt . . . . . 0 N--CA 1.484 1.254 0 N-CA-C 108.317 -0.994 . . . . 60.23 108.317 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 93' ' ' ILE . . . . . 0.539 ' HB ' HG21 ' A' ' 97' ' ' THR . 68.7 mt -51.26 -40.88 23.66 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.61 0 CA-C-O 121.364 0.602 . . . . 55.31 110.401 167.072 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 179.07 -174.69 46.7 Favored Glycine 0 C--O 1.242 0.63 0 CA-C-N 114.724 -1.125 . . . . 25.24 110.711 175.211 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 18.3 mm100 -75.82 149.53 37.87 Favored 'General case' 0 CA--C 1.541 0.631 0 N-CA-C 110.172 -0.307 . . . . 60.53 110.172 174.722 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 29.9 t 75.77 -16.6 0.58 Allowed 'General case' 0 N--CA 1.484 1.247 0 C-N-CA 125.865 1.666 . . . . 44.02 113.119 -174.554 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 97' ' ' THR . . . . . 0.539 HG21 ' HB ' ' A' ' 93' ' ' ILE . 86.7 m -59.52 -36.86 76.93 Favored 'General case' 0 N--CA 1.477 0.89 0 C-N-CA 123.4 0.68 . . . . 70.24 112.186 -176.109 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 98' ' ' ARG . . . . . 0.547 ' HG3' ' H ' ' A' ' 99' ' ' GLN . 0.0 OUTLIER -56.42 -57.28 12.98 Favored 'General case' 0 CA--C 1.554 1.119 0 O-C-N 123.434 0.459 . . . . 74.32 111.665 -178.936 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 99' ' ' GLN . . . . . 0.547 ' H ' ' HG3' ' A' ' 98' ' ' ARG . 23.1 tm0? -78.64 -42.48 28.65 Favored 'General case' 0 C--N 1.349 0.558 0 N-CA-C 109.28 -0.637 . . . . 73.12 109.28 -170.643 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 4.5 tppp? -62.53 -52.36 63.77 Favored 'General case' 0 CA--C 1.539 0.525 0 O-C-N 123.707 0.629 . . . . 74.55 110.992 -176.592 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 33.3 t -72.89 -36.87 67.41 Favored 'General case' 0 CA--C 1.543 0.692 0 O-C-N 123.61 0.569 . . . . 74.51 111.449 -174.973 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 5.0 tp -75.98 -32.81 59.65 Favored 'General case' 0 N--CA 1.487 1.403 0 CA-C-N 118.21 0.459 . . . . 63.21 111.4 -177.743 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 25.9 t-20 -78.91 -31.03 45.14 Favored 'General case' 0 N--CA 1.489 1.517 0 C-N-CA 123.326 0.65 . . . . 62.55 110.35 176.87 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 53.1 t30 -66.03 -38.75 89.21 Favored 'General case' 0 N--CA 1.487 1.393 0 C-N-CA 123.604 0.761 . . . . 75.45 109.384 171.859 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -60.49 -48.57 81.18 Favored 'General case' 0 CA--C 1.54 0.586 0 CA-C-N 115.002 -0.999 . . . . 73.52 110.522 175.459 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 106' ' ' TYR . . . . . 0.616 ' HE2' ' HB2' ' A' ' 69' ' ' LYS . 6.3 t80 -56.28 -45.07 80.29 Favored 'General case' 0 C--N 1.355 0.84 0 O-C-N 123.62 0.575 . . . . 72.42 110.18 174.702 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -58.32 -43.56 95.55 Favored Glycine 0 C--N 1.354 1.568 0 O-C-N 123.842 0.714 . . . . 71.33 112.882 -177.285 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 99.7 mtt180 -68.47 -37.93 80.6 Favored 'General case' 0 CA--C 1.544 0.715 0 C-N-CA 123.196 0.598 . . . . 73.52 111.116 177.615 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 109' ' ' LEU . . . . . 0.492 ' HA ' ' N ' ' A' ' 114' ' ' LEU . 35.8 tp -72.84 -31.15 64.57 Favored 'General case' 0 N--CA 1.488 1.449 0 C-N-CA 123.06 0.544 . . . . 65.42 111.554 -178.383 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 33.3 t -79.87 -32.55 40.43 Favored 'General case' 0 CA--C 1.537 0.48 0 C-N-CA 123.789 0.836 . . . . 65.05 109.337 178.148 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . -87.9 -64.35 1.36 Allowed Glycine 0 C--N 1.36 1.904 0 CA-C-O 119.164 -0.798 . . . . 62.21 113.606 -178.439 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 112' ' ' MET . . . . . . . . . . . . . 21.7 mmm -96.98 -69.0 0.77 Allowed 'General case' 0 N--CA 1.489 1.518 0 CA-C-N 118.34 1.07 . . . . 74.04 113.194 178.058 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 13.6 tp 172.03 25.7 0.0 OUTLIER 'General case' 0 N--CA 1.495 1.786 0 O-C-N 123.77 0.669 . . . . 74.24 110.888 -173.3 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 114' ' ' LEU . . . . . 0.492 ' N ' ' HA ' ' A' ' 109' ' ' LEU . 41.5 tp . . . . . 0 N--CA 1.501 2.092 0 C-N-CA 126.571 1.948 . . . . 71.14 111.9 -177.443 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 1' ' ' MET . . . . . 0.605 ' HG2' ' HB ' ' A' ' 4' ' ' THR . 0.0 OUTLIER . . . . . 0 CA--C 1.55 0.96 0 N-CA-C 109.362 -0.607 . . . . 74.14 109.362 . . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 42.2 p -57.81 -48.05 80.85 Favored 'General case' 0 N--CA 1.479 1.011 0 C-N-CA 124.411 1.084 . . . . 62.24 113.555 -166.531 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 36.2 m -66.08 -38.52 88.49 Favored 'General case' 0 N--CA 1.476 0.873 0 O-C-N 123.522 0.514 . . . . 70.54 111.543 -176.078 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 4' ' ' THR . . . . . 0.618 ' HA ' ' HG3' ' A' ' 53' ' ' PRO . 15.0 m -76.24 -38.65 56.07 Favored 'General case' 0 N--CA 1.475 0.822 0 O-C-N 123.576 0.547 . . . . 62.25 112.155 -176.575 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 85.5 t -67.86 -40.52 83.7 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.87 0 N-CA-C 109.612 -0.514 . . . . 74.33 109.612 177.109 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 6' ' ' GLU . . . . . 0.505 ' O ' ' HG3' ' A' ' 10' ' ' ARG . 2.6 tm-20 -64.67 -36.83 85.53 Favored 'General case' 0 CA--C 1.549 0.922 0 C-N-CA 123.666 0.786 . . . . 73.34 109.854 175.694 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 7' ' ' PHE . . . . . 0.44 ' HZ ' HD13 ' A' ' 114' ' ' LEU . 81.3 t80 -64.26 -47.21 80.49 Favored 'General case' 0 N--CA 1.481 1.083 0 C-N-CA 124.764 1.225 . . . . 75.35 111.851 177.342 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 8' ' ' ILE . . . . . 0.436 ' O ' ' HG3' ' A' ' 12' ' ' GLN . 79.1 mt -62.99 -39.71 86.23 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.91 0 N-CA-C 109.042 -0.725 . . . . 41.42 109.042 175.588 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 2.4 t-20 -61.06 -35.54 77.21 Favored 'General case' 0 N--CA 1.484 1.231 0 C-N-CA 124.695 1.198 . . . . 61.21 111.151 178.146 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . 0.505 ' HG3' ' O ' ' A' ' 6' ' ' GLU . 42.1 mtt180 -59.15 -56.7 18.86 Favored 'General case' 0 N--CA 1.474 0.757 0 C-N-CA 123.473 0.709 . . . . 65.01 109.269 172.416 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 11' ' ' TRP . . . . . 0.424 ' CD1' HG13 ' A' ' 64' ' ' VAL . 93.8 m95 -69.68 -23.47 63.46 Favored 'General case' 0 N--CA 1.468 0.468 0 CA-C-N 114.966 -1.015 . . . . 74.52 112.758 -175.704 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . 0.436 ' HG3' ' O ' ' A' ' 8' ' ' ILE . 59.3 mt-30 -66.84 -50.37 62.77 Favored 'General case' 0 N--CA 1.473 0.724 0 N-CA-C 108.141 -1.059 . . . . 71.12 108.141 172.436 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . 0.575 ' HE ' HD11 ' A' ' 17' ' ' LEU . 13.2 tpt180 -57.25 -47.9 80.21 Favored 'General case' 0 CA--C 1.549 0.922 0 O-C-N 124.249 0.968 . . . . 71.45 111.221 -177.758 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 14' ' ' ILE . . . . . 0.661 HD11 HG21 ' A' ' 47' ' ' VAL . 49.0 mt -67.95 -46.17 82.45 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.063 0 CA-C-N 115.744 -0.662 . . . . 72.03 110.247 -177.309 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . 0.431 ' HB1' ' OE1' ' A' ' 70' ' ' GLN . . . -61.55 -44.79 96.4 Favored 'General case' 0 N--CA 1.484 1.265 0 C-N-CA 123.614 0.766 . . . . 64.11 112.038 -178.449 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 85.4 mt -71.18 -44.68 64.98 Favored 'General case' 0 N--CA 1.477 0.897 0 CA-C-N 114.838 -1.073 . . . . 64.24 110.843 -175.541 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.575 HD11 ' HE ' ' A' ' 13' ' ' ARG . 43.0 mt -72.24 -31.94 66.25 Favored 'General case' 0 N--CA 1.477 0.912 0 CA-C-O 118.874 -0.584 . . . . 71.01 112.025 -178.094 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 83.0 p -70.71 -39.45 73.41 Favored 'General case' 0 N--CA 1.486 1.34 0 CA-C-N 118.406 0.548 . . . . 73.1 110.284 175.944 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 19' ' ' GLN . . . . . 0.435 HE21 HE21 ' A' ' 70' ' ' GLN . 5.9 tp-100 -57.89 -43.6 86.22 Favored 'General case' 0 C--O 1.25 1.083 0 CA-C-N 115.344 -0.844 . . . . 75.35 110.079 172.183 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 49.8 m -60.01 -57.88 10.94 Favored 'General case' 0 C--N 1.353 0.753 0 CA-C-N 114.832 -1.076 . . . . 73.01 109.98 176.772 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . 0.539 HD22 ' HG ' ' A' ' 33' ' ' LEU . 65.1 mt -57.64 -33.77 68.64 Favored 'General case' 0 N--CA 1.479 0.989 0 C-N-CA 123.607 0.763 . . . . 63.15 111.241 -175.421 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.65 ' HA ' HD21 ' A' ' 78' ' ' LEU . 64.4 tp -63.34 -61.55 2.27 Favored 'General case' 0 C--O 1.251 1.149 0 O-C-N 123.791 0.682 . . . . 72.31 110.315 177.375 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . 0.468 ' O ' ' HG3' ' A' ' 27' ' ' ARG . 94.6 mt-10 -57.81 -48.0 80.99 Favored 'General case' 0 C--N 1.356 0.88 0 O-C-N 124.178 0.924 . . . . 74.52 110.58 -177.392 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 95.7 mt -62.02 -39.44 92.27 Favored 'General case' 0 N--CA 1.476 0.861 0 C-N-CA 124.558 1.143 . . . . 71.55 111.757 -176.605 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . 0.433 ' HB2' HD21 ' A' ' 33' ' ' LEU . . . -61.11 -44.36 97.47 Favored 'General case' 0 N--CA 1.484 1.228 0 CA-C-O 121.138 0.494 . . . . 53.23 110.904 175.958 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 81.5 mt-30 -68.03 -32.24 72.47 Favored 'General case' 0 CA--C 1.551 0.997 0 CA-C-N 114.937 -1.029 . . . . 70.24 111.471 177.3 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 27' ' ' ARG . . . . . 0.468 ' HG3' ' O ' ' A' ' 23' ' ' GLU . 89.3 mtt-85 -74.67 -20.06 60.02 Favored 'General case' 0 N--CA 1.486 1.366 0 C-N-CA 123.74 0.816 . . . . 74.11 111.226 178.811 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 94.44 5.68 61.66 Favored Glycine 0 C--N 1.351 1.385 0 O-C-N 123.272 0.358 . . . . 71.22 112.72 -176.237 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 29' ' ' GLU . . . . . 0.419 ' HG2' ' HB2' ' A' ' 27' ' ' ARG . 7.6 mm-40 -83.07 52.79 2.26 Favored 'General case' 0 CA--C 1.549 0.94 0 C-N-CA 124.058 0.943 . . . . 71.03 110.541 178.989 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 30' ' ' TRP . . . . . 0.468 ' O ' ' HG ' ' A' ' 34' ' ' LEU . 94.6 m95 -66.87 -23.81 66.06 Favored 'General case' 0 N--CA 1.473 0.695 0 C-N-CA 123.56 0.744 . . . . 71.43 111.454 -178.936 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 15.2 m-20 -54.22 -46.67 72.57 Favored 'General case' 0 N--CA 1.478 0.928 0 C-N-CA 123.754 0.821 . . . . 74.22 110.078 172.098 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 93.5 mt -63.26 -33.83 76.35 Favored 'General case' 0 C--O 1.215 -0.725 0 CA-C-N 114.905 -1.043 . . . . 75.05 110.81 178.069 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . 0.539 ' HG ' HD22 ' A' ' 21' ' ' LEU . 8.1 mp -68.36 -39.89 81.66 Favored 'General case' 0 N--CA 1.488 1.457 0 CA-C-N 118.053 0.388 . . . . 73.31 111.202 174.138 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.468 ' HG ' ' O ' ' A' ' 30' ' ' TRP . 93.8 mt -65.03 -38.37 90.67 Favored 'General case' 0 N--CA 1.487 1.386 0 C-N-CA 123.555 0.742 . . . . 62.51 111.542 -177.681 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 1.7 mp0 -77.22 -56.86 4.2 Favored 'General case' 0 N--CA 1.475 0.809 0 CA-C-N 116.068 -0.514 . . . . 64.53 110.643 176.986 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 82.3 mm-40 -66.81 -14.56 62.8 Favored 'General case' 0 N--CA 1.484 1.227 0 CA-C-O 118.726 -0.654 . . . . 50.15 112.6 -174.956 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 42.9 tt0 -52.79 -57.8 8.99 Favored 'General case' 0 N--CA 1.481 1.115 0 C-N-CA 123.666 0.786 . . . . 74.55 111.308 175.577 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 61.5 t -56.97 -43.88 81.61 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.163 0 C-N-CA 123.515 0.726 . . . . 70.22 111.318 -175.078 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 18.5 p -74.88 -45.49 42.59 Favored 'General case' 0 N--CA 1.477 0.91 0 C-N-CA 123.643 0.777 . . . . 63.14 112.343 -175.255 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 27.0 t80 -62.9 -42.78 99.9 Favored 'General case' 0 N--CA 1.482 1.155 0 C-N-CA 124.02 0.928 . . . . 73.54 110.821 179.963 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . 0.682 ' HA ' HG22 ' A' ' 44' ' ' ILE . 88.5 mt -78.47 -31.43 47.88 Favored 'General case' 0 C--O 1.222 -0.378 0 CA-C-N 115.556 -0.747 . . . . 64.33 111.175 -176.444 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 23.4 tm0? -59.59 -43.6 93.63 Favored 'General case' 0 N--CA 1.476 0.864 0 N-CA-C 108.831 -0.803 . . . . 71.15 108.831 170.005 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 43' ' ' SER . . . . . 0.565 ' O ' HG23 ' A' ' 47' ' ' VAL . 61.6 m -60.59 -55.08 37.68 Favored 'General case' 0 C--N 1.353 0.728 0 O-C-N 123.946 0.779 . . . . 72.33 111.106 178.478 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 44' ' ' ILE . . . . . 0.682 HG22 ' HA ' ' A' ' 41' ' ' LEU . 17.2 tt -65.42 -34.51 70.92 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.329 0 C-N-CA 123.019 0.528 . . . . 74.0 111.697 -172.961 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 21.6 mm-40 -61.27 -50.35 73.38 Favored 'General case' 0 C--N 1.356 0.882 0 C-N-CA 123.494 0.718 . . . . 63.35 109.836 172.078 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 46' ' ' THR . . . . . 0.422 ' O ' ' HB2' ' A' ' 50' ' ' LYS . 97.5 m -54.12 -39.02 66.04 Favored 'General case' 0 N--CA 1.481 1.105 0 C-N-CA 124.352 1.061 . . . . 72.31 111.534 177.419 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 47' ' ' VAL . . . . . 0.661 HG21 HD11 ' A' ' 14' ' ' ILE . 84.5 t -68.57 -45.0 82.41 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.969 0 C-N-CA 124.005 0.922 . . . . 75.4 111.447 -178.317 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 48' ' ' MET . . . . . . . . . . . . . 77.5 mtm -67.34 -31.49 71.79 Favored 'General case' 0 N--CA 1.482 1.149 0 O-C-N 123.491 0.494 . . . . 73.55 111.29 178.214 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 48.2 mt-10 -72.2 -31.2 65.67 Favored 'General case' 0 N--CA 1.481 1.086 0 C-N-CA 123.652 0.781 . . . . 60.32 110.975 174.576 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . 0.422 ' HB2' ' O ' ' A' ' 46' ' ' THR . 4.6 tppt? -79.5 160.44 26.53 Favored 'General case' 0 N--CA 1.474 0.755 0 C-N-CA 123.151 0.58 . . . . 44.01 111.858 -168.871 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 8.7 tt0 -81.95 124.87 30.13 Favored 'General case' 0 C--O 1.241 0.642 0 CA-C-N 115.165 -0.925 . . . . 64.3 110.814 -176.968 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 52' ' ' THR . . . . . 0.791 HG21 ' HB3' ' A' ' 114' ' ' LEU . 96.7 m -69.93 122.85 87.35 Favored Pre-proline 0 CA--C 1.551 0.984 0 N-CA-C 109.162 -0.681 . . . . 74.03 109.162 166.765 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 53' ' ' PRO . . . . . 0.618 ' HG3' ' HA ' ' A' ' 4' ' ' THR . 72.0 Cg_endo -69.28 156.91 63.23 Favored 'Trans proline' 0 C--N 1.369 1.645 0 C-N-CA 123.002 2.468 . . . . 62.24 112.573 178.458 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 56.7 Cg_endo -70.7 -44.61 1.36 Allowed 'Trans proline' 0 C--N 1.371 1.723 0 C-N-CA 122.526 2.151 . . . . 74.43 111.471 172.194 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . -75.04 68.93 1.94 Allowed Glycine 0 C--N 1.352 1.419 0 N-CA-C 115.048 0.779 . . . . 41.01 115.048 -172.087 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 56' ' ' ILE . . . . . 0.527 HG23 HG22 ' A' ' 60' ' ' ILE . 84.5 mt -110.24 108.46 25.48 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.656 0 N-CA-C 107.579 -1.267 . . . . 72.34 107.579 176.53 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 42.8 p -82.27 -172.45 3.99 Favored 'General case' 0 N--CA 1.483 1.176 0 C-N-CA 123.016 0.526 . . . . 71.33 110.552 -177.625 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 29.8 tpt85 -63.06 -60.33 3.59 Favored 'General case' 0 N--CA 1.475 0.794 0 C-N-CA 123.275 0.63 . . . . 64.14 110.639 -178.771 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 21.0 m -62.4 -33.6 75.09 Favored 'General case' 0 N--CA 1.475 0.798 0 C-N-CA 123.595 0.758 . . . . 51.34 111.731 -178.101 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 60' ' ' ILE . . . . . 0.527 HG22 HG23 ' A' ' 56' ' ' ILE . 74.4 mt -65.07 -43.68 95.85 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.81 0 C-N-CA 122.921 0.488 . . . . 55.42 110.125 175.087 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 60.3 tt0 -64.55 -36.64 84.89 Favored 'General case' 0 N--CA 1.48 1.072 0 C-N-CA 123.322 0.649 . . . . 73.12 111.036 179.196 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 26.5 m-20 -65.64 -46.66 78.36 Favored 'General case' 0 N--CA 1.474 0.731 0 C-N-CA 123.001 0.52 . . . . 75.32 110.853 176.976 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 63' ' ' MET . . . . . . . . . . . . . 73.3 mtm -65.96 -46.67 77.27 Favored 'General case' 0 N--CA 1.476 0.867 0 O-C-N 123.307 0.38 . . . . 72.15 111.014 -179.692 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 64' ' ' VAL . . . . . 0.494 ' O ' HG13 ' A' ' 68' ' ' ILE . 52.0 t -63.78 -60.55 2.58 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.566 0 C-N-CA 123.474 0.709 . . . . 74.41 110.615 -178.535 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . 0.571 ' HB2' HD23 ' A' ' 109' ' ' LEU . . . -60.59 -33.11 72.25 Favored 'General case' 0 N--CA 1.487 1.397 0 O-C-N 123.403 0.44 . . . . 62.53 111.519 -179.896 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -65.03 -38.04 94.95 Favored Glycine 0 C--N 1.347 1.146 0 CA-C-N 116.3 -0.409 . . . . 63.44 112.316 175.743 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 67' ' ' TYR . . . . . 0.5 ' O ' HG22 ' A' ' 71' ' ' THR . 17.4 m-30 -74.72 -33.55 62.4 Favored 'General case' 0 N--CA 1.473 0.679 0 C-N-CA 123.218 0.607 . . . . 53.4 111.238 177.563 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 68' ' ' ILE . . . . . 0.494 HG13 ' O ' ' A' ' 64' ' ' VAL . 59.8 mt -63.68 -49.06 83.83 Favored 'Isoleucine or valine' 0 C--N 1.36 1.052 0 N-CA-C 108.663 -0.866 . . . . 71.41 108.663 175.63 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 69' ' ' LYS . . . . . 0.51 ' HB2' ' HE2' ' A' ' 106' ' ' TYR . 44.0 tptt -56.33 -44.65 80.21 Favored 'General case' 0 C--N 1.349 0.555 0 C-N-CA 123.572 0.749 . . . . 74.11 110.901 174.64 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 70' ' ' GLN . . . . . 0.435 HE21 HE21 ' A' ' 19' ' ' GLN . 63.4 tt0 -61.47 -45.72 93.06 Favored 'General case' 0 C--N 1.349 0.549 0 O-C-N 123.679 0.612 . . . . 71.02 111.077 -177.49 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 71' ' ' THR . . . . . 0.5 HG22 ' O ' ' A' ' 67' ' ' TYR . 3.0 t -74.7 -39.73 61.78 Favored 'General case' 0 C--N 1.355 0.824 0 CA-C-O 119.646 -0.216 . . . . 75.52 111.12 -175.185 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 72' ' ' LEU . . . . . 0.487 HD21 ' HB2' ' A' ' 102' ' ' LEU . 44.2 mt -64.85 -39.0 92.85 Favored 'General case' 0 N--CA 1.472 0.67 0 C-N-CA 122.11 0.164 . . . . 75.31 111.069 178.578 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 73' ' ' ASP . . . . . 0.444 ' O ' ' HG ' ' A' ' 77' ' ' LEU . 14.2 t70 -65.71 -59.63 3.72 Favored 'General case' 0 CA--C 1.543 0.686 0 O-C-N 123.994 0.809 . . . . 70.42 109.677 -178.702 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 84.1 m-20 -59.52 -45.22 92.38 Favored 'General case' 0 N--CA 1.485 1.317 0 C-N-CA 124.036 0.934 . . . . 55.11 111.778 -176.2 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 3.3 tm-20 -75.05 -29.86 60.85 Favored 'General case' 0 CA--C 1.555 1.166 0 CA-C-N 115.661 -0.7 . . . . 73.24 110.413 -174.477 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 9.4 tt0 -75.27 -29.62 60.21 Favored 'General case' 0 N--CA 1.488 1.458 0 O-C-N 122.056 -0.403 . . . . 75.33 110.746 175.076 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . 0.444 ' HG ' ' O ' ' A' ' 73' ' ' ASP . 93.2 mt -65.43 -39.99 92.77 Favored 'General case' 0 N--CA 1.48 1.07 0 N-CA-C 109.428 -0.582 . . . . 61.01 109.428 172.475 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . 0.65 HD21 ' HA ' ' A' ' 22' ' ' LEU . 72.7 mt -58.23 -47.67 82.81 Favored 'General case' 0 N--CA 1.477 0.889 0 CA-C-N 115.378 -0.828 . . . . 74.32 111.246 170.476 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 79' ' ' LYS . . . . . 0.421 ' HA ' ' HD3' ' A' ' 79' ' ' LYS . 25.9 mmtp -66.92 -28.56 68.4 Favored 'General case' 0 N--CA 1.475 0.81 0 C-N-CA 123.161 0.584 . . . . 62.24 112.463 -177.991 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -72.26 -33.99 61.38 Favored Glycine 0 C--N 1.347 1.175 0 N-CA-C 111.572 -0.611 . . . . 54.02 111.572 171.259 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 7.1 tt -73.61 -36.11 65.45 Favored 'General case' 0 CA--C 1.554 1.125 0 C-N-CA 124.224 1.009 . . . . 41.3 110.266 177.762 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 82' ' ' LEU . . . . . 0.411 ' HG ' ' O ' ' A' ' 78' ' ' LEU . 95.1 mt . . . . . 0 C--N 1.357 0.929 0 C-N-CA 123.078 0.551 . . . . 73.32 111.258 -171.973 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 92' ' ' LEU . . . . . 0.491 HD11 HD22 ' A' ' 41' ' ' LEU . 64.4 mt . . . . . 0 N--CA 1.49 1.536 0 N-CA-C 110.324 -0.25 . . . . 73.12 110.324 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 59.0 mt -62.03 92.16 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.482 1.14 0 C-N-CA 124.365 1.066 . . . . 63.21 111.877 -172.954 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 60.78 30.57 73.05 Favored Glycine 0 C--N 1.353 1.499 0 CA-C-N 115.769 -0.651 . . . . 63.24 113.506 178.83 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 21.0 pt20 42.18 36.39 0.7 Allowed 'General case' 0 N--CA 1.497 1.918 0 C-N-CA 126.297 1.839 . . . . 73.14 112.849 -172.392 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 72.7 m -155.0 -168.48 2.89 Favored 'General case' 0 N--CA 1.48 1.051 0 C-N-CA 125.719 1.608 . . . . 73.11 107.873 178.138 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 54.0 m 76.83 -42.53 0.42 Allowed 'General case' 0 N--CA 1.49 1.564 0 C-N-CA 124.678 1.191 . . . . 73.31 113.473 170.159 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 1.1 tmm_? -50.81 -51.24 52.77 Favored 'General case' 0 N--CA 1.482 1.135 0 C-N-CA 125.301 1.44 . . . . 75.13 111.522 -170.291 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 30.8 tt0 -61.61 -45.82 92.44 Favored 'General case' 0 C--N 1.355 0.831 0 O-C-N 123.496 0.497 . . . . 71.21 109.975 -175.781 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 64.4 tttp -68.29 -29.26 67.99 Favored 'General case' 0 N--CA 1.482 1.162 0 O-C-N 124.098 0.874 . . . . 71.04 111.737 179.542 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 35.1 t -72.79 -41.29 65.14 Favored 'General case' 0 N--CA 1.478 0.957 0 C-N-CA 123.361 0.665 . . . . 44.43 110.282 -177.551 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 102' ' ' LEU . . . . . 0.487 ' HB2' HD21 ' A' ' 72' ' ' LEU . 9.2 mp -79.36 -23.73 43.16 Favored 'General case' 0 N--CA 1.476 0.841 0 CA-C-N 116.07 -0.514 . . . . 61.25 110.934 174.97 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -72.46 -34.15 67.52 Favored 'General case' 0 N--CA 1.482 1.175 0 N-CA-C 108.602 -0.888 . . . . 72.15 108.602 174.476 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 9.6 t30 -71.65 -37.34 70.83 Favored 'General case' 0 N--CA 1.474 0.753 0 CA-C-N 115.213 -0.903 . . . . 73.11 109.226 174.037 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 105' ' ' ALA . . . . . 0.454 ' O ' ' HG ' ' A' ' 114' ' ' LEU . . . -61.1 -48.96 79.25 Favored 'General case' 0 CA--C 1.538 0.502 0 O-C-N 123.733 0.646 . . . . 75.24 110.315 175.504 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 106' ' ' TYR . . . . . 0.51 ' HE2' ' HB2' ' A' ' 69' ' ' LYS . 7.8 t80 -61.14 -51.9 67.14 Favored 'General case' 0 CA--C 1.541 0.611 0 CA-C-N 116.008 -0.542 . . . . 73.34 109.733 179.564 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -63.37 -44.48 96.78 Favored Glycine 0 C--N 1.354 1.581 0 O-C-N 124.212 0.945 . . . . 74.35 113.19 -173.815 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 5.8 tpm_? -69.13 -34.29 74.79 Favored 'General case' 0 C--N 1.348 0.522 0 C-N-CA 122.996 0.518 . . . . 72.33 109.909 179.935 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 109' ' ' LEU . . . . . 0.571 HD23 ' HB2' ' A' ' 65' ' ' ALA . 54.9 tp -65.91 -45.76 80.75 Favored 'General case' 0 N--CA 1.488 1.426 0 C-N-CA 123.055 0.542 . . . . 62.2 110.616 176.072 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 42.4 t -59.59 -48.58 81.11 Favored 'General case' 0 CA--C 1.531 0.249 0 O-C-N 124.738 1.274 . . . . 73.12 110.551 -176.471 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . -85.4 -59.32 1.94 Allowed Glycine 0 C--N 1.356 1.646 0 CA-C-O 119.299 -0.723 . . . . 65.52 112.957 -178.463 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 112' ' ' MET . . . . . . . . . . . . . 8.0 tpt -93.07 -70.4 0.7 Allowed 'General case' 0 N--CA 1.489 1.479 0 CA-C-N 118.216 1.008 . . . . 75.52 113.143 -178.011 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 113' ' ' LEU . . . . . 0.416 HD11 ' HB ' ' A' ' 56' ' ' ILE . 15.1 tp 168.36 13.9 0.0 OUTLIER 'General case' 0 N--CA 1.507 2.379 0 C-N-CA 123.575 0.75 . . . . 74.44 112.267 -173.498 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 114' ' ' LEU . . . . . 0.791 ' HB3' HG21 ' A' ' 52' ' ' THR . 0.9 OUTLIER . . . . . 0 N--CA 1.502 2.138 0 C-N-CA 125.089 1.356 . . . . 72.32 109.98 -176.153 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 1' ' ' MET . . . . . 0.435 ' O ' HG23 ' A' ' 5' ' ' VAL . 16.5 tpt . . . . . 0 N--CA 1.487 1.376 0 CA-C-O 119.325 -0.369 . . . . 70.34 111.383 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 30.5 p -55.63 -51.36 67.45 Favored 'General case' 0 N--CA 1.489 1.488 0 C-N-CA 123.224 0.61 . . . . 54.1 112.229 -176.647 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 35.6 m -64.55 -29.58 70.61 Favored 'General case' 0 CA--C 1.541 0.601 0 CA-C-N 115.551 -0.749 . . . . 72.5 111.14 178.576 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 4' ' ' THR . . . . . 0.503 ' HA ' ' HG3' ' A' ' 53' ' ' PRO . 4.5 m -74.13 -33.3 63.5 Favored 'General case' 0 N--CA 1.473 0.688 0 C-N-CA 123.36 0.664 . . . . 70.13 110.976 178.845 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 5' ' ' VAL . . . . . 0.435 HG23 ' O ' ' A' ' 1' ' ' MET . 89.5 t -69.39 -45.64 78.33 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.793 0 N-CA-C 109.273 -0.64 . . . . 71.53 109.273 177.045 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 25.1 mm-40 -55.07 -47.76 74.43 Favored 'General case' 0 N--CA 1.478 0.961 0 O-C-N 123.627 0.579 . . . . 73.31 110.831 172.789 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 7' ' ' PHE . . . . . 0.672 ' HZ ' HD11 ' A' ' 109' ' ' LEU . 72.8 t80 -55.38 -61.8 2.09 Favored 'General case' 0 CA--C 1.558 1.275 0 C-N-CA 124.621 1.168 . . . . 73.11 111.922 -178.573 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 8' ' ' ILE . . . . . 0.411 ' O ' ' HG3' ' A' ' 12' ' ' GLN . 65.2 mt -57.77 -48.79 82.8 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.08 0 C-N-CA 123.473 0.709 . . . . 63.35 110.615 -178.905 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 2.7 t-20 -65.32 -37.82 88.28 Favored 'General case' 0 N--CA 1.473 0.679 0 O-C-N 124.067 0.855 . . . . 71.24 111.818 -171.329 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 56.3 mtt180 -69.67 -38.59 77.11 Favored 'General case' 0 CA--C 1.543 0.677 0 CA-C-N 116.151 -0.477 . . . . 75.12 110.343 176.674 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 11' ' ' TRP . . . . . . . . . . . . . 80.0 m95 -68.82 -27.92 66.28 Favored 'General case' 0 N--CA 1.488 1.44 0 N-CA-C 112.054 0.39 . . . . 63.24 112.054 174.419 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . 0.411 ' HG3' ' O ' ' A' ' 8' ' ' ILE . 56.1 mt-30 -64.12 -47.69 79.0 Favored 'General case' 0 N--CA 1.478 0.945 0 N-CA-C 109.083 -0.71 . . . . 52.14 109.083 172.581 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 15.7 tpt180 -54.24 -49.75 68.77 Favored 'General case' 0 CA--C 1.548 0.875 0 C-N-CA 124.036 0.934 . . . . 73.12 110.889 177.735 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 14' ' ' ILE . . . . . 0.487 HD11 HG21 ' A' ' 47' ' ' VAL . 96.9 mt -59.95 -52.56 59.7 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.894 0 C-N-CA 124.236 1.015 . . . . 74.14 111.582 -178.104 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -60.06 -45.2 93.64 Favored 'General case' 0 N--CA 1.474 0.746 0 C-N-CA 123.599 0.759 . . . . 72.05 112.037 -176.55 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 96.1 mt -69.27 -40.8 77.56 Favored 'General case' 0 N--CA 1.475 0.804 0 CA-C-N 114.956 -1.02 . . . . 55.25 111.107 -177.517 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.51 ' O ' ' HG ' ' A' ' 21' ' ' LEU . 43.1 mt -62.19 -51.92 65.87 Favored 'General case' 0 N--CA 1.478 0.927 0 C-N-CA 122.798 0.439 . . . . 63.03 110.485 177.894 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 77.8 p -61.94 -40.41 95.43 Favored 'General case' 0 N--CA 1.475 0.817 0 C-N-CA 123.275 0.63 . . . . 71.01 111.501 -176.676 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 6.6 tp-100 -63.75 -42.24 97.87 Favored 'General case' 0 C--N 1.36 1.034 0 O-C-N 123.294 0.371 . . . . 61.14 110.428 176.694 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 65.5 m -60.52 -45.45 93.79 Favored 'General case' 0 CA--C 1.538 0.498 0 O-C-N 123.468 0.48 . . . . 52.04 110.712 176.248 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . 0.668 HD22 ' HA ' ' A' ' 33' ' ' LEU . 69.6 mt -63.29 -33.54 75.73 Favored 'General case' 0 N--CA 1.476 0.839 0 C-N-CA 123.347 0.659 . . . . 75.2 110.696 -179.092 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.661 ' HA ' HD21 ' A' ' 78' ' ' LEU . 57.9 tp -67.56 -53.34 29.2 Favored 'General case' 0 CA--C 1.544 0.724 0 C-N-CA 123.183 0.593 . . . . 62.42 110.677 178.036 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . 0.413 ' O ' ' HG3' ' A' ' 27' ' ' ARG . 37.3 mt-10 -56.23 -47.87 77.62 Favored 'General case' 0 N--CA 1.481 1.093 0 C-N-CA 123.874 0.87 . . . . 54.12 110.556 179.035 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . 0.496 HD22 HD12 ' A' ' 32' ' ' LEU . 87.6 mt -66.02 -35.34 80.3 Favored 'General case' 0 C--O 1.217 -0.653 0 CA-C-N 114.961 -1.018 . . . . 55.05 110.996 -177.138 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . 0.521 ' HB2' HD21 ' A' ' 33' ' ' LEU . . . -65.04 -38.97 92.61 Favored 'General case' 0 N--CA 1.482 1.154 0 CA-C-O 121.019 0.438 . . . . 63.31 111.27 175.397 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 96.7 mt-30 -70.94 -27.72 63.97 Favored 'General case' 0 N--CA 1.48 1.041 0 CA-C-N 115.323 -0.853 . . . . 75.1 111.333 177.456 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 27' ' ' ARG . . . . . 0.454 ' HD2' HD23 ' A' ' 24' ' ' LEU . 96.9 mtt180 -78.07 -26.85 48.43 Favored 'General case' 0 N--CA 1.478 0.97 0 C-N-CA 123.385 0.674 . . . . 64.23 110.469 172.469 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 95.54 13.95 49.17 Favored Glycine 0 C--N 1.346 1.121 0 CA-C-N 115.992 -0.549 . . . . 70.12 113.37 -177.534 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 29' ' ' GLU . . . . . 0.431 ' HG2' ' HB2' ' A' ' 27' ' ' ARG . 8.7 mm-40 -84.88 59.38 5.55 Favored 'General case' 0 CA--C 1.553 1.076 0 C-N-CA 123.961 0.904 . . . . 70.53 110.326 176.713 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 30' ' ' TRP . . . . . . . . . . . . . 95.2 m95 -65.4 -22.3 66.77 Favored 'General case' 0 N--CA 1.485 1.302 0 C-N-CA 123.875 0.87 . . . . 74.54 111.714 -177.734 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 11.9 m-20 -53.56 -53.27 54.13 Favored 'General case' 0 C--N 1.35 0.62 0 O-C-N 123.753 0.658 . . . . 60.23 109.919 171.354 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 0.496 HD12 HD22 ' A' ' 24' ' ' LEU . 78.5 mt -63.19 -27.25 69.24 Favored 'General case' 0 N--CA 1.475 0.788 0 O-C-N 124.082 0.864 . . . . 73.53 111.444 -175.198 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . 0.668 ' HA ' HD22 ' A' ' 21' ' ' LEU . 9.0 mp -69.2 -54.92 12.33 Favored 'General case' 0 N--CA 1.479 0.988 0 C-N-CA 122.551 0.34 . . . . 65.24 110.421 174.253 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 91.0 mt -63.96 -29.03 70.23 Favored 'General case' 0 N--CA 1.484 1.255 0 O-C-N 123.814 0.696 . . . . 45.11 112.017 -176.344 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 94.1 mt-30 -71.67 -43.32 66.24 Favored 'General case' 0 N--CA 1.476 0.87 0 C-N-CA 123.374 0.669 . . . . 72.34 110.7 176.889 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 81.9 mm-40 -85.56 -14.47 45.7 Favored 'General case' 0 N--CA 1.481 1.095 0 C-N-CA 123.166 0.586 . . . . 71.4 112.369 -178.219 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 41.2 tt0 -51.81 -55.79 17.82 Favored 'General case' 0 N--CA 1.479 1.004 0 C-N-CA 125.069 1.348 . . . . 72.34 112.54 -173.621 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 63.9 t -62.77 -44.61 99.63 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.895 0 C-N-CA 122.754 0.421 . . . . 54.2 111.101 -175.407 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 65.3 m -65.43 -38.62 90.45 Favored 'General case' 0 N--CA 1.481 1.086 0 C-N-CA 123.021 0.528 . . . . 63.13 111.029 -178.908 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 46.1 t80 -66.73 -54.46 22.66 Favored 'General case' 0 CA--C 1.539 0.554 0 CA-C-N 115.262 -0.881 . . . . 74.03 110.761 -178.924 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . 0.489 HD22 HD21 ' A' ' 92' ' ' LEU . 75.3 mt -62.11 -38.71 89.95 Favored 'General case' 0 N--CA 1.477 0.88 0 O-C-N 123.746 0.654 . . . . 72.34 110.375 -177.641 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 54.0 tt0 -53.53 -57.23 11.44 Favored 'General case' 0 C--O 1.247 0.925 0 C-N-CA 124.253 1.021 . . . . 63.41 110.329 174.682 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 43' ' ' SER . . . . . 0.537 ' O ' HG23 ' A' ' 47' ' ' VAL . 51.6 m -54.02 -60.65 3.05 Favored 'General case' 0 CA--C 1.544 0.713 0 O-C-N 124.56 1.163 . . . . 73.4 111.397 179.496 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 44' ' ' ILE . . . . . 0.463 HG13 HD13 ' A' ' 14' ' ' ILE . 19.0 tt -60.15 -40.82 84.6 Favored 'Isoleucine or valine' 0 C--O 1.257 1.493 0 C-N-CA 123.677 0.791 . . . . 62.21 112.974 -168.586 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . 0.438 ' HG2' ' O ' ' A' ' 41' ' ' LEU . 23.1 mm-40 -67.99 -45.55 73.79 Favored 'General case' 0 C--N 1.348 0.538 0 CA-C-N 116.521 -0.309 . . . . 75.22 110.189 178.036 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 41.4 m -62.25 -26.36 68.34 Favored 'General case' 0 CA--C 1.56 1.349 0 O-C-N 123.38 0.425 . . . . 42.32 112.031 178.66 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 47' ' ' VAL . . . . . 0.537 HG23 ' O ' ' A' ' 43' ' ' SER . 59.3 t -72.12 -46.57 58.06 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.434 0 C-N-CA 122.718 0.407 . . . . 72.1 110.502 175.933 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 48' ' ' MET . . . . . . . . . . . . . 71.6 mtm -67.74 -26.43 66.13 Favored 'General case' 0 N--CA 1.488 1.43 0 N-CA-C 111.77 0.285 . . . . 72.03 111.77 178.822 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 42.8 mt-10 -81.53 -20.6 39.69 Favored 'General case' 0 N--CA 1.479 0.987 0 C-N-CA 123.69 0.796 . . . . 70.14 111.192 175.451 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -75.8 136.44 40.24 Favored 'General case' 0 C--O 1.244 0.781 0 N-CA-C 109.291 -0.633 . . . . 72.34 109.291 -179.706 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 7.2 tt0 -61.86 113.85 3.01 Favored 'General case' 0 C--O 1.241 0.656 0 O-C-N 123.448 0.467 . . . . 64.15 110.007 178.73 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 52' ' ' THR . . . . . 0.441 HG21 ' O ' ' A' ' 114' ' ' LEU . 89.3 m -65.26 128.47 93.82 Favored Pre-proline 0 CA--C 1.553 1.064 0 CA-C-N 115.769 -0.65 . . . . 74.22 109.71 173.883 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 53' ' ' PRO . . . . . 0.503 ' HG3' ' HA ' ' A' ' 4' ' ' THR . 29.3 Cg_endo -60.27 153.52 58.86 Favored 'Trans proline' 0 C--N 1.375 1.948 0 C-N-CA 122.915 2.41 . . . . 62.21 112.608 178.93 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 54' ' ' PRO . . . . . 0.468 ' HD3' ' HA ' ' A' ' 53' ' ' PRO . 5.0 Cg_exo -81.63 -49.16 0.05 OUTLIER 'Trans proline' 0 C--N 1.369 1.627 0 C-N-CA 123.117 2.544 . . . . 71.24 112.973 179.479 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . -78.53 80.9 1.39 Allowed Glycine 0 C--N 1.348 1.22 0 CA-C-N 116.498 -0.319 . . . . 73.2 112.509 -175.208 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 56' ' ' ILE . . . . . 0.629 HG21 HD22 ' A' ' 114' ' ' LEU . 74.2 mt -121.83 144.0 32.51 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.786 0 C-N-CA 123.977 0.911 . . . . 71.03 109.428 -179.039 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 57' ' ' THR . . . . . 0.411 ' H ' HD12 ' A' ' 60' ' ' ILE . 66.0 p -99.88 170.25 8.65 Favored 'General case' 0 N--CA 1.479 1.014 0 C-N-CA 123.554 0.742 . . . . 72.21 111.005 177.466 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 13.3 tpt180 -64.65 -35.42 80.97 Favored 'General case' 0 C--N 1.357 0.897 0 C-N-CA 123.208 0.603 . . . . 64.21 111.439 178.164 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 20.4 m -59.9 -41.81 92.48 Favored 'General case' 0 N--CA 1.482 1.138 0 CA-C-O 121.175 0.512 . . . . 74.53 110.768 178.518 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 60' ' ' ILE . . . . . 0.411 HD12 ' H ' ' A' ' 57' ' ' THR . 83.3 mt -66.93 -39.26 83.1 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.603 0 CA-C-N 114.996 -1.002 . . . . 75.14 110.03 176.109 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 61' ' ' GLN . . . . . 0.539 HE21 ' HA ' ' A' ' 110' ' ' SER . 52.3 tt0 -60.89 -35.72 77.36 Favored 'General case' 0 N--CA 1.481 1.076 0 C-N-CA 123.727 0.811 . . . . 60.44 111.16 176.876 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 57.8 m-20 -73.84 -45.42 51.33 Favored 'General case' 0 N--CA 1.478 0.958 0 C-N-CA 123.073 0.549 . . . . 74.21 111.468 -179.57 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 63' ' ' MET . . . . . . . . . . . . . 67.1 mtm -66.05 -51.36 58.95 Favored 'General case' 0 N--CA 1.481 1.119 0 C-N-CA 122.708 0.403 . . . . 74.35 110.889 -179.888 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 64' ' ' VAL . . . . . 0.429 ' O ' HG13 ' A' ' 68' ' ' ILE . 77.3 t -63.13 -59.56 4.17 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.538 0 C-N-CA 123.356 0.662 . . . . 72.34 111.364 -179.871 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . 0.54 ' HB2' HD23 ' A' ' 109' ' ' LEU . . . -69.14 -22.47 63.94 Favored 'General case' 0 N--CA 1.485 1.313 0 CA-C-N 118.491 0.587 . . . . 74.24 111.326 -176.606 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -67.42 -38.98 91.45 Favored Glycine 0 C--N 1.348 1.195 0 N-CA-C 111.886 -0.485 . . . . 74.24 111.886 170.752 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 67' ' ' TYR . . . . . 0.417 ' O ' HG22 ' A' ' 71' ' ' THR . 1.8 m-30 -74.92 -32.32 61.75 Favored 'General case' 0 C--O 1.241 0.636 0 C-N-CA 123.405 0.682 . . . . 65.31 112.034 175.603 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 68' ' ' ILE . . . . . 0.535 HD12 HD22 ' A' ' 109' ' ' LEU . 19.5 mt -68.53 -38.79 79.65 Favored 'Isoleucine or valine' 0 C--N 1.357 0.894 0 N-CA-C 108.495 -0.928 . . . . 73.13 108.495 175.03 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 12.3 tmtt? -57.73 -48.81 78.55 Favored 'General case' 0 N--CA 1.48 1.034 0 C-N-CA 123.767 0.827 . . . . 73.42 108.791 175.63 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 70' ' ' GLN . . . . . 0.5 ' HG2' HD21 ' A' ' 74' ' ' ASN . 64.6 tt0 -53.58 -49.91 66.71 Favored 'General case' 0 CA--C 1.544 0.734 0 O-C-N 124.522 1.139 . . . . 64.24 110.718 178.652 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 71' ' ' THR . . . . . 0.417 HG22 ' O ' ' A' ' 67' ' ' TYR . 2.9 t -75.12 -21.56 58.78 Favored 'General case' 0 C--N 1.358 0.959 0 CA-C-O 119.293 -0.384 . . . . 63.32 111.925 -178.542 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 72' ' ' LEU . . . . . 0.486 ' HG ' ' O ' ' A' ' 68' ' ' ILE . 25.4 mt -61.36 -52.43 64.67 Favored 'General case' 0 N--CA 1.487 1.406 0 N-CA-C 108.852 -0.796 . . . . 62.22 108.852 173.064 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 5.3 m-20 -61.66 -57.39 12.19 Favored 'General case' 0 N--CA 1.475 0.785 0 O-C-N 124.064 0.853 . . . . 71.21 110.846 178.675 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 74' ' ' ASN . . . . . 0.5 HD21 ' HG2' ' A' ' 70' ' ' GLN . 79.9 m-20 -51.87 -54.43 29.27 Favored 'General case' 0 N--CA 1.484 1.247 0 C-N-CA 124.177 0.991 . . . . 73.33 111.434 -174.403 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . 0.599 ' O ' ' HG2' ' A' ' 79' ' ' LYS . 10.4 mm-40 -60.26 -57.16 13.98 Favored 'General case' 0 C--O 1.221 -0.427 0 CA-C-N 115.268 -0.878 . . . . 65.5 111.295 179.224 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 9.3 tt0 -62.61 -29.64 70.75 Favored 'General case' 0 N--CA 1.484 1.247 0 O-C-N 123.67 0.606 . . . . 65.51 112.182 -172.014 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 77.2 mt -72.23 -40.89 67.41 Favored 'General case' 0 N--CA 1.473 0.711 0 C-N-CA 123.613 0.765 . . . . 72.23 110.042 175.604 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . 0.661 HD21 ' HA ' ' A' ' 22' ' ' LEU . 71.9 mt -61.94 -36.9 82.78 Favored 'General case' 0 N--CA 1.488 1.435 0 C-N-CA 123.135 0.574 . . . . 63.53 111.559 173.158 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 79' ' ' LYS . . . . . 0.599 ' HG2' ' O ' ' A' ' 75' ' ' GLU . 33.7 mmtm -69.21 -47.64 64.26 Favored 'General case' 0 N--CA 1.473 0.723 0 N-CA-C 109.18 -0.674 . . . . 72.41 109.18 -177.634 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -64.68 -29.09 74.28 Favored Glycine 0 C--N 1.35 1.315 0 CA-C-N 115.283 -0.872 . . . . 51.14 112.731 175.782 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 2.6 tt -69.82 -40.39 75.95 Favored 'General case' 0 CA--C 1.547 0.854 0 C-N-CA 123.724 0.81 . . . . 73.44 109.321 177.418 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 93.1 mt . . . . . 0 C--N 1.352 0.699 0 N-CA-C 109.468 -0.567 . . . . 74.32 109.468 179.196 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 92' ' ' LEU . . . . . 0.489 HD21 HD22 ' A' ' 41' ' ' LEU . 81.0 mt . . . . . 0 N--CA 1.481 1.087 0 CA-C-O 121.149 0.499 . . . . 71.01 111.112 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 59.5 mt -98.42 -34.23 4.49 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.884 0 C-N-CA 123.52 0.728 . . . . 74.42 109.444 175.239 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 140.31 -28.0 2.49 Favored Glycine 0 C--N 1.337 0.627 0 N-CA-C 110.281 -1.127 . . . . 74.23 110.281 -173.309 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 21.6 mp0 -98.74 146.84 25.48 Favored 'General case' 0 C--O 1.245 0.85 0 N-CA-C 107.649 -1.241 . . . . 75.53 107.649 173.765 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 52.8 p -72.08 83.08 0.98 Allowed 'General case' 0 CA--C 1.545 0.753 0 CA-C-O 121.804 0.811 . . . . 62.33 110.249 179.516 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 7.1 t -107.17 3.46 25.69 Favored 'General case' 0 CA--C 1.541 0.621 0 CA-C-N 115.058 -0.974 . . . . 70.54 111.425 -171.078 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 98' ' ' ARG . . . . . 0.467 ' HG2' HD11 ' A' ' 92' ' ' LEU . 0.0 OUTLIER -59.93 -61.97 2.22 Favored 'General case' 0 N--CA 1.482 1.131 0 CA-C-N 117.959 0.345 . . . . 71.42 110.432 -170.384 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 1.4 tm0? -72.68 -41.12 65.69 Favored 'General case' 0 N--CA 1.467 0.378 0 CA-C-N 115.541 -0.754 . . . . 73.21 109.799 -174.478 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 40.3 ttmt -63.28 -55.08 27.73 Favored 'General case' 0 C--N 1.348 0.539 0 O-C-N 123.754 0.659 . . . . 73.42 111.26 -175.1 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 33.7 t -75.14 -28.48 60.17 Favored 'General case' 0 N--CA 1.476 0.845 0 C-N-CA 123.357 0.663 . . . . 65.05 111.733 -174.939 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 102' ' ' LEU . . . . . 0.418 HD12 ' HA ' ' A' ' 102' ' ' LEU . 10.5 tp -75.84 -35.57 59.91 Favored 'General case' 0 CA--C 1.549 0.937 0 CA-C-N 118.18 0.445 . . . . 75.13 110.657 178.526 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 5.0 t-20 -78.86 -26.48 44.04 Favored 'General case' 0 N--CA 1.481 1.089 0 C-N-CA 123.428 0.691 . . . . 74.33 110.248 176.58 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 104' ' ' ASN . . . . . 0.417 ' ND2' HH11 ' A' ' 108' ' ' ARG . 24.6 t-20 -67.53 -50.42 58.76 Favored 'General case' 0 N--CA 1.476 0.862 0 C-N-CA 123.927 0.891 . . . . 72.31 109.386 173.543 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 105' ' ' ALA . . . . . 0.452 ' O ' ' HB2' ' A' ' 109' ' ' LEU . . . -56.23 -46.62 79.47 Favored 'General case' 0 C--N 1.35 0.596 0 CA-C-N 115.096 -0.956 . . . . 51.23 110.244 175.959 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 106' ' ' TYR . . . . . . . . . . . . . 6.4 t80 -57.6 -43.06 84.41 Favored 'General case' 0 N--CA 1.478 0.931 0 C-N-CA 124.539 1.135 . . . . 65.14 110.705 176.215 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -62.33 -51.55 55.68 Favored Glycine 0 C--N 1.348 1.232 0 O-C-N 123.595 0.56 . . . . 53.44 113.094 -176.453 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 108' ' ' ARG . . . . . 0.417 HH11 ' ND2' ' A' ' 104' ' ' ASN . 0.0 OUTLIER -67.81 -33.13 74.2 Favored 'General case' 0 C--O 1.251 1.137 0 C-N-CA 122.548 0.339 . . . . 62.52 110.459 177.717 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 109' ' ' LEU . . . . . 0.761 ' HA ' ' HA ' ' A' ' 114' ' ' LEU . 4.6 tp -61.92 -55.1 33.07 Favored 'General case' 0 C--N 1.354 0.774 0 O-C-N 124.213 0.945 . . . . 70.11 110.596 -177.733 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 110' ' ' SER . . . . . 0.539 ' HA ' HE21 ' A' ' 61' ' ' GLN . 17.2 m -78.62 -18.05 55.1 Favored 'General case' 0 CA--C 1.542 0.65 0 CA-C-N 114.965 -1.016 . . . . 63.04 110.526 179.084 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . -73.01 -62.41 3.15 Favored Glycine 0 C--N 1.359 1.836 0 CA-C-O 118.571 -1.127 . . . . 73.44 114.74 -176.565 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 112' ' ' MET . . . . . . . . . . . . . 2.8 tmm? -94.5 -63.93 1.13 Allowed 'General case' 0 N--CA 1.503 2.213 0 CA-C-N 119.487 1.644 . . . . 71.41 111.162 -175.139 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 2.5 tm? 170.75 60.8 0.0 OUTLIER 'General case' 0 N--CA 1.48 1.041 0 N-CA-C 105.487 -2.042 . . . . 73.25 105.487 -177.649 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 114' ' ' LEU . . . . . 0.761 ' HA ' ' HA ' ' A' ' 109' ' ' LEU . 5.4 mp . . . . . 0 N--CA 1.475 0.82 0 CA-C-N 113.02 -1.9 . . . . 74.12 115.33 171.53 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 20.2 ptt? . . . . . 0 N--CA 1.479 1.005 0 CA-C-O 121.293 0.568 . . . . 71.33 109.888 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 52.0 p -56.79 -33.12 66.35 Favored 'General case' 0 N--CA 1.482 1.16 0 C-N-CA 123.52 0.728 . . . . 63.45 111.971 -176.012 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 59.2 p -63.39 -43.41 97.65 Favored 'General case' 0 CA--C 1.549 0.92 0 C-N-CA 123.502 0.721 . . . . 35.11 110.995 175.098 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 27.6 m -69.63 -37.53 76.85 Favored 'General case' 0 N--CA 1.478 0.934 0 C-N-CA 123.581 0.752 . . . . 63.31 111.581 179.211 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 89.3 t -64.47 -47.16 90.52 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.819 0 C-N-CA 123.078 0.551 . . . . 72.34 109.858 179.664 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 16.7 mm-40 -60.26 -42.44 95.34 Favored 'General case' 0 C--O 1.218 -0.595 0 O-C-N 123.897 0.748 . . . . 64.33 110.563 173.495 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 35.7 t80 -59.19 -53.51 57.46 Favored 'General case' 0 CA--C 1.546 0.805 0 C-N-CA 123.626 0.77 . . . . 74.52 111.181 -176.851 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 52.0 mt -63.04 -45.89 97.62 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.033 0 C-N-CA 123.184 0.594 . . . . 73.24 110.311 179.226 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 3.4 t-20 -63.49 -32.99 74.6 Favored 'General case' 0 N--CA 1.48 1.028 0 C-N-CA 123.615 0.766 . . . . 64.33 111.454 -176.398 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . 0.477 ' O ' ' HB3' ' A' ' 13' ' ' ARG . 94.7 mtt180 -79.59 -29.39 41.16 Favored 'General case' 0 C--O 1.214 -0.775 0 CA-C-N 115.828 -0.624 . . . . 73.14 110.5 177.202 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 11' ' ' TRP . . . . . . . . . . . . . 79.3 m95 -76.6 -19.71 57.55 Favored 'General case' 0 N--CA 1.479 1.004 0 CA-C-O 119.186 -0.435 . . . . 73.3 111.053 171.362 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 51.3 mt-30 -68.73 -48.87 62.7 Favored 'General case' 0 N--CA 1.481 1.102 0 N-CA-C 108.196 -1.038 . . . . 75.04 108.196 168.265 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . 0.477 ' HB3' ' O ' ' A' ' 10' ' ' ARG . 17.6 tpt180 -48.25 -52.33 21.63 Favored 'General case' 0 CA--C 1.554 1.1 0 C-N-CA 124.939 1.296 . . . . 61.25 110.997 173.771 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 14' ' ' ILE . . . . . 0.465 HG13 ' O ' ' A' ' 10' ' ' ARG . 74.7 mt -69.08 -48.35 69.97 Favored 'Isoleucine or valine' 0 CA--C 1.558 1.267 0 C-N-CA 123.774 0.83 . . . . 54.42 111.267 -177.053 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -60.66 -48.4 81.93 Favored 'General case' 0 N--CA 1.487 1.424 0 C-N-CA 123.562 0.745 . . . . 54.45 111.964 -177.328 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 95.4 mt -69.26 -44.29 72.2 Favored 'General case' 0 CA--C 1.539 0.544 0 CA-C-N 115.079 -0.964 . . . . 61.04 111.046 -177.074 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.431 ' O ' ' HG ' ' A' ' 21' ' ' LEU . 42.3 mt -68.45 -32.41 72.41 Favored 'General case' 0 N--CA 1.482 1.171 0 CA-C-O 119.129 -0.463 . . . . 70.13 112.091 -179.502 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 78.7 p -68.38 -43.64 76.9 Favored 'General case' 0 N--CA 1.481 1.115 0 CA-C-N 118.181 0.446 . . . . 65.3 110.129 176.299 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 6.8 tp-100 -63.58 -37.56 87.77 Favored 'General case' 0 C--N 1.355 0.839 0 O-C-N 123.858 0.724 . . . . 74.11 110.789 176.841 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 52.5 m -62.52 -53.49 54.02 Favored 'General case' 0 C--N 1.348 0.542 0 CA-C-N 115.85 -0.614 . . . . 71.11 110.075 176.364 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . 0.545 HD22 ' HA ' ' A' ' 33' ' ' LEU . 57.9 mt -58.0 -35.6 71.46 Favored 'General case' 0 N--CA 1.477 0.916 0 O-C-N 123.833 0.708 . . . . 71.32 111.224 -178.569 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.652 HD22 ' HA ' ' A' ' 74' ' ' ASN . 53.5 tp -65.83 -57.25 8.39 Favored 'General case' 0 N--CA 1.475 0.817 0 O-C-N 123.364 0.415 . . . . 62.24 111.152 178.914 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . 0.451 ' O ' ' HG3' ' A' ' 27' ' ' ARG . 43.6 mt-10 -57.21 -50.76 71.85 Favored 'General case' 0 N--CA 1.481 1.076 0 O-C-N 123.628 0.58 . . . . 75.4 110.297 -179.366 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . 0.462 HD23 ' HD2' ' A' ' 27' ' ' ARG . 95.0 mt -61.11 -33.49 73.45 Favored 'General case' 0 N--CA 1.474 0.768 0 C-N-CA 124.469 1.107 . . . . 74.31 111.735 -178.747 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . 0.547 ' HB2' HD21 ' A' ' 33' ' ' LEU . . . -61.62 -48.52 80.54 Favored 'General case' 0 N--CA 1.477 0.882 0 CA-C-O 120.957 0.408 . . . . 35.43 110.378 173.869 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 81.3 mt-30 -67.62 -22.43 65.34 Favored 'General case' 0 CA--C 1.551 0.99 0 CA-C-N 115.156 -0.929 . . . . 72.34 111.607 178.848 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 27' ' ' ARG . . . . . 0.462 ' HD2' HD23 ' A' ' 24' ' ' LEU . 73.3 mtt180 -85.72 -6.76 59.08 Favored 'General case' 0 N--CA 1.482 1.145 0 C-N-CA 124.062 0.945 . . . . 73.12 112.012 177.86 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 81.78 8.16 87.13 Favored Glycine 0 C--N 1.352 1.469 0 N-CA-C 113.612 0.205 . . . . 72.44 113.612 -178.397 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 36.8 mm-40 -82.26 60.98 5.26 Favored 'General case' 0 CA--C 1.545 0.757 0 C-N-CA 124.571 1.148 . . . . 60.01 111.404 179.912 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 30' ' ' TRP . . . . . 0.478 ' O ' ' HG ' ' A' ' 34' ' ' LEU . 45.9 m95 -65.99 -29.06 69.38 Favored 'General case' 0 N--CA 1.481 1.106 0 C-N-CA 122.992 0.517 . . . . 62.13 110.819 -177.154 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 -62.02 -46.96 86.9 Favored 'General case' 0 N--CA 1.475 0.791 0 C-N-CA 123.522 0.729 . . . . 71.43 109.771 177.295 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 0.431 ' HB3' HD13 ' A' ' 24' ' ' LEU . 61.1 mt -62.14 -28.77 69.88 Favored 'General case' 0 N--CA 1.476 0.873 0 C-N-CA 123.068 0.547 . . . . 72.44 111.385 176.722 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . 0.547 HD21 ' HB2' ' A' ' 25' ' ' ALA . 10.7 mp -68.86 -42.03 77.61 Favored 'General case' 0 C--N 1.357 0.897 0 CA-C-O 119.047 -0.501 . . . . 72.22 110.742 171.769 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.478 ' HG ' ' O ' ' A' ' 30' ' ' TRP . 83.8 mt -64.18 -43.54 94.79 Favored 'General case' 0 N--CA 1.487 1.387 0 C-N-CA 123.558 0.743 . . . . 71.41 111.565 -177.847 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 1.4 mp0 -65.43 -57.78 7.47 Favored 'General case' 0 N--CA 1.478 0.958 0 C-N-CA 123.137 0.575 . . . . 75.33 110.471 177.777 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 84.6 mm-40 -74.14 -11.31 60.27 Favored 'General case' 0 N--CA 1.479 0.99 0 C-N-CA 123.502 0.721 . . . . 74.43 112.723 -175.378 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 35.2 tt0 -53.65 -54.74 33.44 Favored 'General case' 0 N--CA 1.487 1.399 0 C-N-CA 123.876 0.87 . . . . 62.14 110.485 172.742 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 57.4 t -59.99 -47.94 89.77 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.514 0 O-C-N 124.248 0.968 . . . . 75.43 110.177 -179.344 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 16.3 m -55.6 -57.31 12.48 Favored 'General case' 0 CA--C 1.548 0.884 0 C-N-CA 124.037 0.935 . . . . 75.32 111.498 -179.265 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 28.5 t80 -63.87 -52.02 61.89 Favored 'General case' 0 CA--C 1.54 0.57 0 C-N-CA 124.97 1.308 . . . . 71.13 112.069 -173.73 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . 0.496 ' HA ' HG22 ' A' ' 44' ' ' ILE . 96.3 mt -72.22 -39.37 68.59 Favored 'General case' 0 N--CA 1.468 0.471 0 CA-C-N 115.969 -0.56 . . . . 71.24 111.659 -172.605 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 29.1 tt0 -60.0 -42.74 94.92 Favored 'General case' 0 CA--C 1.546 0.824 0 N-CA-C 109.68 -0.489 . . . . 73.11 109.68 173.866 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 43' ' ' SER . . . . . 0.436 ' O ' HG23 ' A' ' 47' ' ' VAL . 69.5 m -58.21 -54.84 42.48 Favored 'General case' 0 N--CA 1.483 1.189 0 C-N-CA 123.169 0.588 . . . . 73.12 112.151 176.892 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 44' ' ' ILE . . . . . 0.496 HG22 ' HA ' ' A' ' 41' ' ' LEU . 16.3 tt -62.83 -41.84 94.11 Favored 'Isoleucine or valine' 0 C--O 1.25 1.11 0 O-C-N 123.632 0.582 . . . . 71.33 111.146 -171.947 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . 0.496 ' O ' ' HG3' ' A' ' 49' ' ' GLU . 16.0 mm-40 -58.86 -51.02 71.82 Favored 'General case' 0 C--N 1.356 0.859 0 CA-C-N 115.801 -0.636 . . . . 62.43 110.166 174.812 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 46' ' ' THR . . . . . 0.514 ' O ' ' HD3' ' A' ' 50' ' ' LYS . 93.8 m -58.0 -36.31 72.48 Favored 'General case' 0 CA--C 1.55 0.976 0 O-C-N 124.319 1.012 . . . . 64.33 112.403 -178.115 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 47' ' ' VAL . . . . . 0.445 HG21 HD11 ' A' ' 14' ' ' ILE . 87.7 t -68.0 -45.42 83.69 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.063 0 C-N-CA 122.58 0.352 . . . . 63.41 110.167 177.721 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 48' ' ' MET . . . . . . . . . . . . . 65.8 mtm -76.0 -14.41 60.23 Favored 'General case' 0 N--CA 1.486 1.358 0 N-CA-C 112.989 0.737 . . . . 73.22 112.989 -177.799 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . 0.496 ' HG3' ' O ' ' A' ' 45' ' ' GLU . 69.0 mt-10 -70.53 -35.51 73.21 Favored 'General case' 0 N--CA 1.484 1.259 0 CA-C-O 120.839 0.352 . . . . 72.45 111.063 172.988 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . 0.514 ' HD3' ' O ' ' A' ' 46' ' ' THR . 13.4 mptt -90.21 166.84 13.13 Favored 'General case' 0 N--CA 1.477 0.915 0 C-N-CA 123.8 0.84 . . . . 61.04 110.65 -173.801 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 20.4 pt20 -71.92 146.78 47.59 Favored 'General case' 0 C--O 1.243 0.756 0 CA-C-N 115.431 -0.804 . . . . 72.23 110.635 -179.613 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 52' ' ' THR . . . . . 0.578 HG22 HD11 ' A' ' 56' ' ' ILE . 39.5 m -83.98 122.81 76.13 Favored Pre-proline 0 CA--C 1.546 0.807 0 N-CA-C 108.559 -0.904 . . . . 72.52 108.559 171.477 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 22.9 Cg_endo -57.38 157.06 23.32 Favored 'Trans proline' 0 C--N 1.379 2.149 0 C-N-CA 123.02 2.48 . . . . 51.13 113.411 -177.104 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 20.5 Cg_exo -68.22 -48.13 1.38 Allowed 'Trans proline' 0 C--N 1.371 1.755 0 C-N-CA 122.647 2.231 . . . . 71.12 112.354 174.394 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . -74.71 76.64 1.15 Allowed Glycine 0 C--N 1.351 1.378 0 CA-C-N 115.701 -0.681 . . . . 63.41 113.549 -175.97 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 56' ' ' ILE . . . . . 0.669 ' O ' ' HB ' ' A' ' 60' ' ' ILE . 26.6 mt -106.15 -14.14 9.26 Favored 'Isoleucine or valine' 0 C--O 1.202 -1.444 0 C-N-CA 123.583 0.753 . . . . 73.44 110.453 -179.989 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 73.6 p 38.82 -178.18 0.0 OUTLIER 'General case' 0 N--CA 1.506 2.338 0 N-CA-C 114.931 1.456 . . . . 73.13 114.931 -173.734 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 13.8 tpt85 -73.95 -37.04 64.67 Favored 'General case' 0 N--CA 1.476 0.854 0 O-C-N 120.482 -1.386 . . . . 74.5 108.378 171.194 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 33.4 m -62.51 -55.46 27.28 Favored 'General case' 0 C--O 1.246 0.875 0 C-N-CA 124.282 1.033 . . . . 73.1 111.93 -178.211 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 60' ' ' ILE . . . . . 0.669 ' HB ' ' O ' ' A' ' 56' ' ' ILE . 66.9 mt -75.03 -27.57 20.07 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.916 0 N-CA-C 109.046 -0.724 . . . . 75.23 109.046 -176.928 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 60.9 tt0 -57.23 -45.63 83.72 Favored 'General case' 0 C--N 1.376 1.732 0 CA-C-N 118.31 0.505 . . . . 65.24 110.862 171.915 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 65.9 m-20 -66.65 -41.78 87.7 Favored 'General case' 0 N--CA 1.472 0.666 0 O-C-N 123.591 0.557 . . . . 74.1 111.325 178.686 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 63' ' ' MET . . . . . . . . . . . . . 63.5 mtm -63.61 -54.78 30.53 Favored 'General case' 0 N--CA 1.486 1.343 0 O-C-N 123.318 0.386 . . . . 73.41 111.775 -179.455 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 64' ' ' VAL . . . . . 0.428 ' O ' HG13 ' A' ' 68' ' ' ILE . 73.5 t -59.04 -52.39 61.25 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.841 0 C-N-CA 123.719 0.808 . . . . 62.34 111.38 176.673 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . 0.465 ' HB2' HD23 ' A' ' 109' ' ' LEU . . . -64.46 -26.87 68.63 Favored 'General case' 0 N--CA 1.487 1.406 0 C-N-CA 122.534 0.333 . . . . 54.25 111.47 -179.836 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 66' ' ' GLY . . . . . 0.411 ' O ' ' HG3' ' A' ' 70' ' ' GLN . . . -68.1 -40.55 88.22 Favored Glycine 0 C--N 1.342 0.915 0 N-CA-C 111.296 -0.722 . . . . 73.4 111.296 174.357 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 67' ' ' TYR . . . . . 0.512 ' O ' HG23 ' A' ' 71' ' ' THR . 19.0 m-30 -67.06 -41.05 87.13 Favored 'General case' 0 N--CA 1.468 0.453 0 C-N-CA 123.533 0.733 . . . . 71.12 110.914 175.425 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 68' ' ' ILE . . . . . 0.584 ' O ' ' HG ' ' A' ' 72' ' ' LEU . 48.5 mt -61.09 -40.89 87.26 Favored 'Isoleucine or valine' 0 C--N 1.358 0.939 0 O-C-N 123.904 0.752 . . . . 63.24 109.001 174.665 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 69' ' ' LYS . . . . . 0.555 ' HA ' ' HE2' ' A' ' 69' ' ' LYS . 0.6 OUTLIER -58.72 -42.94 89.91 Favored 'General case' 0 N--CA 1.474 0.758 0 C-N-CA 123.305 0.642 . . . . 74.33 110.128 179.738 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 70' ' ' GLN . . . . . 0.411 ' HG3' ' O ' ' A' ' 66' ' ' GLY . 75.7 mt-30 -58.91 -45.92 89.18 Favored 'General case' 0 N--CA 1.476 0.84 0 O-C-N 124.176 0.922 . . . . 71.14 111.082 175.01 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 71' ' ' THR . . . . . 0.512 HG23 ' O ' ' A' ' 67' ' ' TYR . 10.0 p -60.59 -39.29 87.55 Favored 'General case' 0 N--CA 1.486 1.367 0 CA-C-O 120.862 0.363 . . . . 61.24 110.291 -178.63 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 72' ' ' LEU . . . . . 0.584 ' HG ' ' O ' ' A' ' 68' ' ' ILE . 52.7 mt -64.33 -54.59 30.7 Favored 'General case' 0 C--N 1.355 0.828 0 CA-C-N 115.144 -0.935 . . . . 74.43 109.812 -178.128 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 15.8 m-20 -58.7 -59.37 5.51 Favored 'General case' 0 N--CA 1.487 1.414 0 O-C-N 123.558 0.536 . . . . 74.14 111.243 178.542 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 74' ' ' ASN . . . . . 0.652 ' HA ' HD22 ' A' ' 22' ' ' LEU . 87.0 m-20 -56.71 -57.88 10.51 Favored 'General case' 0 N--CA 1.479 1.02 0 C-N-CA 124.471 1.108 . . . . 64.31 112.019 -173.59 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . 0.522 ' O ' ' HG2' ' A' ' 79' ' ' LYS . 61.8 tt0 -73.02 -29.25 62.87 Favored 'General case' 0 CA--C 1.545 0.78 0 CA-C-O 118.696 -0.668 . . . . 74.44 111.129 -172.694 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 7.0 tt0 -66.97 -38.43 86.07 Favored 'General case' 0 N--CA 1.491 1.578 0 CA-C-N 118.444 0.566 . . . . 70.44 110.763 173.536 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 92.6 mt -66.19 -30.56 71.05 Favored 'General case' 0 N--CA 1.471 0.583 0 N-CA-C 109.993 -0.373 . . . . 65.12 109.993 175.571 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . 0.609 HD21 ' HA ' ' A' ' 22' ' ' LEU . 85.3 mt -71.98 -35.01 69.37 Favored 'General case' 0 N--CA 1.479 1.019 0 C-N-CA 123.111 0.564 . . . . 65.02 111.912 170.437 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 79' ' ' LYS . . . . . 0.522 ' HG2' ' O ' ' A' ' 75' ' ' GLU . 35.5 mmtm -60.7 -43.92 97.17 Favored 'General case' 0 N--CA 1.485 1.28 0 N-CA-C 109.19 -0.67 . . . . 65.13 109.19 174.997 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -75.23 -33.44 53.88 Favored Glycine 0 C--N 1.346 1.117 0 CA-C-N 114.674 -1.148 . . . . 52.33 113.643 -179.431 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 5.4 tt -73.24 -60.13 2.39 Favored 'General case' 0 N--CA 1.477 0.91 0 C-N-CA 123.367 0.667 . . . . 71.25 109.407 -178.247 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 74.3 mt . . . . . 0 CA--C 1.544 0.738 0 CA-C-N 114.909 -1.041 . . . . 72.22 112.113 -171.018 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 92' ' ' LEU . . . . . 0.499 HD22 HH12 ' A' ' 98' ' ' ARG . 33.0 mt . . . . . 0 N--CA 1.486 1.348 0 N-CA-C 109.222 -0.658 . . . . 70.41 109.222 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 36.7 mt -68.71 145.52 13.38 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.943 0 C-N-CA 123.729 0.812 . . . . 71.53 109.617 176.473 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -64.64 138.63 40.41 Favored Glycine 0 C--N 1.348 1.2 0 O-C-N 123.551 0.532 . . . . 53.14 113.996 -175.881 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 6.9 tt0 61.56 88.19 0.09 Allowed 'General case' 0 CA--C 1.554 1.12 0 C-N-CA 125.127 1.371 . . . . 61.21 113.103 173.007 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 45.2 m 47.03 68.01 0.7 Allowed 'General case' 0 N--CA 1.486 1.337 0 C-N-CA 125.017 1.327 . . . . 70.33 114.114 163.922 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 12.0 t -96.48 -34.22 11.57 Favored 'General case' 0 N--CA 1.474 0.753 0 C-N-CA 122.49 0.316 . . . . 71.53 111.399 -177.25 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 98' ' ' ARG . . . . . 0.538 ' HA ' ' NE ' ' A' ' 98' ' ' ARG . 0.2 OUTLIER -62.61 -51.16 68.4 Favored 'General case' 0 C--N 1.353 0.752 0 O-C-N 123.584 0.552 . . . . 75.01 112.488 -161.486 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 22.7 tp60 -55.66 -55.58 30.53 Favored 'General case' 0 CA--C 1.545 0.765 0 O-C-N 124.159 0.912 . . . . 74.34 111.157 -176.519 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 24.1 tptp -70.88 -51.84 23.82 Favored 'General case' 0 CA--C 1.54 0.58 0 CA-C-N 115.585 -0.734 . . . . 71.2 111.153 -171.573 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 40.6 t -69.05 -38.36 79.08 Favored 'General case' 0 N--CA 1.474 0.748 0 C-N-CA 123.698 0.799 . . . . 71.52 112.353 -173.236 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 13.9 tp -83.5 -33.63 25.5 Favored 'General case' 0 N--CA 1.476 0.86 0 C-N-CA 122.485 0.314 . . . . 64.24 110.866 -174.405 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 27.9 t-20 -69.09 -34.23 74.79 Favored 'General case' 0 N--CA 1.482 1.158 0 N-CA-C 110.109 -0.33 . . . . 72.5 110.109 171.723 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 104' ' ' ASN . . . . . 0.453 ' O ' ' HG2' ' A' ' 108' ' ' ARG . 27.4 t-20 -60.88 -46.19 91.6 Favored 'General case' 0 N--CA 1.478 0.957 0 C-N-CA 123.16 0.584 . . . . 72.53 109.479 171.671 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -57.09 -42.79 81.38 Favored 'General case' 0 N--CA 1.477 0.887 0 O-C-N 124.018 0.824 . . . . 50.51 111.24 178.841 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 106' ' ' TYR . . . . . 0.402 ' HE2' ' HB2' ' A' ' 69' ' ' LYS . 9.1 t80 -58.47 -51.56 69.34 Favored 'General case' 0 CA--C 1.547 0.848 0 O-C-N 123.737 0.648 . . . . 74.02 110.276 175.384 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -65.79 -38.59 94.54 Favored Glycine 0 C--N 1.353 1.521 0 O-C-N 123.909 0.755 . . . . 72.1 113.232 -174.568 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 108' ' ' ARG . . . . . 0.453 ' HG2' ' O ' ' A' ' 104' ' ' ASN . 21.3 mmt180 -70.2 -35.62 74.03 Favored 'General case' 0 C--N 1.348 0.526 0 C-N-CA 122.998 0.519 . . . . 73.34 109.62 179.248 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 109' ' ' LEU . . . . . 0.465 HD23 ' HB2' ' A' ' 65' ' ' ALA . 53.2 tp -63.81 -52.69 59.07 Favored 'General case' 0 N--CA 1.48 1.058 0 C-N-CA 122.803 0.441 . . . . 73.13 110.216 175.782 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 16.2 t -62.91 -37.44 86.97 Favored 'General case' 0 CA--C 1.54 0.581 0 O-C-N 125.109 1.506 . . . . 71.24 111.03 -172.677 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . -91.05 -62.08 1.24 Allowed Glycine 0 C--N 1.35 1.326 0 CA-C-O 119.919 -0.378 . . . . 75.23 113.869 178.252 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 112' ' ' MET . . . . . . . . . . . . . 7.3 tpt -93.18 -65.81 0.97 Allowed 'General case' 0 N--CA 1.487 1.425 0 N-CA-C 113.167 0.802 . . . . 65.31 113.167 -168.213 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 14.4 tp 168.08 16.75 0.0 OUTLIER 'General case' 0 N--CA 1.504 2.271 0 C-N-CA 124.336 1.055 . . . . 71.21 110.917 -173.911 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 114' ' ' LEU . . . . . 0.445 ' N ' ' HA ' ' A' ' 109' ' ' LEU . 0.7 OUTLIER . . . . . 0 N--CA 1.502 2.13 0 C-N-CA 125.158 1.383 . . . . 71.21 110.098 -171.633 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 23.4 ttt . . . . . 0 N--CA 1.48 1.027 0 CA-C-O 119.773 -0.156 . . . . 71.11 111.083 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 87.1 m -52.0 -49.16 63.85 Favored 'General case' 0 N--CA 1.484 1.228 0 C-N-CA 123.387 0.675 . . . . 73.14 111.865 -178.08 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 22.9 m -63.08 -35.37 80.04 Favored 'General case' 0 N--CA 1.471 0.596 0 C-N-CA 123.708 0.803 . . . . 52.32 111.479 -178.901 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 4' ' ' THR . . . . . 0.558 HG21 HD13 ' A' ' 60' ' ' ILE . 5.0 m -68.42 -47.9 66.06 Favored 'General case' 0 CA--C 1.544 0.732 0 C-N-CA 123.461 0.704 . . . . 71.15 110.875 179.37 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 76.5 t -65.23 -39.51 85.66 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.979 0 C-N-CA 123.595 0.758 . . . . 63.11 110.484 -178.2 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 39.0 mm-40 -59.73 -49.23 78.53 Favored 'General case' 0 C--N 1.35 0.615 0 C-N-CA 123.291 0.636 . . . . 72.54 110.218 172.479 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 29.3 t80 -59.35 -45.78 90.45 Favored 'General case' 0 CA--C 1.551 1.0 0 C-N-CA 124.296 1.038 . . . . 74.34 110.873 -176.188 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 8' ' ' ILE . . . . . 0.464 HD11 HG23 ' A' ' 60' ' ' ILE . 77.7 mt -66.8 -42.95 90.0 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.914 0 C-N-CA 123.943 0.897 . . . . 71.05 110.693 179.635 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 28.5 t-20 -66.64 -34.18 77.31 Favored 'General case' 0 N--CA 1.485 1.32 0 C-N-CA 123.531 0.732 . . . . 64.32 111.355 -178.16 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 75.9 mtt180 -68.57 -41.42 79.72 Favored 'General case' 0 CA--C 1.537 0.469 0 CA-C-N 115.601 -0.727 . . . . 74.43 109.383 174.521 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 11' ' ' TRP . . . . . 0.468 ' HH2' ' HG ' ' A' ' 102' ' ' LEU . 42.5 m95 -65.66 -29.26 69.8 Favored 'General case' 0 N--CA 1.477 0.884 0 O-C-N 123.458 0.474 . . . . 73.25 111.632 173.905 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 50.1 mt-30 -61.91 -50.08 73.61 Favored 'General case' 0 C--N 1.359 0.987 0 N-CA-C 108.568 -0.901 . . . . 63.54 108.568 172.506 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 14.6 tpt180 -57.67 -49.25 77.12 Favored 'General case' 0 CA--C 1.545 0.785 0 O-C-N 124.103 0.877 . . . . 74.32 111.411 -179.078 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 14' ' ' ILE . . . . . 0.458 HD11 HG21 ' A' ' 47' ' ' VAL . 65.6 mt -63.59 -48.34 87.28 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.359 0 C-N-CA 123.427 0.691 . . . . 72.04 111.051 -177.897 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . 0.463 ' HB1' ' OE1' ' A' ' 70' ' ' GLN . . . -60.72 -47.79 84.69 Favored 'General case' 0 N--CA 1.478 0.934 0 C-N-CA 124.296 1.038 . . . . 70.55 111.412 -177.813 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 96.3 mt -74.69 -34.13 62.59 Favored 'General case' 0 N--CA 1.481 1.11 0 CA-C-N 114.756 -1.111 . . . . 72.04 111.452 -176.531 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.495 ' O ' ' HG ' ' A' ' 21' ' ' LEU . 18.6 mt -63.95 -54.97 26.27 Favored 'General case' 0 C--N 1.36 1.058 0 N-CA-C 109.41 -0.589 . . . . 61.54 109.41 175.745 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 79.6 p -59.63 -35.38 74.28 Favored 'General case' 0 CA--C 1.544 0.749 0 O-C-N 123.894 0.746 . . . . 63.12 111.276 -178.568 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 6.2 tp-100 -62.29 -49.16 76.76 Favored 'General case' 0 N--CA 1.478 0.932 0 C-N-CA 123.503 0.721 . . . . 61.42 110.907 174.673 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 57.1 m -60.58 -43.21 97.57 Favored 'General case' 0 N--CA 1.472 0.665 0 C-N-CA 123.33 0.652 . . . . 54.01 110.444 177.023 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . 0.693 HD22 ' HA ' ' A' ' 33' ' ' LEU . 77.2 mt -68.75 -28.81 67.14 Favored 'General case' 0 C--N 1.346 0.415 0 C-N-CA 123.959 0.904 . . . . 74.45 110.288 -177.015 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.597 ' HA ' HD21 ' A' ' 78' ' ' LEU . 35.8 tp -68.65 -51.26 43.9 Favored 'General case' 0 C--N 1.354 0.779 0 O-C-N 123.859 0.725 . . . . 53.42 109.652 175.928 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 76.2 mm-40 -51.87 -54.61 27.21 Favored 'General case' 0 N--CA 1.478 0.94 0 O-C-N 124.091 0.869 . . . . 74.22 110.526 175.799 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . 0.553 ' HB3' ' HB2' ' A' ' 29' ' ' GLU . 95.5 mt -64.2 -37.27 86.87 Favored 'General case' 0 CA--C 1.545 0.768 0 CA-C-N 114.505 -1.225 . . . . 73.44 111.46 -174.196 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . 0.629 ' HB2' HD21 ' A' ' 33' ' ' LEU . . . -66.7 -38.12 86.09 Favored 'General case' 0 N--CA 1.489 1.511 0 C-N-CA 122.837 0.455 . . . . 71.3 111.378 177.73 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 87.1 mt-30 -67.01 -26.76 66.95 Favored 'General case' 0 N--CA 1.478 0.96 0 C-N-CA 123.84 0.856 . . . . 71.33 110.833 175.481 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 59.2 mtt180 -88.51 -15.19 35.89 Favored 'General case' 0 N--CA 1.481 1.091 0 C-N-CA 124.025 0.93 . . . . 74.32 111.874 175.086 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 81.44 35.77 22.15 Favored Glycine 0 C--N 1.352 1.443 0 C-N-CA 123.01 0.338 . . . . 60.43 113.285 178.999 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 29' ' ' GLU . . . . . 0.553 ' HB2' ' HB3' ' A' ' 24' ' ' LEU . 13.6 mm-40 -97.83 59.89 1.48 Allowed 'General case' 0 CA--C 1.545 0.774 0 C-N-CA 124.806 1.243 . . . . 74.24 109.527 -177.551 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 30' ' ' TRP . . . . . 0.401 ' O ' ' HG ' ' A' ' 34' ' ' LEU . 61.3 m95 -53.58 -38.71 64.17 Favored 'General case' 0 N--CA 1.485 1.319 0 C-N-CA 124.245 1.018 . . . . 71.52 112.028 -174.421 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 31' ' ' ASP . . . . . 0.43 ' O ' ' HG3' ' A' ' 35' ' ' GLN . 4.2 m-20 -58.0 -50.15 74.39 Favored 'General case' 0 N--CA 1.483 1.186 0 C-N-CA 123.743 0.817 . . . . 72.3 110.652 -179.272 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 95.7 mt -62.89 -31.52 72.58 Favored 'General case' 0 N--CA 1.479 0.993 0 C-N-CA 123.93 0.892 . . . . 61.51 111.755 -176.778 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . 0.693 ' HA ' HD22 ' A' ' 21' ' ' LEU . 11.2 mp -66.26 -45.78 79.35 Favored 'General case' 0 N--CA 1.478 0.956 0 C-N-CA 123.045 0.538 . . . . 74.23 110.54 173.131 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.401 ' HG ' ' O ' ' A' ' 30' ' ' TRP . 81.1 mt -69.31 -24.77 63.98 Favored 'General case' 0 CA--C 1.548 0.897 0 CA-C-N 115.84 -0.618 . . . . 75.15 111.712 179.43 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 35' ' ' GLN . . . . . 0.43 ' HG3' ' O ' ' A' ' 31' ' ' ASP . 95.1 mt-30 -77.84 -32.42 52.13 Favored 'General case' 0 N--CA 1.474 0.752 0 C-N-CA 122.822 0.449 . . . . 74.33 111.24 178.067 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 36' ' ' GLN . . . . . 0.569 ' HB2' HD21 ' A' ' 21' ' ' LEU . 87.0 mm-40 -90.67 -14.63 31.89 Favored 'General case' 0 N--CA 1.483 1.183 0 C-N-CA 123.101 0.56 . . . . 74.51 112.37 174.746 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 42.2 tt0 -47.83 -56.37 7.62 Favored 'General case' 0 N--CA 1.488 1.462 0 C-N-CA 124.104 0.962 . . . . 71.4 112.871 -176.998 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 91.9 t -60.88 -43.9 96.65 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.869 0 C-N-CA 123.057 0.543 . . . . 74.45 111.684 -175.3 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 44.7 p -68.47 -34.75 76.49 Favored 'General case' 0 N--CA 1.473 0.723 0 C-N-CA 122.903 0.481 . . . . 65.45 111.148 -178.725 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 66.2 t80 -69.02 -51.74 35.93 Favored 'General case' 0 CA--C 1.541 0.61 0 C-N-CA 123.707 0.803 . . . . 75.2 110.027 -179.478 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 72.7 mt -63.73 -43.46 96.45 Favored 'General case' 0 N--CA 1.473 0.71 0 O-C-N 124.254 0.972 . . . . 61.22 110.834 -179.284 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 53.3 tt0 -67.57 -45.81 74.52 Favored 'General case' 0 N--CA 1.476 0.837 0 C-N-CA 123.027 0.531 . . . . 74.3 111.102 -176.903 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 43' ' ' SER . . . . . 0.489 ' O ' HG23 ' A' ' 47' ' ' VAL . 68.7 m -65.74 -42.43 90.98 Favored 'General case' 0 N--CA 1.474 0.757 0 O-C-N 123.312 0.383 . . . . 61.44 111.457 -178.941 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 44' ' ' ILE . . . . . 0.423 HG13 HD13 ' A' ' 14' ' ' ILE . 15.7 tt -69.45 -35.74 68.25 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.019 0 O-C-N 123.077 0.235 . . . . 63.03 110.704 -178.147 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 9.6 mm-40 -59.12 -44.91 92.03 Favored 'General case' 0 C--N 1.359 1.019 0 C-N-CA 123.428 0.691 . . . . 73.5 110.527 171.726 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 90.0 m -58.61 -45.3 89.47 Favored 'General case' 0 CA--C 1.544 0.738 0 O-C-N 124.277 0.986 . . . . 74.13 111.261 178.604 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 47' ' ' VAL . . . . . 0.489 HG23 ' O ' ' A' ' 43' ' ' SER . 57.8 t -64.04 -47.85 88.53 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.172 0 C-N-CA 123.108 0.563 . . . . 70.32 111.443 -178.468 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 48' ' ' MET . . . . . . . . . . . . . 73.6 mtm -73.51 -24.02 60.1 Favored 'General case' 0 N--CA 1.48 1.034 0 CA-C-N 115.95 -0.568 . . . . 73.23 111.642 -177.397 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 9.8 tp10 -82.16 -35.33 28.52 Favored 'General case' 0 N--CA 1.475 0.777 0 C-N-CA 122.847 0.459 . . . . 72.51 110.396 178.169 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 12.3 mptt -84.62 151.46 24.48 Favored 'General case' 0 N--CA 1.479 0.991 0 C-N-CA 123.475 0.71 . . . . 62.15 110.874 -176.971 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 8.7 tt0 -76.23 132.9 40.18 Favored 'General case' 0 CA--C 1.543 0.707 0 CA-C-N 114.76 -1.109 . . . . 61.25 110.921 -175.131 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 24.1 m -74.46 125.65 89.58 Favored Pre-proline 0 CA--C 1.551 0.989 0 C-N-CA 123.712 0.805 . . . . 72.42 109.079 170.314 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 73.7 Cg_endo -72.45 152.05 54.19 Favored 'Trans proline' 0 C--N 1.373 1.864 0 C-N-CA 122.075 1.85 . . . . 62.04 112.777 -178.903 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 52.8 Cg_exo -58.72 -44.94 32.43 Favored 'Trans proline' 0 C--N 1.378 2.099 0 C-N-CA 123.716 2.944 . . . . 72.55 113.583 176.427 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . -63.83 80.38 0.05 OUTLIER Glycine 0 C--N 1.351 1.409 0 O-C-N 124.342 1.027 . . . . 40.23 114.117 -176.849 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 72.5 mt -130.49 111.61 21.08 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.673 0 C-N-CA 124.804 1.242 . . . . 65.31 108.752 178.522 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 57' ' ' THR . . . . . 0.467 ' H ' HD12 ' A' ' 60' ' ' ILE . 74.2 p -80.23 175.14 10.91 Favored 'General case' 0 N--CA 1.471 0.577 0 C-N-CA 123.47 0.708 . . . . 73.54 109.454 172.544 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 26.3 tpt180 -63.94 -38.96 93.01 Favored 'General case' 0 CA--C 1.541 0.622 0 CA-C-O 119.428 -0.32 . . . . 72.53 110.398 177.538 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 21.9 m -59.41 -47.39 85.62 Favored 'General case' 0 CA--C 1.548 0.889 0 C-N-CA 122.987 0.515 . . . . 71.22 110.854 178.252 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 60' ' ' ILE . . . . . 0.558 HD13 HG21 ' A' ' 4' ' ' THR . 93.5 mt -61.09 -42.17 92.18 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.149 0 C-N-CA 123.623 0.769 . . . . 63.41 110.372 176.159 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 64.4 tt0 -62.54 -38.7 91.01 Favored 'General case' 0 CA--C 1.547 0.837 0 C-N-CA 124.024 0.929 . . . . 70.33 111.092 -179.171 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 63.9 m-20 -67.68 -43.52 80.0 Favored 'General case' 0 N--CA 1.48 1.028 0 C-N-CA 123.433 0.693 . . . . 73.14 110.79 177.686 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 63' ' ' MET . . . . . . . . . . . . . 72.3 mtm -64.46 -52.39 58.23 Favored 'General case' 0 N--CA 1.48 1.054 0 O-C-N 123.72 0.638 . . . . 62.2 111.447 -178.356 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 64' ' ' VAL . . . . . 0.465 ' O ' HG13 ' A' ' 68' ' ' ILE . 92.4 t -60.71 -50.42 80.53 Favored 'Isoleucine or valine' 0 C--N 1.353 0.739 0 C-N-CA 123.71 0.804 . . . . 72.14 110.372 -179.747 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . 0.404 ' HB2' HD23 ' A' ' 109' ' ' LEU . . . -61.91 -36.5 81.52 Favored 'General case' 0 N--CA 1.484 1.231 0 O-C-N 123.432 0.457 . . . . 72.31 111.327 179.78 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -64.25 -38.81 96.41 Favored Glycine 0 C--N 1.345 1.038 0 O-C-N 123.73 0.644 . . . . 33.4 112.402 178.41 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 67' ' ' TYR . . . . . 0.528 ' O ' HG22 ' A' ' 71' ' ' THR . 17.9 m-30 -72.58 -42.32 64.71 Favored 'General case' 0 N--CA 1.471 0.577 0 C-N-CA 123.277 0.631 . . . . 74.35 111.452 179.371 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 68' ' ' ILE . . . . . 0.522 ' O ' ' HG ' ' A' ' 72' ' ' LEU . 68.0 mt -56.49 -52.22 55.52 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.112 0 N-CA-C 108.652 -0.87 . . . . 75.51 108.652 175.207 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 69' ' ' LYS . . . . . 0.549 ' HB2' ' HE2' ' A' ' 106' ' ' TYR . 13.5 tmtt? -53.35 -45.8 69.3 Favored 'General case' 0 N--CA 1.476 0.842 0 C-N-CA 125.25 1.42 . . . . 71.42 110.345 179.125 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 70' ' ' GLN . . . . . 0.463 ' OE1' ' HB1' ' A' ' 15' ' ' ALA . 61.4 tt0 -61.39 -49.1 78.25 Favored 'General case' 0 C--N 1.349 0.557 0 CA-C-N 115.428 -0.806 . . . . 73.43 111.328 -176.158 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 71' ' ' THR . . . . . 0.528 HG22 ' O ' ' A' ' 67' ' ' TYR . 1.0 OUTLIER -73.18 -23.59 60.44 Favored 'General case' 0 N--CA 1.474 0.736 0 CA-C-O 119.469 -0.3 . . . . 64.15 110.874 -178.871 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 72' ' ' LEU . . . . . 0.522 ' HG ' ' O ' ' A' ' 68' ' ' ILE . 37.4 mt -61.21 -55.61 30.2 Favored 'General case' 0 C--N 1.363 1.16 0 N-CA-C 108.878 -0.786 . . . . 63.42 108.878 173.175 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 73' ' ' ASP . . . . . 0.427 ' O ' ' HG ' ' A' ' 77' ' ' LEU . 4.5 m-20 -55.09 -61.89 2.02 Favored 'General case' 0 N--CA 1.482 1.133 0 O-C-N 124.505 1.128 . . . . 75.32 111.001 177.373 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 74' ' ' ASN . . . . . 0.529 ' HA ' HD22 ' A' ' 22' ' ' LEU . 83.0 m-20 -53.5 -54.7 33.41 Favored 'General case' 0 N--CA 1.478 0.933 0 O-C-N 124.506 1.129 . . . . 74.23 112.294 -172.292 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . 0.41 ' HB3' ' NH2' ' A' ' 98' ' ' ARG . 5.4 tt0 -73.03 -32.77 65.31 Favored 'General case' 0 CA--C 1.547 0.832 0 O-C-N 123.211 0.32 . . . . 72.43 111.516 -174.634 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 9.0 tt0 -64.9 -37.15 86.69 Favored 'General case' 0 N--CA 1.484 1.266 0 CA-C-O 120.764 0.316 . . . . 73.3 110.197 175.43 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . 0.427 ' HG ' ' O ' ' A' ' 73' ' ' ASP . 96.8 mt -68.72 -34.92 76.45 Favored 'General case' 0 CA--C 1.539 0.539 0 CA-C-N 116.057 -0.52 . . . . 61.34 110.198 176.142 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . 0.597 HD21 ' HA ' ' A' ' 22' ' ' LEU . 57.3 mt -61.04 -39.88 91.47 Favored 'General case' 0 N--CA 1.483 1.193 0 C-N-CA 122.89 0.476 . . . . 73.12 111.03 171.675 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 48.8 mmtm -65.01 -45.57 84.97 Favored 'General case' 0 C--O 1.22 -0.449 0 CA-C-N 116.416 -0.356 . . . . 74.02 110.334 178.224 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -71.32 -25.24 75.83 Favored Glycine 0 CA--C 1.531 1.081 0 O-C-N 124.104 0.877 . . . . 74.15 113.851 -179.294 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 6.4 tt -86.05 -64.26 1.18 Allowed 'General case' 0 N--CA 1.48 1.052 0 C-N-CA 123.312 0.645 . . . . 64.22 109.613 -178.002 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 25.6 mt . . . . . 0 N--CA 1.479 1.008 0 C-N-CA 123.914 0.885 . . . . 71.3 112.167 -168.511 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 75.7 mt . . . . . 0 CA--C 1.54 0.582 0 CA-C-O 120.792 0.33 . . . . 71.2 110.852 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 62.6 mt -90.05 -40.01 12.57 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.69 0 N-CA-C 108.259 -1.015 . . . . 74.22 108.259 174.161 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 178.92 -56.67 0.09 OUTLIER Glycine 0 C--N 1.345 1.032 0 CA-C-N 114.446 -1.252 . . . . 75.33 110.176 177.037 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 13.8 pt20 -81.27 175.32 10.7 Favored 'General case' 0 C--O 1.244 0.784 0 C-N-CA 123.626 0.77 . . . . 63.42 110.764 176.811 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 35.0 p -83.99 51.67 2.11 Favored 'General case' 0 CA--C 1.552 1.042 0 C-N-CA 124.369 1.067 . . . . 65.11 110.666 177.937 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 15.2 t -67.56 -9.76 45.62 Favored 'General case' 0 N--CA 1.479 1.01 0 C-N-CA 124.189 0.996 . . . . 64.32 112.837 -174.325 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 98' ' ' ARG . . . . . 0.594 HH11 HD22 ' A' ' 102' ' ' LEU . 2.0 tmm_? -51.28 -50.34 59.47 Favored 'General case' 0 N--CA 1.479 1.003 0 C-N-CA 125.265 1.426 . . . . 74.41 111.506 -176.439 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 24.7 tm0? -57.26 -53.3 59.71 Favored 'General case' 0 N--CA 1.474 0.752 0 C-N-CA 124.025 0.93 . . . . 74.43 110.053 -176.887 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 61.5 tttp -65.02 -49.16 71.25 Favored 'General case' 0 C--O 1.218 -0.567 0 O-C-N 124.016 0.823 . . . . 74.3 111.425 -176.589 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 51.1 m -60.27 -43.98 95.72 Favored 'General case' 0 CA--C 1.542 0.649 0 C-N-CA 123.587 0.755 . . . . 71.21 111.584 -173.877 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 102' ' ' LEU . . . . . 0.594 HD22 HH11 ' A' ' 98' ' ' ARG . 10.8 mp -78.45 -35.64 46.48 Favored 'General case' 0 N--CA 1.48 1.026 0 N-CA-C 112.306 0.484 . . . . 71.21 112.306 -179.08 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 26.9 t-20 -69.41 -37.84 77.65 Favored 'General case' 0 N--CA 1.484 1.254 0 CA-C-O 121.035 0.445 . . . . 63.45 110.392 179.727 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -73.72 -36.51 65.21 Favored 'General case' 0 N--CA 1.47 0.561 0 CA-C-N 115.615 -0.721 . . . . 74.24 109.164 176.768 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -61.56 -36.76 81.53 Favored 'General case' 0 C--N 1.358 0.937 0 O-C-N 123.605 0.566 . . . . 73.53 110.892 173.715 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 106' ' ' TYR . . . . . 0.549 ' HE2' ' HB2' ' A' ' 69' ' ' LYS . 2.3 t80 -67.45 -42.03 83.75 Favored 'General case' 0 CA--C 1.541 0.614 0 N-CA-C 108.964 -0.754 . . . . 73.42 108.964 176.762 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -67.01 -31.79 78.97 Favored Glycine 0 CA--C 1.535 1.283 0 O-C-N 123.59 0.556 . . . . 54.24 113.449 177.809 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 52.6 mtp180 -71.7 -41.59 68.43 Favored 'General case' 0 N--CA 1.474 0.759 0 C-N-CA 123.694 0.798 . . . . 75.25 109.643 176.668 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 109' ' ' LEU . . . . . 0.404 HD23 ' HB2' ' A' ' 65' ' ' ALA . 34.8 tp -66.73 -46.59 75.01 Favored 'General case' 0 C--N 1.351 0.635 0 O-C-N 124.248 0.968 . . . . 71.15 110.021 -179.471 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 33.8 t -66.07 -36.16 82.45 Favored 'General case' 0 CA--C 1.536 0.439 0 C-N-CA 124.221 1.008 . . . . 73.52 110.548 177.556 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . -77.84 -66.18 1.8 Allowed Glycine 0 C--N 1.36 1.878 0 C-N-CA 120.692 -0.766 . . . . 73.25 112.702 -176.728 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 112' ' ' MET . . . . . . . . . . . . . 41.7 mmm -99.13 -72.89 0.64 Allowed 'General case' 0 N--CA 1.481 1.101 0 CA-C-N 118.315 1.057 . . . . 72.32 111.647 172.524 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER 171.4 33.27 0.0 OUTLIER 'General case' 0 N--CA 1.487 1.415 0 C-N-CA 125.85 1.66 . . . . 75.55 109.666 -178.66 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 11.5 tp . . . . . 0 N--CA 1.491 1.604 0 C-N-CA 125.242 1.417 . . . . 73.21 113.941 170.011 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 25.0 ptm . . . . . 0 N--CA 1.485 1.28 0 N-CA-C 111.936 0.347 . . . . 71.42 111.936 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 28.6 m -62.69 -40.19 96.36 Favored 'General case' 0 N--CA 1.482 1.127 0 C-N-CA 122.931 0.492 . . . . 74.15 111.531 -176.111 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 14.3 m -65.59 -35.99 82.44 Favored 'General case' 0 N--CA 1.476 0.871 0 C-N-CA 122.964 0.505 . . . . 72.5 110.467 176.331 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 4' ' ' THR . . . . . 0.555 ' HA ' ' HG2' ' A' ' 53' ' ' PRO . 33.5 m -66.4 -50.0 64.93 Favored 'General case' 0 C--N 1.361 1.086 0 C-N-CA 123.602 0.761 . . . . 74.1 111.3 179.241 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 59.0 t -60.45 -40.02 82.91 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.084 0 C-N-CA 123.401 0.68 . . . . 73.34 110.022 179.173 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 6' ' ' GLU . . . . . 0.478 ' O ' ' HG3' ' A' ' 10' ' ' ARG . 0.2 OUTLIER -63.68 -41.42 98.15 Favored 'General case' 0 CA--C 1.548 0.895 0 CA-C-N 115.326 -0.852 . . . . 62.42 110.293 176.823 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 7' ' ' PHE . . . . . 0.598 ' HD1' HH11 ' A' ' 10' ' ' ARG . 39.4 t80 -69.44 -40.71 77.04 Favored 'General case' 0 N--CA 1.483 1.198 0 C-N-CA 123.968 0.907 . . . . 73.23 111.316 -176.665 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 8' ' ' ILE . . . . . 0.465 ' O ' ' HG3' ' A' ' 12' ' ' GLN . 76.7 mt -60.73 -42.48 92.26 Favored 'Isoleucine or valine' 0 C--N 1.353 0.733 0 N-CA-C 108.593 -0.892 . . . . 73.21 108.593 172.863 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 3.3 t-20 -66.46 -27.62 67.95 Favored 'General case' 0 N--CA 1.475 0.823 0 O-C-N 124.354 1.034 . . . . 72.52 111.426 -179.835 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . 0.633 ' HB3' HG22 ' A' ' 47' ' ' VAL . 53.8 mtt180 -71.36 -39.02 71.54 Favored 'General case' 0 N--CA 1.475 0.802 0 C-N-CA 123.442 0.697 . . . . 74.23 110.764 174.465 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 11' ' ' TRP . . . . . 0.452 ' CD1' HG13 ' A' ' 64' ' ' VAL . 92.1 m95 -75.17 -24.18 57.84 Favored 'General case' 0 N--CA 1.477 0.875 0 CA-C-N 116.25 -0.432 . . . . 71.54 111.654 173.871 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . 0.504 ' HG2' ' CE2' ' A' ' 67' ' ' TYR . 55.7 mt-30 -68.59 -39.74 80.81 Favored 'General case' 0 N--CA 1.473 0.692 0 N-CA-C 108.743 -0.836 . . . . 65.52 108.743 170.11 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 22.4 tpt180 -60.19 -53.51 56.84 Favored 'General case' 0 CA--C 1.545 0.759 0 C-N-CA 124.174 0.99 . . . . 75.21 110.658 178.748 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 14' ' ' ILE . . . . . 0.477 HG22 ' OG1' ' A' ' 71' ' ' THR . 49.1 mt -66.32 -42.74 91.22 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.006 0 O-C-N 123.338 0.399 . . . . 71.54 110.45 -178.466 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . 0.598 ' HA ' ' HB ' ' A' ' 71' ' ' THR . . . -60.34 -48.04 83.46 Favored 'General case' 0 N--CA 1.486 1.337 0 C-N-CA 123.249 0.619 . . . . 43.12 112.1 -178.776 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 92.1 mt -70.11 -44.36 69.14 Favored 'General case' 0 N--CA 1.481 1.098 0 O-C-N 124.304 1.003 . . . . 72.32 110.856 -175.985 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.495 ' O ' ' HG ' ' A' ' 21' ' ' LEU . 49.3 mt -62.62 -53.43 54.68 Favored 'General case' 0 C--N 1.354 0.799 0 O-C-N 123.606 0.566 . . . . 72.22 110.527 179.982 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 94.9 p -60.8 -37.84 83.31 Favored 'General case' 0 N--CA 1.479 0.975 0 C-N-CA 123.338 0.655 . . . . 44.15 111.432 -178.51 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 6.9 tp-100 -62.65 -48.11 80.78 Favored 'General case' 0 C--N 1.36 1.025 0 O-C-N 123.939 0.775 . . . . 71.45 110.348 177.699 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . 0.407 ' O ' ' HG ' ' A' ' 24' ' ' LEU . 65.2 m -58.91 -49.04 79.29 Favored 'General case' 0 C--O 1.213 -0.855 0 O-C-N 123.944 0.777 . . . . 41.4 110.3 176.405 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . 0.587 HD22 ' HA ' ' A' ' 33' ' ' LEU . 79.7 mt -64.43 -31.33 72.5 Favored 'General case' 0 N--CA 1.475 0.807 0 C-N-CA 123.93 0.892 . . . . 71.24 111.28 -176.471 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.603 ' HA ' HD21 ' A' ' 78' ' ' LEU . 69.9 tp -67.42 -55.42 13.74 Favored 'General case' 0 C--N 1.353 0.738 0 C-N-CA 123.191 0.596 . . . . 54.43 109.766 176.996 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 45.5 mt-10 -55.05 -50.69 68.47 Favored 'General case' 0 C--N 1.352 0.689 0 O-C-N 124.635 1.209 . . . . 70.3 110.549 179.933 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . 0.487 ' HB3' ' HB2' ' A' ' 29' ' ' GLU . 93.7 mt -63.38 -36.22 82.98 Favored 'General case' 0 CA--C 1.544 0.736 0 C-N-CA 124.508 1.123 . . . . 71.33 111.251 -177.46 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -63.9 -41.16 97.77 Favored 'General case' 0 N--CA 1.485 1.277 0 C-N-CA 122.87 0.468 . . . . 73.24 111.279 174.948 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 86.3 mt-30 -71.41 -23.38 61.86 Favored 'General case' 0 N--CA 1.483 1.195 0 C-N-CA 123.892 0.877 . . . . 73.32 111.289 177.958 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 89.0 mtt180 -91.98 -11.59 35.66 Favored 'General case' 0 N--CA 1.481 1.113 0 C-N-CA 123.943 0.897 . . . . 75.32 111.685 176.649 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 88.21 6.98 73.95 Favored Glycine 0 C--N 1.349 1.284 0 CA-C-O 119.924 -0.375 . . . . 73.11 113.941 178.549 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 29' ' ' GLU . . . . . 0.487 ' HB2' ' HB3' ' A' ' 24' ' ' LEU . 44.2 mm-40 -79.01 55.91 1.87 Allowed 'General case' 0 N--CA 1.484 1.23 0 C-N-CA 124.805 1.242 . . . . 65.42 111.643 176.424 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 30' ' ' TRP . . . . . 0.624 ' HH2' HD22 ' A' ' 81' ' ' LEU . 93.8 m95 -64.17 -27.51 69.12 Favored 'General case' 0 N--CA 1.481 1.08 0 C-N-CA 124.162 0.985 . . . . 54.32 111.904 -177.492 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 4.9 m-20 -56.94 -47.86 79.67 Favored 'General case' 0 CA--C 1.539 0.536 0 C-N-CA 124.12 0.968 . . . . 70.02 110.353 176.275 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 98.4 mt -64.84 -26.8 68.49 Favored 'General case' 0 CA--C 1.546 0.826 0 CA-C-N 115.574 -0.739 . . . . 74.41 111.204 179.983 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . 0.587 ' HA ' HD22 ' A' ' 21' ' ' LEU . 9.8 mp -68.93 -39.63 79.5 Favored 'General case' 0 N--CA 1.484 1.249 0 C-N-CA 122.465 0.306 . . . . 73.0 110.458 171.34 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.42 ' HG ' ' O ' ' A' ' 30' ' ' TRP . 75.7 mt -66.69 -37.92 85.71 Favored 'General case' 0 N--CA 1.487 1.385 0 O-C-N 123.585 0.553 . . . . 65.24 111.975 -179.681 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 1.3 mp0 -71.67 -49.19 42.0 Favored 'General case' 0 N--CA 1.485 1.315 0 C-N-CA 122.638 0.375 . . . . 74.34 110.957 177.598 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 36' ' ' GLN . . . . . 0.476 ' HB2' HD21 ' A' ' 21' ' ' LEU . 87.4 mm-40 -74.42 -13.44 60.72 Favored 'General case' 0 N--CA 1.478 0.955 0 C-N-CA 123.22 0.608 . . . . 72.23 111.96 -179.563 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . 0.512 ' O ' ' HG ' ' A' ' 41' ' ' LEU . 32.4 tt0 -48.51 -61.14 2.17 Favored 'General case' 0 N--CA 1.486 1.332 0 C-N-CA 124.672 1.189 . . . . 72.42 111.885 177.584 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 66.0 t -53.55 -46.27 59.91 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.346 0 O-C-N 124.322 1.014 . . . . 73.23 111.235 -176.517 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 44.6 m -65.66 -38.51 89.51 Favored 'General case' 0 CA--C 1.544 0.748 0 CA-C-N 114.99 -1.005 . . . . 54.45 111.727 179.818 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 40' ' ' TYR . . . . . 0.414 ' O ' HG22 ' A' ' 44' ' ' ILE . 40.0 t80 -69.29 -46.08 68.04 Favored 'General case' 0 N--CA 1.476 0.87 0 C-N-CA 123.056 0.542 . . . . 73.21 110.564 -177.758 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . 0.512 ' HG ' ' O ' ' A' ' 37' ' ' GLU . 49.9 mt -55.75 -51.79 66.15 Favored 'General case' 0 C--N 1.355 0.829 0 O-C-N 124.673 1.233 . . . . 63.2 109.81 177.382 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 50.1 tt0 -54.54 -48.02 72.48 Favored 'General case' 0 C--N 1.355 0.812 0 CA-C-N 114.62 -1.173 . . . . 45.23 111.017 179.404 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 43' ' ' SER . . . . . 0.54 ' O ' HG23 ' A' ' 47' ' ' VAL . 67.5 m -59.03 -62.18 2.08 Favored 'General case' 0 C--N 1.349 0.552 0 O-C-N 124.057 0.848 . . . . 74.35 111.307 -177.721 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 44' ' ' ILE . . . . . 0.414 HG22 ' O ' ' A' ' 40' ' ' TYR . 14.6 tt -64.52 -34.78 71.84 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.955 0 O-C-N 123.571 0.544 . . . . 72.0 111.628 -171.46 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . 0.538 ' HG2' HD22 ' A' ' 92' ' ' LEU . 17.6 mm-40 -58.93 -53.02 63.15 Favored 'General case' 0 N--CA 1.484 1.237 0 C-N-CA 122.663 0.385 . . . . 70.03 110.539 171.947 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 87.2 m -56.43 -40.31 74.54 Favored 'General case' 0 C--N 1.358 0.949 0 C-N-CA 123.502 0.721 . . . . 71.01 111.486 -178.654 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 47' ' ' VAL . . . . . 0.633 HG22 ' HB3' ' A' ' 10' ' ' ARG . 44.9 t -70.36 -41.22 78.43 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.078 0 C-N-CA 123.406 0.682 . . . . 73.33 111.293 -177.055 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 48' ' ' MET . . . . . . . . . . . . . 77.3 mtm -71.34 -30.8 66.62 Favored 'General case' 0 N--CA 1.486 1.361 0 C-N-CA 122.505 0.322 . . . . 75.32 111.667 179.519 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 62.3 mt-10 -82.57 -8.3 59.61 Favored 'General case' 0 N--CA 1.482 1.167 0 C-N-CA 123.314 0.646 . . . . 73.33 111.334 176.332 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -90.41 139.9 30.23 Favored 'General case' 0 N--CA 1.469 0.502 0 C-N-CA 123.002 0.521 . . . . 72.24 110.407 -176.002 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 7.7 tt0 -68.78 140.97 55.31 Favored 'General case' 0 CA--C 1.537 0.477 0 C-N-CA 124.172 0.989 . . . . 74.21 109.893 174.784 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 52' ' ' THR . . . . . 0.433 ' HA ' ' HD3' ' A' ' 53' ' ' PRO . 25.2 m -83.76 128.18 64.5 Favored Pre-proline 0 CA--C 1.547 0.844 0 N-CA-C 109.548 -0.538 . . . . 63.4 109.548 174.709 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 53' ' ' PRO . . . . . 0.555 ' HG2' ' HA ' ' A' ' 4' ' ' THR . 25.7 Cg_exo -65.57 155.07 70.89 Favored 'Trans proline' 0 C--N 1.376 1.99 0 C-N-CA 123.086 2.524 . . . . 52.02 113.548 -179.422 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 54' ' ' PRO . . . . . 0.485 ' HA ' HD11 ' A' ' 113' ' ' LEU . 37.9 Cg_endo -66.1 -47.46 3.47 Favored 'Trans proline' 0 C--N 1.382 2.292 0 C-N-CA 123.165 2.577 . . . . 73.43 112.687 176.736 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . -75.34 78.89 1.09 Allowed Glycine 0 C--N 1.343 0.938 0 O-C-N 123.748 0.655 . . . . 72.2 113.882 -172.824 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 65.4 mt -116.88 117.16 54.49 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.651 0 N-CA-C 108.134 -1.062 . . . . 72.14 108.134 173.99 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 62.8 p -95.92 -168.05 1.69 Allowed 'General case' 0 N--CA 1.476 0.866 0 C-N-CA 123.663 0.785 . . . . 75.11 110.024 179.11 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 32.5 tpt180 -58.82 -63.76 1.18 Allowed 'General case' 0 C--N 1.355 0.819 0 C-N-CA 124.025 0.93 . . . . 72.21 110.271 175.355 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 13.1 m -59.84 -38.04 80.94 Favored 'General case' 0 C--N 1.353 0.73 0 O-C-N 123.989 0.805 . . . . 53.42 111.655 -175.111 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 60' ' ' ILE . . . . . 0.485 HD13 HG21 ' A' ' 4' ' ' THR . 94.5 mt -61.62 -48.79 87.11 Favored 'Isoleucine or valine' 0 C--N 1.357 0.923 0 O-C-N 123.833 0.708 . . . . 75.44 110.28 176.71 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 49.8 tt0 -59.26 -41.69 89.41 Favored 'General case' 0 N--CA 1.479 1.022 0 C-N-CA 123.259 0.623 . . . . 75.34 111.261 -179.211 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 23.6 m-20 -74.04 -32.81 63.5 Favored 'General case' 0 N--CA 1.476 0.833 0 N-CA-C 112.297 0.48 . . . . 63.44 112.297 -178.54 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 63' ' ' MET . . . . . . . . . . . . . 67.8 mtm -71.51 -43.55 66.29 Favored 'General case' 0 N--CA 1.486 1.374 0 CA-C-N 118.194 0.452 . . . . 74.21 110.432 177.408 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 64' ' ' VAL . . . . . 0.483 ' O ' HG13 ' A' ' 68' ' ' ILE . 78.9 t -63.65 -61.64 1.58 Allowed 'Isoleucine or valine' 0 CA--C 1.54 0.576 0 O-C-N 123.936 0.772 . . . . 73.42 109.443 177.68 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -63.26 -26.45 68.79 Favored 'General case' 0 N--CA 1.485 1.287 0 C-N-CA 123.433 0.693 . . . . 31.31 112.442 -179.201 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -66.17 -46.69 78.11 Favored Glycine 0 C--N 1.343 0.958 0 N-CA-C 111.581 -0.607 . . . . 40.43 111.581 174.797 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 67' ' ' TYR . . . . . 0.504 ' CE2' ' HG2' ' A' ' 12' ' ' GLN . 12.6 m-30 -77.15 -23.17 51.67 Favored 'General case' 0 N--CA 1.468 0.446 0 CA-C-O 118.8 -0.619 . . . . 65.24 112.12 178.095 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 68' ' ' ILE . . . . . 0.483 HG13 ' O ' ' A' ' 64' ' ' VAL . 49.4 mt -68.96 -53.68 24.72 Favored 'Isoleucine or valine' 0 C--N 1.363 1.156 0 N-CA-C 108.04 -1.096 . . . . 73.24 108.04 172.472 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 69' ' ' LYS . . . . . 0.511 ' HB2' ' HE2' ' A' ' 106' ' ' TYR . 49.9 tptt -54.14 -46.18 72.15 Favored 'General case' 0 N--CA 1.487 1.394 0 C-N-CA 123.641 0.776 . . . . 75.43 110.962 178.106 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 62.9 tt0 -57.84 -50.2 74.09 Favored 'General case' 0 CA--C 1.537 0.456 0 O-C-N 124.3 1.0 . . . . 72.35 109.99 179.532 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 71' ' ' THR . . . . . 0.598 ' HB ' ' HA ' ' A' ' 15' ' ' ALA . 11.5 t -74.16 -20.44 60.22 Favored 'General case' 0 C--O 1.207 -1.179 0 CA-C-O 118.539 -0.743 . . . . 71.3 111.632 -178.818 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 72' ' ' LEU . . . . . 0.56 HD21 ' HB3' ' A' ' 102' ' ' LEU . 17.9 mt -70.15 -40.04 74.98 Favored 'General case' 0 N--CA 1.484 1.237 0 CA-C-N 118.622 0.646 . . . . 73.22 109.436 175.464 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 71.5 m-20 -66.88 -52.54 42.17 Favored 'General case' 0 C--N 1.342 0.266 0 O-C-N 123.898 0.749 . . . . 62.23 109.799 178.808 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 74' ' ' ASN . . . . . 0.518 ' HA ' HD22 ' A' ' 22' ' ' LEU . 53.9 m-20 -58.04 -50.45 73.39 Favored 'General case' 0 N--CA 1.479 1.025 0 C-N-CA 123.661 0.785 . . . . 73.24 110.932 -179.523 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . 0.495 ' O ' ' HG2' ' A' ' 79' ' ' LYS . 4.8 tp10 -57.35 -60.2 3.99 Favored 'General case' 0 N--CA 1.473 0.724 0 C-N-CA 124.162 0.985 . . . . 72.32 110.564 179.674 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 7.8 tt0 -61.29 -35.48 77.45 Favored 'General case' 0 N--CA 1.479 1.002 0 C-N-CA 123.985 0.914 . . . . 71.21 111.658 -171.525 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . 0.418 ' O ' ' HB2' ' A' ' 81' ' ' LEU . 63.5 mt -60.35 -51.29 70.13 Favored 'General case' 0 C--N 1.357 0.902 0 O-C-N 123.862 0.726 . . . . 74.14 109.426 173.579 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . 0.603 HD21 ' HA ' ' A' ' 22' ' ' LEU . 75.6 mt -59.03 -39.4 81.83 Favored 'General case' 0 N--CA 1.484 1.246 0 O-C-N 123.765 0.666 . . . . 74.24 112.45 177.952 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 79' ' ' LYS . . . . . 0.495 ' HG2' ' O ' ' A' ' 75' ' ' GLU . 7.8 mmpt? -65.5 -40.19 92.76 Favored 'General case' 0 CA--C 1.546 0.802 0 N-CA-C 109.618 -0.512 . . . . 70.24 109.618 -178.079 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -85.5 -8.87 79.99 Favored Glycine 0 C--N 1.349 1.257 0 CA-C-N 115.347 -0.842 . . . . 61.22 113.586 176.291 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 81' ' ' LEU . . . . . 0.624 HD22 ' HH2' ' A' ' 30' ' ' TRP . 2.5 tt -81.99 -41.85 20.18 Favored 'General case' 0 N--CA 1.479 0.996 0 C-N-CA 123.114 0.565 . . . . 72.55 109.635 178.693 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 82' ' ' LEU . . . . . 0.436 ' HG ' ' O ' ' A' ' 78' ' ' LEU . 97.1 mt . . . . . 0 N--CA 1.482 1.144 0 N-CA-C 112.68 0.622 . . . . 70.23 112.68 -173.976 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 92' ' ' LEU . . . . . 0.538 HD22 ' HG2' ' A' ' 45' ' ' GLU . 20.8 mt . . . . . 0 N--CA 1.474 0.767 0 CA-C-O 118.459 -0.781 . . . . 71.43 109.003 . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 65.3 mt -42.52 -48.24 1.1 Allowed 'Isoleucine or valine' 0 C--N 1.367 1.368 0 C-N-CA 124.151 0.98 . . . . 65.22 110.341 167.915 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 169.87 -133.97 3.0 Favored Glycine 0 C--N 1.344 1.009 0 CA-C-N 115.534 -0.757 . . . . 23.21 111.424 171.211 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -69.91 154.72 41.59 Favored 'General case' 0 CA--C 1.548 0.871 0 C-N-CA 123.077 0.551 . . . . 70.53 110.919 173.493 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 19.6 m 66.12 -82.91 0.03 OUTLIER 'General case' 0 N--CA 1.48 1.068 0 C-N-CA 125.15 1.38 . . . . 73.34 110.749 -175.766 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 97' ' ' THR . . . . . 0.462 ' HB ' ' HD3' ' A' ' 98' ' ' ARG . 28.6 m 47.02 -82.35 0.01 OUTLIER 'General case' 0 CA--C 1.553 1.072 0 C-N-CA 126.23 1.812 . . . . 55.2 114.795 175.676 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 98' ' ' ARG . . . . . 0.606 ' H ' ' HD3' ' A' ' 98' ' ' ARG . 0.8 OUTLIER -57.48 -56.44 21.79 Favored 'General case' 0 N--CA 1.477 0.919 0 C-N-CA 124.593 1.157 . . . . 74.41 111.539 -164.993 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 51.3 tt0 -61.28 -54.89 38.27 Favored 'General case' 0 CA--C 1.539 0.547 0 CA-C-N 114.672 -1.149 . . . . 64.21 110.596 -174.142 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 87.9 tttt -64.99 -53.65 42.85 Favored 'General case' 0 N--CA 1.476 0.854 0 O-C-N 123.719 0.637 . . . . 73.22 111.704 -176.034 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 44.8 t -57.48 -49.26 76.87 Favored 'General case' 0 N--CA 1.478 0.938 0 C-N-CA 123.773 0.829 . . . . 72.33 111.772 -174.747 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 102' ' ' LEU . . . . . 0.56 ' HB3' HD21 ' A' ' 72' ' ' LEU . 9.4 mp -77.49 -27.03 51.78 Favored 'General case' 0 CA--C 1.556 1.187 0 O-C-N 123.586 0.554 . . . . 62.55 111.55 -176.203 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 24.9 t-20 -70.1 -41.35 74.12 Favored 'General case' 0 N--CA 1.49 1.574 0 C-N-CA 122.64 0.376 . . . . 74.12 111.119 173.946 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -68.89 -41.22 78.59 Favored 'General case' 0 N--CA 1.476 0.871 0 C-N-CA 123.536 0.734 . . . . 71.3 109.194 178.035 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -60.08 -40.11 88.42 Favored 'General case' 0 C--N 1.352 0.694 0 O-C-N 124.07 0.856 . . . . 40.4 110.478 176.284 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 106' ' ' TYR . . . . . 0.511 ' HE2' ' HB2' ' A' ' 69' ' ' LYS . 4.6 t80 -64.2 -49.5 71.76 Favored 'General case' 0 N--CA 1.475 0.784 0 C-N-CA 123.695 0.798 . . . . 73.24 110.596 178.278 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -63.96 -40.49 98.31 Favored Glycine 0 C--N 1.353 1.513 0 O-C-N 123.431 0.457 . . . . 31.44 113.019 -175.65 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 93.8 mtt180 -74.49 -30.22 61.74 Favored 'General case' 0 N--CA 1.469 0.49 0 C-N-CA 123.446 0.698 . . . . 72.4 110.603 178.239 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 52.4 tp -64.17 -45.06 90.09 Favored 'General case' 0 N--CA 1.484 1.238 0 C-N-CA 123.368 0.667 . . . . 75.21 110.272 173.895 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 39.8 t -63.0 -48.75 77.47 Favored 'General case' 0 CA--C 1.538 0.484 0 O-C-N 124.558 1.161 . . . . 63.35 110.149 -179.521 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . -81.22 -61.45 2.1 Favored Glycine 0 C--N 1.349 1.295 0 C-N-CA 121.243 -0.503 . . . . 62.03 113.515 -176.565 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 112' ' ' MET . . . . . . . . . . . . . 64.6 mmm -93.44 -65.72 0.97 Allowed 'General case' 0 N--CA 1.484 1.271 0 N-CA-C 114.127 1.158 . . . . 72.04 114.127 -173.351 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 113' ' ' LEU . . . . . 0.485 HD11 ' HA ' ' A' ' 54' ' ' PRO . 5.8 tt 179.94 -36.29 0.01 OUTLIER 'General case' 0 N--CA 1.474 0.771 0 C-N-CA 124.099 0.96 . . . . 74.11 108.517 -168.947 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 114' ' ' LEU . . . . . 0.442 ' HB2' ' O ' ' A' ' 113' ' ' LEU . 3.5 tt . . . . . 0 N--CA 1.498 1.936 0 C-N-CA 129.263 3.025 . . . . 63.12 106.367 178.284 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 22.1 ttt . . . . . 0 N--CA 1.485 1.313 0 CA-C-O 119.628 -0.225 . . . . 65.42 110.777 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 36.8 p -52.36 -45.84 65.91 Favored 'General case' 0 N--CA 1.487 1.378 0 C-N-CA 123.736 0.815 . . . . 75.34 112.394 -175.221 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 17.4 m -67.81 -33.47 74.87 Favored 'General case' 0 CA--C 1.552 1.051 0 C-N-CA 123.46 0.704 . . . . 73.1 111.497 -178.547 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 4' ' ' THR . . . . . 0.545 HG21 HD13 ' A' ' 60' ' ' ILE . 60.2 m -70.94 -41.18 71.49 Favored 'General case' 0 N--CA 1.475 0.793 0 C-N-CA 123.705 0.802 . . . . 23.31 110.739 177.536 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 95.5 t -66.67 -37.56 79.78 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.835 0 C-N-CA 123.353 0.661 . . . . 70.21 109.62 -179.168 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 6' ' ' GLU . . . . . 0.401 ' O ' ' HG3' ' A' ' 10' ' ' ARG . 57.2 mt-10 -62.49 -48.69 78.46 Favored 'General case' 0 C--N 1.356 0.861 0 O-C-N 123.727 0.642 . . . . 43.41 110.242 171.344 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 30.4 t80 -61.34 -46.17 91.36 Favored 'General case' 0 N--CA 1.481 1.102 0 C-N-CA 124.268 1.027 . . . . 63.21 111.249 -174.086 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 82.9 mt -65.57 -41.31 90.49 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.785 0 C-N-CA 123.789 0.835 . . . . 70.41 109.741 176.208 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 3.7 t-20 -65.6 -28.17 68.94 Favored 'General case' 0 N--CA 1.484 1.26 0 C-N-CA 123.02 0.528 . . . . 61.41 111.426 179.452 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . 0.425 ' HD3' HG22 ' A' ' 47' ' ' VAL . 62.4 mtt85 -70.11 -46.9 63.84 Favored 'General case' 0 C--O 1.224 -0.244 0 N-CA-C 109.168 -0.679 . . . . 74.0 109.168 174.504 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 11' ' ' TRP . . . . . 0.432 ' CD1' HG13 ' A' ' 64' ' ' VAL . 91.1 m95 -68.86 -20.96 64.29 Favored 'General case' 0 N--CA 1.478 0.935 0 O-C-N 123.385 0.428 . . . . 62.0 111.818 175.731 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 53.9 mt-30 -65.97 -52.19 51.72 Favored 'General case' 0 N--CA 1.477 0.921 0 N-CA-C 108.016 -1.105 . . . . 73.41 108.016 169.323 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 14.8 tpt180 -55.61 -44.86 77.44 Favored 'General case' 0 CA--C 1.547 0.856 0 O-C-N 124.267 0.98 . . . . 73.13 111.224 -179.368 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 14' ' ' ILE . . . . . 0.634 HD11 HG21 ' A' ' 47' ' ' VAL . 77.8 mt -70.41 -50.25 47.3 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.81 0 C-N-CA 123.775 0.83 . . . . 72.45 111.096 -177.011 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -58.54 -44.57 89.66 Favored 'General case' 0 N--CA 1.485 1.275 0 C-N-CA 123.688 0.795 . . . . 73.14 111.263 -178.8 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 95.1 mt -71.92 -43.58 65.09 Favored 'General case' 0 N--CA 1.475 0.821 0 CA-C-N 114.514 -1.221 . . . . 63.14 110.918 -177.879 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.427 ' O ' ' HG ' ' A' ' 21' ' ' LEU . 17.7 mt -63.1 -44.59 95.26 Favored 'General case' 0 N--CA 1.487 1.396 0 CA-C-O 119.227 -0.416 . . . . 64.45 110.992 178.772 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 81.0 p -65.08 -39.58 93.41 Favored 'General case' 0 N--CA 1.474 0.773 0 C-N-CA 123.006 0.522 . . . . 54.03 110.667 -178.961 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 19' ' ' GLN . . . . . 0.439 HE21 HE21 ' A' ' 70' ' ' GLN . 6.6 tp-100 -59.66 -47.98 83.46 Favored 'General case' 0 C--N 1.359 1.014 0 O-C-N 123.894 0.746 . . . . 73.21 110.33 174.47 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 68.1 m -58.37 -52.94 63.51 Favored 'General case' 0 C--O 1.208 -1.116 0 CA-C-N 115.456 -0.793 . . . . 61.2 110.481 177.701 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . 0.566 HD22 ' HA ' ' A' ' 33' ' ' LEU . 89.1 mt -65.92 -24.71 66.88 Favored 'General case' 0 N--CA 1.474 0.736 0 C-N-CA 124.197 0.999 . . . . 60.11 111.486 -175.145 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.691 ' HA ' HD21 ' A' ' 78' ' ' LEU . 57.4 tp -69.88 -53.81 16.34 Favored 'General case' 0 C--N 1.356 0.873 0 N-CA-C 109.814 -0.439 . . . . 75.43 109.814 174.357 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . 0.408 ' O ' ' HG3' ' A' ' 27' ' ' ARG . 40.8 mt-10 -57.27 -49.94 74.47 Favored 'General case' 0 N--CA 1.48 1.067 0 O-C-N 123.968 0.792 . . . . 74.11 110.161 178.628 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . 0.53 ' HB3' ' HB2' ' A' ' 29' ' ' GLU . 95.0 mt -59.4 -42.23 91.27 Favored 'General case' 0 CA--C 1.536 0.438 0 C-N-CA 125.244 1.418 . . . . 71.22 110.878 -178.218 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . 0.64 ' HB2' HD21 ' A' ' 33' ' ' LEU . . . -58.73 -48.62 80.52 Favored 'General case' 0 N--CA 1.48 1.032 0 C-N-CA 122.613 0.365 . . . . 64.11 110.753 175.78 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 96.1 mt-30 -63.04 -30.25 71.45 Favored 'General case' 0 CA--C 1.55 0.945 0 O-C-N 124.063 0.852 . . . . 61.23 111.407 -179.591 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 27' ' ' ARG . . . . . 0.408 ' HG3' ' O ' ' A' ' 23' ' ' GLU . 90.4 mtt180 -78.83 -28.05 44.36 Favored 'General case' 0 N--CA 1.483 1.207 0 C-N-CA 123.688 0.795 . . . . 74.22 111.082 178.216 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 98.73 22.53 13.66 Favored Glycine 0 C--N 1.352 1.436 0 C-N-CA 123.117 0.389 . . . . 44.11 113.603 -176.493 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 29' ' ' GLU . . . . . 0.53 ' HB2' ' HB3' ' A' ' 24' ' ' LEU . 14.8 mm-40 -86.52 54.27 3.1 Favored 'General case' 0 CA--C 1.552 1.044 0 C-N-CA 125.04 1.336 . . . . 74.44 110.396 177.72 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 30' ' ' TRP . . . . . 0.517 ' HH2' HD21 ' A' ' 81' ' ' LEU . 57.2 m95 -59.49 -33.84 71.84 Favored 'General case' 0 N--CA 1.486 1.34 0 C-N-CA 124.257 1.023 . . . . 71.22 112.009 -171.952 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 3.7 m-20 -58.62 -41.42 85.88 Favored 'General case' 0 N--CA 1.474 0.736 0 C-N-CA 124.462 1.105 . . . . 75.24 110.697 -178.407 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 86.0 mt -69.78 -31.83 69.99 Favored 'General case' 0 N--CA 1.472 0.647 0 CA-C-N 115.141 -0.936 . . . . 63.13 110.955 -177.369 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . 0.64 HD21 ' HB2' ' A' ' 25' ' ' ALA . 10.1 mp -67.71 -43.94 78.85 Favored 'General case' 0 N--CA 1.482 1.146 0 C-N-CA 122.934 0.494 . . . . 75.24 110.466 174.35 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.421 ' HG ' ' O ' ' A' ' 30' ' ' TRP . 73.1 mt -67.07 -37.58 84.25 Favored 'General case' 0 N--CA 1.484 1.238 0 O-C-N 123.606 0.566 . . . . 61.32 111.767 -177.53 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 98.5 mt-30 -70.91 -54.1 12.64 Favored 'General case' 0 N--CA 1.477 0.889 0 C-N-CA 123.025 0.53 . . . . 53.51 110.172 177.969 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 83.6 mm-40 -68.34 -16.45 63.94 Favored 'General case' 0 N--CA 1.474 0.741 0 CA-C-O 118.484 -0.769 . . . . 74.13 112.382 -178.622 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 33.3 tt0 -50.39 -46.3 56.01 Favored 'General case' 0 N--CA 1.48 1.068 0 C-N-CA 123.306 0.642 . . . . 74.51 111.348 176.947 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 60.5 t -62.32 -55.67 22.51 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.752 0 C-N-CA 123.336 0.655 . . . . 55.2 111.403 -176.022 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 29.4 p -68.52 -39.62 81.11 Favored 'General case' 0 N--CA 1.478 0.95 0 C-N-CA 123.614 0.766 . . . . 63.01 111.675 -175.957 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 45.6 t80 -64.83 -49.31 71.12 Favored 'General case' 0 N--CA 1.477 0.92 0 C-N-CA 124.189 0.996 . . . . 72.34 111.063 -177.412 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . 0.562 ' HA ' HG22 ' A' ' 44' ' ' ILE . 86.8 mt -72.77 -34.09 66.73 Favored 'General case' 0 C--O 1.243 0.76 0 O-C-N 123.721 0.638 . . . . 71.33 111.066 -178.566 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 53.2 tt0 -57.36 -51.85 67.72 Favored 'General case' 0 C--N 1.353 0.736 0 O-C-N 123.666 0.604 . . . . 73.34 109.513 173.625 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 43' ' ' SER . . . . . 0.594 ' O ' HG23 ' A' ' 47' ' ' VAL . 69.0 m -56.94 -56.39 22.31 Favored 'General case' 0 C--N 1.351 0.664 0 O-C-N 124.479 1.112 . . . . 63.15 110.423 179.865 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 44' ' ' ILE . . . . . 0.607 HG13 HD13 ' A' ' 14' ' ' ILE . 14.3 tt -62.61 -38.54 81.78 Favored 'Isoleucine or valine' 0 C--O 1.252 1.236 0 C-N-CA 123.553 0.741 . . . . 54.03 112.205 -168.687 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 31.9 mm-40 -69.62 -37.78 76.97 Favored 'General case' 0 C--N 1.359 0.993 0 O-C-N 123.114 0.258 . . . . 62.24 110.508 174.819 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 87.6 m -65.46 -28.4 69.19 Favored 'General case' 0 CA--C 1.557 1.214 0 C-N-CA 123.44 0.696 . . . . 61.42 111.762 176.166 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 47' ' ' VAL . . . . . 0.634 HG21 HD11 ' A' ' 14' ' ' ILE . 12.9 t -77.23 -42.45 31.09 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.396 0 O-C-N 122.086 -0.384 . . . . 75.05 110.074 179.123 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 48' ' ' MET . . . . . . . . . . . . . 74.3 mtm -74.43 -13.63 60.74 Favored 'General case' 0 N--CA 1.482 1.135 0 CA-C-N 116.294 -0.412 . . . . 73.53 110.936 173.927 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 15.8 tp10 -80.47 -35.21 35.18 Favored 'General case' 0 N--CA 1.477 0.877 0 C-N-CA 123.457 0.703 . . . . 53.25 109.649 169.171 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 13.9 mptt -70.52 123.58 22.15 Favored 'General case' 0 N--CA 1.472 0.649 0 N-CA-C 109.156 -0.683 . . . . 64.2 109.156 175.611 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 8.8 tt0 -62.71 150.46 41.07 Favored 'General case' 0 C--O 1.242 0.672 0 CA-C-N 115.049 -0.978 . . . . 72.31 110.289 178.316 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 52' ' ' THR . . . . . 0.424 HG21 ' HG ' ' A' ' 113' ' ' LEU . 11.3 m -58.56 116.23 14.45 Favored Pre-proline 0 CA--C 1.552 1.037 0 N-CA-C 109.737 -0.468 . . . . 64.33 109.737 174.452 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 46.5 Cg_endo -64.93 156.08 64.34 Favored 'Trans proline' 0 C--N 1.373 1.848 0 C-N-CA 122.378 2.052 . . . . 75.51 112.414 -177.196 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 46.8 Cg_exo -57.49 -46.4 27.73 Favored 'Trans proline' 0 C--N 1.378 2.102 0 C-N-CA 123.249 2.632 . . . . 54.55 112.875 179.167 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . -77.47 71.13 2.34 Favored Glycine 0 C--N 1.348 1.206 0 CA-C-N 115.597 -0.728 . . . . 34.2 114.343 -175.511 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 19.8 mm -103.56 108.39 24.39 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.6 0 N-CA-C 107.93 -1.137 . . . . 52.44 107.93 170.595 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 57' ' ' THR . . . . . 0.443 ' H ' HD12 ' A' ' 60' ' ' ILE . 64.5 p -89.67 176.31 6.91 Favored 'General case' 0 C--O 1.247 0.946 0 N-CA-C 108.349 -0.982 . . . . 43.33 108.349 167.725 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 34.2 tpt85 -61.5 -50.67 71.8 Favored 'General case' 0 CA--C 1.543 0.702 0 N-CA-C 109.747 -0.464 . . . . 72.23 109.747 179.813 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 37.4 m -58.02 -39.94 79.6 Favored 'General case' 0 CA--C 1.543 0.71 0 O-C-N 124.083 0.865 . . . . 51.43 111.64 179.207 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 60' ' ' ILE . . . . . 0.545 HD13 HG21 ' A' ' 4' ' ' THR . 81.2 mt -63.02 -46.48 96.16 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.094 0 C-N-CA 123.664 0.786 . . . . 62.22 110.784 178.387 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 56.6 tt0 -57.18 -42.71 81.66 Favored 'General case' 0 N--CA 1.478 0.947 0 C-N-CA 123.541 0.736 . . . . 61.13 110.918 177.573 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 44.3 m-20 -70.61 -38.99 74.03 Favored 'General case' 0 N--CA 1.48 1.033 0 CA-C-N 116.025 -0.534 . . . . 63.23 112.151 179.571 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 63' ' ' MET . . . . . . . . . . . . . 72.6 mtm -69.67 -42.37 74.25 Favored 'General case' 0 N--CA 1.485 1.318 0 C-N-CA 122.509 0.324 . . . . 62.22 110.774 -177.816 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 64' ' ' VAL . . . . . 0.522 ' O ' HG13 ' A' ' 68' ' ' ILE . 79.4 t -64.07 -56.7 15.08 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.519 0 O-C-N 123.994 0.809 . . . . 64.42 109.421 177.499 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . 0.407 ' HB2' HD23 ' A' ' 109' ' ' LEU . . . -63.33 -29.58 70.87 Favored 'General case' 0 N--CA 1.486 1.339 0 C-N-CA 122.871 0.468 . . . . 73.32 112.012 -179.158 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -67.16 -40.85 92.64 Favored Glycine 0 C--N 1.347 1.168 0 N-CA-C 111.659 -0.576 . . . . 74.24 111.659 175.84 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 67' ' ' TYR . . . . . 0.478 ' O ' HG22 ' A' ' 71' ' ' THR . 15.4 m-30 -69.21 -39.85 78.34 Favored 'General case' 0 C--O 1.241 0.639 0 C-N-CA 123.425 0.69 . . . . 61.31 110.999 175.943 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 68' ' ' ILE . . . . . 0.542 ' O ' ' HG ' ' A' ' 72' ' ' LEU . 36.9 mt -60.11 -44.71 95.67 Favored 'Isoleucine or valine' 0 C--N 1.365 1.256 0 N-CA-C 108.286 -1.005 . . . . 73.21 108.286 176.152 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 69' ' ' LYS . . . . . 0.477 ' HB2' ' HE2' ' A' ' 106' ' ' TYR . 51.5 tptt -58.07 -45.26 87.38 Favored 'General case' 0 N--CA 1.476 0.856 0 C-N-CA 123.82 0.848 . . . . 73.24 110.683 179.166 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 70' ' ' GLN . . . . . 0.439 HE21 HE21 ' A' ' 19' ' ' GLN . 60.5 tt0 -60.02 -45.97 91.02 Favored 'General case' 0 C--N 1.352 0.688 0 O-C-N 123.798 0.687 . . . . 74.11 110.413 -179.676 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 71' ' ' THR . . . . . 0.478 HG22 ' O ' ' A' ' 67' ' ' TYR . 1.8 t -75.57 -22.74 56.71 Favored 'General case' 0 C--N 1.355 0.814 0 CA-C-O 119.196 -0.431 . . . . 71.33 111.259 -178.584 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 72' ' ' LEU . . . . . 0.542 ' HG ' ' O ' ' A' ' 68' ' ' ILE . 34.2 mt -64.03 -53.33 51.69 Favored 'General case' 0 C--N 1.361 1.101 0 N-CA-C 108.794 -0.817 . . . . 75.12 108.794 173.871 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 66.9 m-20 -64.39 -52.92 55.83 Favored 'General case' 0 N--CA 1.475 0.779 0 O-C-N 123.906 0.754 . . . . 74.35 111.24 -177.077 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 74' ' ' ASN . . . . . 0.428 ' ND2' ' HG2' ' A' ' 70' ' ' GLN . 90.3 m-20 -55.58 -54.0 49.44 Favored 'General case' 0 N--CA 1.482 1.17 0 O-C-N 124.164 0.915 . . . . 75.5 111.188 -177.964 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . 0.444 ' HG2' ' HE2' ' A' ' 79' ' ' LYS . 13.8 tt0 -73.31 -30.09 63.14 Favored 'General case' 0 CA--C 1.553 1.077 0 CA-C-N 115.723 -0.672 . . . . 72.42 110.857 -173.225 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 10.1 tt0 -69.1 -39.08 79.19 Favored 'General case' 0 N--CA 1.488 1.472 0 C-N-CA 123.458 0.703 . . . . 75.2 110.568 177.284 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 90.4 mt -63.37 -40.08 96.28 Favored 'General case' 0 C--N 1.351 0.671 0 CA-C-N 115.516 -0.766 . . . . 63.12 109.251 172.478 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . 0.691 HD21 ' HA ' ' A' ' 22' ' ' LEU . 50.2 mt -60.56 -37.07 80.08 Favored 'General case' 0 N--CA 1.478 0.958 0 O-C-N 123.904 0.752 . . . . 75.44 112.12 175.112 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 79' ' ' LYS . . . . . 0.444 ' HE2' ' HG2' ' A' ' 75' ' ' GLU . 66.4 mmtt -63.99 -54.79 28.82 Favored 'General case' 0 N--CA 1.476 0.853 0 N-CA-C 108.747 -0.835 . . . . 74.35 108.747 176.493 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -59.87 -26.95 63.67 Favored Glycine 0 C--N 1.358 1.764 0 O-C-N 124.214 0.946 . . . . 53.41 113.72 -179.767 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 81' ' ' LEU . . . . . 0.517 HD21 ' HH2' ' A' ' 30' ' ' TRP . 8.5 tt -77.91 -40.71 38.94 Favored 'General case' 0 CA--C 1.545 0.76 0 C-N-CA 124.258 1.023 . . . . 25.44 109.755 179.711 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 58.1 mt . . . . . 0 N--CA 1.478 0.968 0 C-N-CA 122.447 0.299 . . . . 61.11 111.435 -178.624 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 92' ' ' LEU . . . . . 0.549 HD11 ' HE ' ' A' ' 98' ' ' ARG . 11.2 mt . . . . . 0 N--CA 1.483 1.191 0 CA-C-O 121.505 0.669 . . . . 72.03 110.437 . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 93' ' ' ILE . . . . . 0.413 ' H ' ' HB2' ' A' ' 92' ' ' LEU . 65.5 mt -148.87 -51.46 0.08 OUTLIER 'Isoleucine or valine' 0 N--CA 1.476 0.839 0 N-CA-C 106.179 -1.785 . . . . 54.12 106.179 -164.93 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -131.63 -175.74 14.12 Favored Glycine 0 C--N 1.352 1.426 0 CA-C-N 114.032 -1.44 . . . . 63.04 112.568 -178.627 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 34.9 tt0 -74.15 -71.25 0.34 Allowed 'General case' 0 N--CA 1.473 0.719 0 C-N-CA 125.145 1.378 . . . . 72.51 111.708 -170.829 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 33.4 p -94.66 10.78 33.58 Favored 'General case' 0 C--O 1.241 0.609 0 C-N-CA 123.428 0.691 . . . . 70.43 111.63 -173.869 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 88.4 m -52.59 -39.51 61.67 Favored 'General case' 0 C--N 1.361 1.071 0 C-N-CA 124.544 1.138 . . . . 51.3 111.976 177.833 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 98' ' ' ARG . . . . . 0.924 HH12 HD22 ' A' ' 102' ' ' LEU . 4.0 tpm_? -56.89 -61.68 2.27 Favored 'General case' 0 N--CA 1.469 0.515 0 C-N-CA 123.275 0.63 . . . . 70.04 112.039 -168.145 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 8.4 tt0 -83.66 -42.57 16.52 Favored 'General case' 0 CA--C 1.534 0.362 0 CA-C-N 115.063 -0.972 . . . . 71.52 110.28 -169.526 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 8.0 tmtm? -62.81 -55.61 24.8 Favored 'General case' 0 N--CA 1.476 0.835 0 O-C-N 124.106 0.879 . . . . 73.43 109.529 -177.332 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 46.6 t -72.79 -35.37 67.38 Favored 'General case' 0 N--CA 1.478 0.931 0 CA-C-O 118.622 -0.704 . . . . 74.34 111.916 -174.896 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 102' ' ' LEU . . . . . 0.924 HD22 HH12 ' A' ' 98' ' ' ARG . 21.6 tp -67.96 -47.35 68.87 Favored 'General case' 0 C--N 1.368 1.402 0 CA-C-N 118.93 0.786 . . . . 75.34 111.212 179.748 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 59.7 t30 -74.08 -24.35 59.48 Favored 'General case' 0 N--CA 1.478 0.93 0 CA-C-N 115.796 -0.638 . . . . 74.12 110.792 -178.754 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 104' ' ' ASN . . . . . 0.421 ' O ' ' HG2' ' A' ' 108' ' ' ARG . 7.7 t30 -71.13 -39.16 72.16 Favored 'General case' 0 N--CA 1.479 1.016 0 C-N-CA 122.531 0.332 . . . . 75.21 110.223 170.781 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -63.09 -37.92 89.13 Favored 'General case' 0 N--CA 1.483 1.2 0 C-N-CA 123.047 0.539 . . . . 54.52 110.306 178.204 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 106' ' ' TYR . . . . . 0.477 ' HE2' ' HB2' ' A' ' 69' ' ' LYS . 3.5 t80 -57.93 -52.07 67.01 Favored 'General case' 0 C--N 1.356 0.876 0 CA-C-N 114.941 -1.027 . . . . 64.35 108.973 168.85 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -60.51 -31.95 76.29 Favored Glycine 0 C--N 1.352 1.423 0 O-C-N 124.056 0.848 . . . . 62.34 113.673 -176.235 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 108' ' ' ARG . . . . . 0.421 ' HG2' ' O ' ' A' ' 104' ' ' ASN . 5.1 mmp_? -76.69 -36.42 57.26 Favored 'General case' 0 C--N 1.344 0.344 0 N-CA-C 109.259 -0.645 . . . . 73.31 109.259 177.871 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 109' ' ' LEU . . . . . 0.41 HD13 ' HB2' ' A' ' 114' ' ' LEU . 42.1 tp -68.75 -30.69 69.35 Favored 'General case' 0 N--CA 1.489 1.489 0 C-N-CA 123.015 0.526 . . . . 44.42 111.152 177.235 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 38.5 t -77.66 -39.04 46.34 Favored 'General case' 0 CA--C 1.543 0.699 0 CA-C-N 115.014 -0.994 . . . . 71.1 109.584 178.105 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . -90.07 -64.03 1.25 Allowed Glycine 0 C--N 1.36 1.904 0 CA-C-O 119.571 -0.572 . . . . 72.11 114.272 -177.36 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 112' ' ' MET . . . . . . . . . . . . . 11.2 tpt -96.79 -70.56 0.71 Allowed 'General case' 0 N--CA 1.489 1.501 0 CA-C-N 118.104 0.952 . . . . 74.51 113.272 -178.548 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 113' ' ' LEU . . . . . 0.424 ' HG ' HG21 ' A' ' 52' ' ' THR . 22.0 tp 170.11 41.69 0.0 OUTLIER 'General case' 0 N--CA 1.495 1.822 0 C-N-CA 124.195 0.998 . . . . 75.44 109.389 -177.125 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 114' ' ' LEU . . . . . 0.41 ' HB2' HD13 ' A' ' 109' ' ' LEU . 5.3 tt . . . . . 0 N--CA 1.504 2.248 0 C-N-CA 126.36 1.864 . . . . 73.1 111.575 179.668 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 25.5 ptm . . . . . 0 N--CA 1.482 1.167 0 N-CA-C 110.621 -0.14 . . . . 72.33 110.621 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 40.3 p -57.06 -46.32 82.54 Favored 'General case' 0 N--CA 1.479 0.996 0 C-N-CA 123.802 0.841 . . . . 71.1 112.356 -175.784 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 23.5 m -70.79 -25.42 62.87 Favored 'General case' 0 N--CA 1.473 0.724 0 C-N-CA 123.265 0.626 . . . . 60.42 111.331 -179.518 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 4' ' ' THR . . . . . 0.411 ' HA ' ' HG3' ' A' ' 53' ' ' PRO . 25.5 m -75.56 -40.63 56.48 Favored 'General case' 0 C--N 1.35 0.602 0 C-N-CA 123.426 0.691 . . . . 53.2 110.839 178.1 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 92.8 t -67.85 -34.9 70.15 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.849 0 C-N-CA 123.543 0.737 . . . . 72.11 109.538 175.285 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 6' ' ' GLU . . . . . 0.521 ' O ' ' HG3' ' A' ' 10' ' ' ARG . 10.5 tm-20 -71.91 -32.32 67.27 Favored 'General case' 0 N--CA 1.472 0.668 0 C-N-CA 124.179 0.992 . . . . 72.11 110.226 176.504 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 7' ' ' PHE . . . . . 0.413 ' O ' ' HB2' ' A' ' 10' ' ' ARG . 62.3 t80 -70.68 -43.48 69.0 Favored 'General case' 0 N--CA 1.48 1.03 0 C-N-CA 123.871 0.868 . . . . 64.5 110.72 177.47 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 8' ' ' ILE . . . . . 0.539 HD11 HG23 ' A' ' 60' ' ' ILE . 84.5 mt -62.34 -39.21 83.38 Favored 'Isoleucine or valine' 0 C--O 1.212 -0.898 0 N-CA-C 109.178 -0.675 . . . . 75.14 109.178 173.326 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 3.3 t-20 -61.09 -38.03 84.81 Favored 'General case' 0 N--CA 1.483 1.177 0 C-N-CA 124.043 0.937 . . . . 73.21 111.086 175.866 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . 0.531 ' HB3' HG22 ' A' ' 47' ' ' VAL . 73.4 mtt180 -56.77 -53.77 53.94 Favored 'General case' 0 N--CA 1.475 0.811 0 O-C-N 123.82 0.7 . . . . 72.32 109.925 174.625 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 11' ' ' TRP . . . . . 0.424 ' CD1' HG13 ' A' ' 64' ' ' VAL . 99.7 m95 -75.59 -23.27 56.45 Favored 'General case' 0 N--CA 1.471 0.58 0 CA-C-N 114.918 -1.037 . . . . 75.54 113.107 -176.062 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 51.4 mt-30 -62.88 -46.7 86.6 Favored 'General case' 0 N--CA 1.47 0.556 0 N-CA-C 108.134 -1.061 . . . . 75.53 108.134 169.841 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 10.9 tpt180 -63.99 -48.39 76.58 Favored 'General case' 0 CA--C 1.54 0.59 0 CA-C-N 114.695 -1.139 . . . . 73.25 111.226 -175.721 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 14' ' ' ILE . . . . . 0.55 HD13 HG13 ' A' ' 44' ' ' ILE . 48.2 mt -64.62 -48.91 82.83 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.316 0 O-C-N 123.194 0.309 . . . . 61.44 110.287 -179.978 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . 0.567 ' HA ' ' HB ' ' A' ' 71' ' ' THR . . . -54.41 -45.56 72.97 Favored 'General case' 0 C--N 1.36 1.046 0 O-C-N 123.983 0.802 . . . . 74.3 111.163 -178.969 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 84.4 mt -78.73 -36.52 43.11 Favored 'General case' 0 N--CA 1.476 0.858 0 CA-C-N 114.989 -1.005 . . . . 55.34 112.124 -174.311 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.451 ' O ' ' HG ' ' A' ' 21' ' ' LEU . 64.3 mt -67.54 -45.36 75.91 Favored 'General case' 0 N--CA 1.487 1.375 0 CA-C-N 118.057 0.39 . . . . 64.04 110.395 179.813 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 77.8 p -67.49 -37.25 82.58 Favored 'General case' 0 N--CA 1.477 0.901 0 C-N-CA 123.211 0.604 . . . . 71.13 110.79 176.794 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 19' ' ' GLN . . . . . 0.449 HE21 ' NE2' ' A' ' 70' ' ' GLN . 6.9 tp-100 -61.13 -42.29 98.27 Favored 'General case' 0 C--N 1.357 0.906 0 O-C-N 123.701 0.626 . . . . 70.32 110.612 175.407 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 69.2 m -60.31 -49.5 77.36 Favored 'General case' 0 C--N 1.347 0.461 0 O-C-N 124.069 0.856 . . . . 73.42 109.686 176.37 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . 0.719 HD22 ' HA ' ' A' ' 33' ' ' LEU . 26.2 mt -61.36 -33.36 73.5 Favored 'General case' 0 CA--C 1.547 0.85 0 O-C-N 124.014 0.821 . . . . 60.33 110.917 -178.919 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.741 ' HA ' HD21 ' A' ' 78' ' ' LEU . 56.0 tp -67.29 -54.01 24.62 Favored 'General case' 0 N--CA 1.482 1.139 0 C-N-CA 123.271 0.629 . . . . 73.41 110.692 179.74 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 42.5 mt-10 -56.53 -49.6 74.32 Favored 'General case' 0 N--CA 1.474 0.752 0 C-N-CA 124.335 1.054 . . . . 72.13 110.735 178.95 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . 0.407 HD22 HD12 ' A' ' 32' ' ' LEU . 91.5 mt -67.24 -33.74 75.98 Favored 'General case' 0 C--O 1.217 -0.62 0 CA-C-N 114.987 -1.006 . . . . 75.31 111.21 -176.133 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . 0.542 ' HB2' HD21 ' A' ' 33' ' ' LEU . . . -67.65 -42.62 81.92 Favored 'General case' 0 N--CA 1.483 1.208 0 C-N-CA 122.867 0.467 . . . . 74.42 111.594 177.699 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 97.1 mt-30 -70.97 -23.86 62.3 Favored 'General case' 0 N--CA 1.475 0.812 0 CA-C-N 115.532 -0.758 . . . . 73.3 111.069 176.678 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 79.0 mtt180 -78.68 -21.13 48.67 Favored 'General case' 0 N--CA 1.479 0.999 0 C-N-CA 123.562 0.745 . . . . 73.13 110.588 170.71 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 91.77 9.55 62.52 Favored Glycine 0 C--N 1.348 1.216 0 C-N-CA 123.05 0.357 . . . . 72.34 113.332 179.485 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 18.6 mm-40 -82.81 61.27 5.78 Favored 'General case' 0 CA--C 1.547 0.828 0 C-N-CA 124.622 1.169 . . . . 72.32 110.687 177.775 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 30' ' ' TRP . . . . . 0.41 ' O ' ' HG ' ' A' ' 34' ' ' LEU . 59.6 m95 -63.91 -29.71 70.86 Favored 'General case' 0 N--CA 1.484 1.25 0 C-N-CA 123.863 0.865 . . . . 74.21 110.999 -176.788 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 -56.21 -47.31 78.65 Favored 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 124.265 1.026 . . . . 64.31 110.287 175.718 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 0.407 HD12 HD22 ' A' ' 24' ' ' LEU . 35.5 mt -64.59 -31.03 72.07 Favored 'General case' 0 N--CA 1.474 0.733 0 CA-C-N 115.16 -0.927 . . . . 72.0 110.927 -179.0 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . 0.719 ' HA ' HD22 ' A' ' 21' ' ' LEU . 10.5 mp -62.42 -49.01 77.19 Favored 'General case' 0 N--CA 1.477 0.884 0 N-CA-C 109.76 -0.459 . . . . 71.33 109.76 171.554 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.41 ' HG ' ' O ' ' A' ' 30' ' ' TRP . 80.5 mt -58.01 -41.47 83.19 Favored 'General case' 0 N--CA 1.484 1.257 0 O-C-N 123.856 0.722 . . . . 65.31 112.397 -177.195 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 1.4 mp0 -73.81 -56.55 4.84 Favored 'General case' 0 N--CA 1.488 1.438 0 C-N-CA 122.859 0.464 . . . . 73.31 111.778 178.572 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 84.7 mm-40 -66.04 -19.71 65.94 Favored 'General case' 0 N--CA 1.488 1.46 0 C-N-CA 122.965 0.506 . . . . 74.55 111.793 -175.205 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . 0.473 ' O ' ' HG ' ' A' ' 41' ' ' LEU . 22.7 tt0 -60.02 -36.98 78.43 Favored 'General case' 0 C--N 1.358 0.969 0 C-N-CA 123.291 0.636 . . . . 73.1 111.277 179.578 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 62.2 t -53.1 -48.95 52.62 Favored 'Isoleucine or valine' 0 CA--C 1.556 1.182 0 C-N-CA 123.341 0.656 . . . . 71.11 110.764 -179.24 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 70.9 m -72.65 -33.2 66.43 Favored 'General case' 0 CA--C 1.537 0.444 0 CA-C-N 115.129 -0.941 . . . . 64.54 111.617 177.618 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 33.2 t80 -62.12 -40.75 96.97 Favored 'General case' 0 N--CA 1.481 1.08 0 C-N-CA 122.786 0.434 . . . . 73.15 110.984 176.24 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . 0.473 ' HG ' ' O ' ' A' ' 37' ' ' GLU . 56.0 mt -69.74 -52.78 22.43 Favored 'General case' 0 C--O 1.245 0.857 0 C-N-CA 123.953 0.901 . . . . 63.15 109.859 -178.28 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 53.2 tt0 -55.81 -49.97 71.8 Favored 'General case' 0 C--N 1.358 0.954 0 CA-C-N 114.882 -1.054 . . . . 72.24 110.832 -179.112 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 43' ' ' SER . . . . . 0.535 ' O ' HG23 ' A' ' 47' ' ' VAL . 66.1 m -60.94 -56.28 22.93 Favored 'General case' 0 C--N 1.348 0.541 0 O-C-N 123.991 0.807 . . . . 53.2 111.055 -178.78 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 44' ' ' ILE . . . . . 0.55 HG13 HD13 ' A' ' 14' ' ' ILE . 11.9 tt -58.97 -42.77 87.09 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.192 0 O-C-N 123.692 0.62 . . . . 74.34 111.558 -171.806 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . 0.484 ' HG2' HD22 ' A' ' 92' ' ' LEU . 54.9 mm-40 -63.65 -44.96 92.3 Favored 'General case' 0 C--N 1.359 0.99 0 C-N-CA 122.705 0.402 . . . . 75.11 111.039 177.263 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 99.2 m -55.93 -42.58 76.33 Favored 'General case' 0 N--CA 1.479 1.003 0 O-C-N 123.638 0.586 . . . . 75.53 111.248 177.55 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 47' ' ' VAL . . . . . 0.535 HG23 ' O ' ' A' ' 43' ' ' SER . 96.2 t -63.67 -46.45 94.69 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.701 0 C-N-CA 124.018 0.927 . . . . 73.43 111.074 -179.579 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 48' ' ' MET . . . . . 0.565 ' SD ' HD13 ' A' ' 102' ' ' LEU . 77.2 mtm -71.52 -25.89 62.43 Favored 'General case' 0 N--CA 1.478 0.939 0 CA-C-N 115.432 -0.804 . . . . 72.12 112.469 -176.55 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 54.9 mt-10 -94.3 -18.79 21.28 Favored 'General case' 0 N--CA 1.485 1.284 0 N-CA-C 112.544 0.572 . . . . 72.31 112.544 179.605 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 1.3 mptm? -91.38 146.33 23.9 Favored 'General case' 0 N--CA 1.483 1.213 0 C-N-CA 122.981 0.512 . . . . 75.14 109.861 179.387 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 4.9 pt20 -70.75 143.54 51.21 Favored 'General case' 0 CA--C 1.537 0.479 0 C-N-CA 123.503 0.721 . . . . 74.24 112.806 -167.888 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 95.2 m -80.16 118.26 71.58 Favored Pre-proline 0 CA--C 1.55 0.949 0 C-N-CA 124.413 1.085 . . . . 64.2 108.735 172.007 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 53' ' ' PRO . . . . . 0.411 ' HG3' ' HA ' ' A' ' 4' ' ' THR . 31.8 Cg_endo -61.99 153.37 69.18 Favored 'Trans proline' 0 C--N 1.374 1.884 0 C-N-CA 122.28 1.987 . . . . 74.32 112.14 -179.266 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 45.6 Cg_endo -68.27 -46.86 1.88 Allowed 'Trans proline' 0 C--N 1.371 1.757 0 C-N-CA 122.612 2.208 . . . . 52.22 112.216 179.236 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . -74.24 79.4 0.91 Allowed Glycine 0 C--N 1.349 1.28 0 O-C-N 123.591 0.557 . . . . 63.21 113.23 -176.571 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 56' ' ' ILE . . . . . 0.455 ' HB ' HD21 ' A' ' 113' ' ' LEU . 66.9 mt -128.49 107.84 16.56 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.79 0 C-N-CA 124.858 1.263 . . . . 74.24 107.704 175.554 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 57' ' ' THR . . . . . 0.408 ' H ' HD12 ' A' ' 60' ' ' ILE . 38.4 p -82.4 -178.44 7.05 Favored 'General case' 0 CA--C 1.542 0.662 0 C-N-CA 123.506 0.722 . . . . 64.42 110.989 -179.678 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 25.1 tpt180 -53.71 -55.61 24.6 Favored 'General case' 0 N--CA 1.475 0.802 0 C-N-CA 124.892 1.277 . . . . 72.44 111.884 -177.329 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 17.5 m -59.6 -40.31 87.06 Favored 'General case' 0 N--CA 1.478 0.954 0 O-C-N 123.782 0.676 . . . . 74.43 112.107 -177.542 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 60' ' ' ILE . . . . . 0.539 HG23 HD11 ' A' ' 8' ' ' ILE . 66.4 mt -66.42 -40.8 87.52 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.75 0 O-C-N 123.941 0.775 . . . . 74.44 110.61 178.625 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 61.1 tt0 -64.17 -38.62 91.73 Favored 'General case' 0 CA--C 1.543 0.711 0 C-N-CA 124.288 1.035 . . . . 75.12 110.524 -179.049 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 43.4 m-20 -72.8 -38.14 67.32 Favored 'General case' 0 N--CA 1.476 0.868 0 CA-C-N 115.661 -0.699 . . . . 71.44 111.731 177.815 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 63' ' ' MET . . . . . . . . . . . . . 74.1 mtm -65.23 -48.23 74.04 Favored 'General case' 0 N--CA 1.486 1.327 0 C-N-CA 122.291 0.236 . . . . 72.44 110.963 177.841 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 64' ' ' VAL . . . . . 0.51 ' O ' HG13 ' A' ' 68' ' ' ILE . 75.7 t -61.87 -55.93 21.06 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.589 0 C-N-CA 123.554 0.742 . . . . 65.01 110.729 179.188 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -63.59 -27.36 69.19 Favored 'General case' 0 N--CA 1.485 1.32 0 C-N-CA 122.416 0.286 . . . . 74.54 111.368 -179.396 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -67.23 -40.11 92.28 Favored Glycine 0 C--N 1.349 1.271 0 O-C-N 123.66 0.6 . . . . 51.42 112.063 174.677 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 18.6 m-30 -71.39 -35.44 71.04 Favored 'General case' 0 N--CA 1.472 0.656 0 C-N-CA 123.499 0.72 . . . . 73.23 111.624 176.866 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 68' ' ' ILE . . . . . 0.528 ' O ' ' HG ' ' A' ' 72' ' ' LEU . 20.3 mt -63.55 -48.92 84.72 Favored 'Isoleucine or valine' 0 C--N 1.358 0.947 0 N-CA-C 108.162 -1.051 . . . . 74.02 108.162 176.541 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 69' ' ' LYS . . . . . 0.554 ' HB2' ' HE2' ' A' ' 106' ' ' TYR . 46.6 tptt -53.74 -47.71 70.36 Favored 'General case' 0 N--CA 1.481 1.079 0 C-N-CA 124.239 1.016 . . . . 71.45 110.879 176.76 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 70' ' ' GLN . . . . . 0.449 ' NE2' HE21 ' A' ' 19' ' ' GLN . 62.4 tt0 -60.99 -46.04 92.37 Favored 'General case' 0 CA--C 1.535 0.39 0 O-C-N 124.094 0.871 . . . . 73.12 110.97 -177.638 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 71' ' ' THR . . . . . 0.567 ' HB ' ' HA ' ' A' ' 15' ' ' ALA . 13.1 t -79.16 -21.29 46.66 Favored 'General case' 0 C--N 1.352 0.683 0 CA-C-O 118.904 -0.57 . . . . 62.13 111.45 -176.017 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 72' ' ' LEU . . . . . 0.528 ' HG ' ' O ' ' A' ' 68' ' ' ILE . 25.2 mt -75.98 -31.72 59.13 Favored 'General case' 0 N--CA 1.486 1.354 0 N-CA-C 109.802 -0.444 . . . . 64.25 109.802 173.385 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 97.8 m-20 -70.33 -51.12 32.44 Favored 'General case' 0 N--CA 1.469 0.491 0 O-C-N 123.744 0.652 . . . . 73.42 109.842 174.723 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 67.4 m-20 -57.35 -42.96 83.0 Favored 'General case' 0 N--CA 1.479 0.997 0 O-C-N 123.96 0.788 . . . . 73.33 109.912 178.314 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 53.5 tp10 -58.54 -56.37 23.03 Favored 'General case' 0 N--CA 1.473 0.68 0 C-N-CA 124.494 1.117 . . . . 53.23 110.712 177.202 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 10.1 tt0 -65.67 -39.05 90.91 Favored 'General case' 0 N--CA 1.477 0.897 0 C-N-CA 122.724 0.41 . . . . 72.51 111.786 -174.441 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 92.9 mt -64.58 -47.74 77.55 Favored 'General case' 0 N--CA 1.478 0.934 0 C-N-CA 123.349 0.66 . . . . 75.22 110.524 179.881 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . 0.741 HD21 ' HA ' ' A' ' 22' ' ' LEU . 42.5 mt -61.01 -61.86 2.27 Favored 'General case' 0 N--CA 1.482 1.128 0 C-N-CA 123.968 0.907 . . . . 73.21 111.985 178.68 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 43.9 mmtm -67.17 -38.04 84.75 Favored 'General case' 0 CA--C 1.543 0.679 0 CA-C-N 113.872 -1.513 . . . . 74.4 110.356 -171.563 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -68.94 -29.69 72.44 Favored Glycine 0 C--N 1.343 0.939 0 CA-C-N 115.822 -0.626 . . . . 60.45 113.037 175.957 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 8.5 tt -63.14 -44.79 94.56 Favored 'General case' 0 N--CA 1.475 0.81 0 N-CA-C 109.044 -0.725 . . . . 63.3 109.044 171.016 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 82' ' ' LEU . . . . . 0.437 ' HG ' ' O ' ' A' ' 78' ' ' LEU . 67.4 mt . . . . . 0 N--CA 1.477 0.875 0 O-C-N 123.663 0.602 . . . . 72.1 110.497 -178.411 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 92' ' ' LEU . . . . . 0.484 HD22 ' HG2' ' A' ' 45' ' ' GLU . 40.5 mt . . . . . 0 N--CA 1.478 0.944 0 N-CA-C 109.598 -0.519 . . . . 71.33 109.598 . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 93' ' ' ILE . . . . . 0.47 ' HB ' ' HA ' ' A' ' 97' ' ' THR . 35.2 mt -120.44 146.39 25.38 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.06 0 C-N-CA 124.093 0.957 . . . . 70.11 109.072 -177.755 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -64.46 126.7 33.46 Favored Glycine 0 C--N 1.344 0.988 0 O-C-N 123.316 0.385 . . . . 23.33 112.585 177.09 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 17.4 mt-30 66.18 -85.76 0.03 OUTLIER 'General case' 0 N--CA 1.477 0.905 0 C-N-CA 125.038 1.335 . . . . 71.44 111.584 179.247 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 22.7 m -92.39 102.94 15.42 Favored 'General case' 0 N--CA 1.467 0.384 0 C-N-CA 123.547 0.739 . . . . 61.02 109.624 -177.908 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 97' ' ' THR . . . . . 0.624 HG22 ' H ' ' A' ' 99' ' ' GLN . 97.1 m -93.16 155.64 17.34 Favored 'General case' 0 CA--C 1.55 0.949 0 C-N-CA 123.869 0.868 . . . . 75.13 109.916 173.036 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 30.7 mmt180 -58.16 -13.26 4.56 Favored 'General case' 0 CA--C 1.556 1.181 0 C-N-CA 125.291 1.436 . . . . 72.21 113.016 175.554 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 99' ' ' GLN . . . . . 0.624 ' H ' HG22 ' A' ' 97' ' ' THR . 12.5 pt20 -57.89 -29.8 65.34 Favored 'General case' 0 N--CA 1.491 1.601 0 C-N-CA 124.34 1.056 . . . . 71.15 112.069 176.444 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 27.5 ttpp -68.3 -46.47 70.21 Favored 'General case' 0 N--CA 1.478 0.944 0 N-CA-C 109.061 -0.718 . . . . 71.53 109.061 173.65 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 101' ' ' SER . . . . . 0.406 ' HA ' ' HB3' ' A' ' 104' ' ' ASN . 48.7 m -72.1 -12.68 61.31 Favored 'General case' 0 N--CA 1.479 1.011 0 C-N-CA 124.307 1.043 . . . . 70.3 111.941 174.897 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 102' ' ' LEU . . . . . 0.565 HD13 ' SD ' ' A' ' 48' ' ' MET . 24.7 tp -76.49 -48.26 20.11 Favored 'General case' 0 N--CA 1.483 1.188 0 C-N-CA 124.751 1.22 . . . . 52.34 109.19 177.098 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 9.2 t30 -65.53 -37.87 87.99 Favored 'General case' 0 CA--C 1.553 1.087 0 CA-C-N 114.672 -1.149 . . . . 72.25 110.536 173.433 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 104' ' ' ASN . . . . . 0.406 ' HB3' ' HA ' ' A' ' 101' ' ' SER . 24.5 t-20 -70.03 -32.54 70.74 Favored 'General case' 0 N--CA 1.478 0.947 0 CA-C-N 115.611 -0.722 . . . . 63.41 110.936 175.952 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -63.69 -40.23 96.29 Favored 'General case' 0 N--CA 1.48 1.072 0 C-N-CA 123.572 0.749 . . . . 71.42 110.165 175.853 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 106' ' ' TYR . . . . . 0.554 ' HE2' ' HB2' ' A' ' 69' ' ' LYS . 2.9 t80 -57.34 -51.97 67.24 Favored 'General case' 0 C--N 1.353 0.758 0 O-C-N 124.274 0.983 . . . . 64.34 109.443 172.016 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -53.19 -55.01 26.4 Favored Glycine 0 C--N 1.353 1.49 0 O-C-N 124.133 0.896 . . . . 42.51 114.204 -177.179 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 108' ' ' ARG . . . . . 0.638 ' HG3' ' HA ' ' A' ' 114' ' ' LEU . 17.2 ptp180 -66.6 -31.43 72.12 Favored 'General case' 0 CA--C 1.548 0.897 0 C-N-CA 123.295 0.638 . . . . 74.4 111.905 178.983 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 109' ' ' LEU . . . . . 0.543 ' HA ' ' H ' ' A' ' 114' ' ' LEU . 56.4 tp -68.05 -45.81 72.87 Favored 'General case' 0 N--CA 1.484 1.247 0 C-N-CA 122.645 0.378 . . . . 74.33 111.096 176.505 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 11.6 t -72.23 -29.54 64.04 Favored 'General case' 0 CA--C 1.54 0.595 0 CA-C-N 115.344 -0.843 . . . . 42.13 109.84 -174.659 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . -88.03 -62.96 1.4 Allowed Glycine 0 C--N 1.36 1.905 0 CA-C-O 119.364 -0.687 . . . . 72.42 113.844 -179.928 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 112' ' ' MET . . . . . . . . . . . . . 1.0 OUTLIER -98.99 -69.92 0.75 Allowed 'General case' 0 N--CA 1.485 1.31 0 CA-C-N 118.622 1.211 . . . . 71.52 112.065 177.576 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 113' ' ' LEU . . . . . 0.455 HD21 ' HB ' ' A' ' 56' ' ' ILE . 0.9 OUTLIER 163.29 51.2 0.0 OUTLIER 'General case' 0 N--CA 1.497 1.899 0 C-N-CA 125.746 1.618 . . . . 42.24 108.228 -174.322 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 114' ' ' LEU . . . . . 0.638 ' HA ' ' HG3' ' A' ' 108' ' ' ARG . 0.3 OUTLIER . . . . . 0 N--CA 1.487 1.414 0 C-N-CA 125.574 1.55 . . . . 73.13 112.934 171.221 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 23.5 ttt . . . . . 0 N--CA 1.488 1.439 0 CA-C-O 119.475 -0.298 . . . . 73.25 111.326 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 27.2 p -47.13 -39.02 12.61 Favored 'General case' 0 N--CA 1.497 1.885 0 N-CA-C 113.634 0.975 . . . . 72.24 113.634 -174.25 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 16.6 m -65.19 -45.35 85.16 Favored 'General case' 0 N--CA 1.478 0.932 0 C-N-CA 123.249 0.62 . . . . 73.11 111.464 178.384 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 4' ' ' THR . . . . . 0.53 ' HA ' ' HG3' ' A' ' 53' ' ' PRO . 5.2 m -70.96 -37.21 72.78 Favored 'General case' 0 N--CA 1.476 0.863 0 C-N-CA 123.351 0.66 . . . . 65.32 111.822 179.947 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 69.9 t -62.1 -47.58 92.48 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.84 0 C-N-CA 123.258 0.623 . . . . 74.31 109.758 178.529 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 44.9 mm-40 -57.27 -51.72 68.21 Favored 'General case' 0 N--CA 1.473 0.718 0 CA-C-N 115.778 -0.646 . . . . 53.51 110.927 172.205 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 40.7 t80 -57.32 -50.3 73.36 Favored 'General case' 0 CA--C 1.552 1.024 0 C-N-CA 124.197 0.999 . . . . 72.52 111.849 -173.853 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 8' ' ' ILE . . . . . 0.432 HD11 HG23 ' A' ' 60' ' ' ILE . 83.6 mt -62.38 -46.25 96.87 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.065 0 C-N-CA 123.977 0.911 . . . . 71.35 110.237 177.337 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 25.1 t-20 -67.09 -27.69 67.57 Favored 'General case' 0 N--CA 1.486 1.351 0 C-N-CA 123.781 0.833 . . . . 73.12 112.032 -176.441 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . 0.465 ' O ' HG13 ' A' ' 14' ' ' ILE . 96.5 mtt180 -76.23 -38.41 56.39 Favored 'General case' 0 N--CA 1.469 0.484 0 N-CA-C 109.041 -0.726 . . . . 64.32 109.041 175.325 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 11' ' ' TRP . . . . . 0.514 ' HH2' ' HG ' ' A' ' 102' ' ' LEU . 57.0 m95 -67.42 -29.65 69.19 Favored 'General case' 0 N--CA 1.484 1.274 0 C-N-CA 123.055 0.542 . . . . 75.12 111.696 172.152 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . 0.413 ' HG3' ' O ' ' A' ' 8' ' ' ILE . 52.7 mt-30 -64.08 -49.45 72.2 Favored 'General case' 0 N--CA 1.472 0.65 0 N-CA-C 107.671 -1.233 . . . . 44.25 107.671 171.773 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 53.5 ttt180 -60.85 -43.25 98.59 Favored 'General case' 0 CA--C 1.548 0.898 0 CA-C-N 114.996 -1.002 . . . . 74.01 111.382 -176.303 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 14' ' ' ILE . . . . . 0.465 HG13 ' O ' ' A' ' 10' ' ' ARG . 64.2 mt -66.52 -47.41 83.74 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.388 0 C-N-CA 122.731 0.412 . . . . 62.13 109.899 178.782 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . 0.572 ' HA ' ' HB ' ' A' ' 71' ' ' THR . . . -58.63 -43.71 89.8 Favored 'General case' 0 N--CA 1.486 1.343 0 C-N-CA 123.888 0.875 . . . . 60.54 111.824 -179.53 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 96.4 mt -81.83 -34.55 30.13 Favored 'General case' 0 N--CA 1.483 1.176 0 CA-C-N 114.613 -1.176 . . . . 55.42 111.112 -173.591 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.475 ' O ' ' HG ' ' A' ' 21' ' ' LEU . 25.3 mt -65.18 -51.76 59.06 Favored 'General case' 0 N--CA 1.486 1.352 0 N-CA-C 109.589 -0.523 . . . . 75.23 109.589 176.0 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 80.9 p -63.6 -37.32 86.9 Favored 'General case' 0 N--CA 1.48 1.028 0 C-N-CA 123.389 0.675 . . . . 70.33 111.557 -179.484 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 6.4 tp-100 -58.58 -50.14 74.91 Favored 'General case' 0 N--CA 1.476 0.866 0 O-C-N 123.613 0.57 . . . . 75.42 110.582 173.685 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 70.9 m -58.0 -49.91 75.21 Favored 'General case' 0 C--O 1.207 -1.161 0 CA-C-N 115.167 -0.924 . . . . 63.33 110.18 176.923 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . 0.595 HD22 ' HA ' ' A' ' 33' ' ' LEU . 92.4 mt -63.21 -29.88 71.14 Favored 'General case' 0 N--CA 1.474 0.772 0 C-N-CA 123.783 0.833 . . . . 73.05 111.393 -175.627 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.575 ' HA ' HD21 ' A' ' 78' ' ' LEU . 58.9 tp -68.56 -53.95 19.69 Favored 'General case' 0 C--O 1.252 1.19 0 C-N-CA 123.063 0.545 . . . . 62.03 110.221 176.903 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . 0.585 ' HB3' ' HE ' ' A' ' 27' ' ' ARG . 46.1 mt-10 -55.37 -51.2 67.58 Favored 'General case' 0 N--CA 1.475 0.798 0 CA-C-N 114.775 -1.102 . . . . 75.33 110.024 177.749 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . 0.425 HD22 HD12 ' A' ' 32' ' ' LEU . 95.4 mt -60.6 -39.73 89.21 Favored 'General case' 0 N--CA 1.476 0.873 0 C-N-CA 125.382 1.473 . . . . 72.1 111.589 -176.683 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . 0.58 ' HB2' HD21 ' A' ' 33' ' ' LEU . . . -59.76 -48.87 79.95 Favored 'General case' 0 N--CA 1.481 1.106 0 C-N-CA 123.097 0.559 . . . . 43.54 110.823 176.168 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 95.6 mt-30 -66.63 -30.38 70.64 Favored 'General case' 0 CA--C 1.552 1.049 0 CA-C-N 114.901 -1.045 . . . . 65.4 111.633 178.919 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 27' ' ' ARG . . . . . 0.585 ' HE ' ' HB3' ' A' ' 23' ' ' GLU . 44.5 mtt-85 -76.28 -25.45 54.92 Favored 'General case' 0 N--CA 1.488 1.448 0 C-N-CA 123.473 0.709 . . . . 74.22 110.846 176.856 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 98.18 9.54 53.49 Favored Glycine 0 C--N 1.348 1.221 0 CA-C-N 116.364 -0.38 . . . . 54.42 113.244 -177.825 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 29' ' ' GLU . . . . . 0.415 ' HB2' ' HB3' ' A' ' 24' ' ' LEU . 12.8 mm-40 -80.13 57.41 2.69 Favored 'General case' 0 CA--C 1.55 0.976 0 C-N-CA 124.508 1.123 . . . . 72.42 110.482 174.985 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 30' ' ' TRP . . . . . 0.447 ' O ' ' HG ' ' A' ' 34' ' ' LEU . 89.2 m95 -62.0 -35.29 78.08 Favored 'General case' 0 N--CA 1.482 1.169 0 C-N-CA 124.218 1.007 . . . . 73.25 111.51 -175.892 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 6.2 m-20 -54.23 -40.01 67.28 Favored 'General case' 0 N--CA 1.476 0.871 0 C-N-CA 124.766 1.226 . . . . 71.43 111.51 179.619 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 0.425 HD12 HD22 ' A' ' 24' ' ' LEU . 87.9 mt -69.1 -31.23 69.8 Favored 'General case' 0 CA--C 1.543 0.685 0 CA-C-N 115.096 -0.956 . . . . 51.34 110.981 179.112 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . 0.595 ' HA ' HD22 ' A' ' 21' ' ' LEU . 8.5 mp -70.48 -40.3 73.72 Favored 'General case' 0 N--CA 1.491 1.604 0 C-N-CA 122.252 0.221 . . . . 64.53 110.57 173.051 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.447 ' HG ' ' O ' ' A' ' 30' ' ' TRP . 82.6 mt -65.1 -40.65 94.87 Favored 'General case' 0 N--CA 1.479 0.986 0 C-N-CA 123.648 0.779 . . . . 52.4 111.364 -176.916 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 1.6 mp0 -80.32 -55.76 4.67 Favored 'General case' 0 N--CA 1.473 0.72 0 C-N-CA 123.429 0.692 . . . . 70.31 111.197 178.541 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 36' ' ' GLN . . . . . 0.435 ' HB2' HD21 ' A' ' 21' ' ' LEU . 84.1 mm-40 -64.44 -13.08 49.55 Favored 'General case' 0 N--CA 1.494 1.768 0 N-CA-C 113.088 0.773 . . . . 71.54 113.088 -178.935 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . 0.471 ' O ' ' HG ' ' A' ' 41' ' ' LEU . 43.4 tt0 -47.55 -49.43 26.42 Favored 'General case' 0 N--CA 1.478 0.952 0 C-N-CA 122.914 0.486 . . . . 73.02 110.454 169.296 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 40.9 t -57.1 -53.75 39.18 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.088 0 O-C-N 124.061 0.851 . . . . 74.44 111.897 -176.906 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 46.4 p -69.09 -34.17 74.67 Favored 'General case' 0 N--CA 1.483 1.179 0 C-N-CA 122.801 0.44 . . . . 71.34 111.926 -177.399 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 40.9 t80 -64.9 -42.88 94.4 Favored 'General case' 0 N--CA 1.475 0.815 0 C-N-CA 123.513 0.725 . . . . 73.34 110.064 176.836 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . 0.471 ' HG ' ' O ' ' A' ' 37' ' ' GLU . 96.6 mt -60.81 -44.35 96.97 Favored 'General case' 0 C--N 1.35 0.627 0 O-C-N 124.192 0.932 . . . . 64.51 109.856 175.117 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 47.6 tt0 -63.86 -42.6 97.5 Favored 'General case' 0 N--CA 1.473 0.724 0 O-C-N 123.269 0.356 . . . . 74.02 110.761 -179.246 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 30.9 m -59.82 -53.76 54.2 Favored 'General case' 0 N--CA 1.482 1.156 0 C-N-CA 123.157 0.583 . . . . 61.45 111.355 -179.047 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 11.5 tt -66.1 -33.99 67.27 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.054 0 CA-C-N 115.072 -0.967 . . . . 63.44 111.054 -176.706 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 10.1 mm-40 -64.15 -44.93 90.64 Favored 'General case' 0 N--CA 1.484 1.251 0 C-N-CA 123.119 0.568 . . . . 73.13 111.307 172.774 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 46' ' ' THR . . . . . 0.422 ' O ' ' HB2' ' A' ' 50' ' ' LYS . 67.7 m -62.8 -34.06 76.49 Favored 'General case' 0 N--CA 1.478 0.932 0 C-N-CA 122.65 0.38 . . . . 75.42 110.969 -177.882 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 47' ' ' VAL . . . . . . . . . . . . . 58.3 t -71.46 -51.82 30.68 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.021 0 N-CA-C 111.615 0.228 . . . . 64.24 111.615 175.518 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 48' ' ' MET . . . . . . . . . . . . . 75.6 mtm -67.85 -32.84 73.64 Favored 'General case' 0 N--CA 1.488 1.473 0 N-CA-C 112.899 0.703 . . . . 72.42 112.899 -172.777 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 49.6 mt-10 -84.02 -34.42 24.29 Favored 'General case' 0 N--CA 1.483 1.198 0 C-N-CA 123.371 0.668 . . . . 64.51 111.626 -178.632 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . 0.422 ' HB2' ' O ' ' A' ' 46' ' ' THR . 13.8 mptt -79.86 164.08 23.86 Favored 'General case' 0 N--CA 1.483 1.186 0 CA-C-O 121.181 0.515 . . . . 75.25 110.699 -179.677 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 8.9 tt0 -82.83 138.39 33.97 Favored 'General case' 0 C--O 1.241 0.61 0 CA-C-N 115.046 -0.979 . . . . 42.32 110.65 -172.361 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 52' ' ' THR . . . . . 0.693 HG21 ' HB3' ' A' ' 114' ' ' LEU . 39.1 m -72.29 123.59 89.69 Favored Pre-proline 0 CA--C 1.556 1.187 0 N-CA-C 109.178 -0.675 . . . . 61.12 109.178 171.914 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 53' ' ' PRO . . . . . 0.53 ' HG3' ' HA ' ' A' ' 4' ' ' THR . 61.7 Cg_endo -69.3 155.46 67.39 Favored 'Trans proline' 0 C--N 1.376 2.01 0 C-N-CA 123.162 2.575 . . . . 74.53 112.675 -176.664 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 43.9 Cg_endo -67.98 -47.29 1.86 Allowed 'Trans proline' 0 C--N 1.377 2.063 0 C-N-CA 122.367 2.045 . . . . 72.4 112.258 175.004 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . -69.97 80.1 0.36 Allowed Glycine 0 C--N 1.352 1.46 0 O-C-N 123.566 0.541 . . . . 60.41 113.656 -175.796 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 77.7 mt -125.86 98.4 4.96 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.526 0 N-CA-C 107.91 -1.144 . . . . 65.04 107.91 175.085 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 57' ' ' THR . . . . . 0.401 ' H ' HD12 ' A' ' 60' ' ' ILE . 78.5 p -74.45 -179.65 4.12 Favored 'General case' 0 N--CA 1.473 0.712 0 C-N-CA 122.867 0.467 . . . . 72.4 109.917 175.373 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 21.1 tpt180 -64.99 -40.03 94.35 Favored 'General case' 0 N--CA 1.476 0.828 0 N-CA-C 110.371 -0.233 . . . . 64.14 110.371 177.79 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 51.9 m -60.25 -45.24 93.94 Favored 'General case' 0 N--CA 1.478 0.953 0 C-N-CA 123.309 0.644 . . . . 62.1 111.4 177.005 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 60' ' ' ILE . . . . . 0.432 HG23 HD11 ' A' ' 8' ' ' ILE . 80.1 mt -64.8 -39.13 84.61 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.971 0 CA-C-N 115.479 -0.782 . . . . 61.44 110.377 177.272 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 63.2 tt0 -63.18 -41.95 99.28 Favored 'General case' 0 N--CA 1.482 1.143 0 C-N-CA 124.012 0.925 . . . . 73.11 111.131 179.525 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 52.3 m-20 -69.4 -41.54 76.28 Favored 'General case' 0 N--CA 1.477 0.91 0 C-N-CA 123.163 0.585 . . . . 73.42 111.503 179.78 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 63' ' ' MET . . . . . . . . . . . . . 64.9 mtm -65.88 -52.3 51.41 Favored 'General case' 0 N--CA 1.485 1.295 0 C-N-CA 122.351 0.26 . . . . 73.54 111.311 178.477 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 64' ' ' VAL . . . . . 0.533 ' O ' HG13 ' A' ' 68' ' ' ILE . 71.4 t -60.99 -55.84 21.99 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.998 0 C-N-CA 123.456 0.702 . . . . 70.53 110.563 -178.957 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . 0.555 ' HB2' HD23 ' A' ' 109' ' ' LEU . . . -61.33 -37.8 84.61 Favored 'General case' 0 N--CA 1.488 1.455 0 O-C-N 123.478 0.486 . . . . 54.5 111.406 179.715 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -60.98 -37.17 93.41 Favored Glycine 0 C--N 1.346 1.109 0 CA-C-N 116.413 -0.358 . . . . 74.13 112.383 176.521 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 19.3 m-30 -75.86 -34.23 60.04 Favored 'General case' 0 N--CA 1.476 0.846 0 C-N-CA 123.137 0.575 . . . . 72.43 111.622 177.018 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 68' ' ' ILE . . . . . 0.533 HG13 ' O ' ' A' ' 64' ' ' VAL . 61.5 mt -59.69 -53.57 46.48 Favored 'Isoleucine or valine' 0 C--N 1.357 0.923 0 N-CA-C 108.808 -0.812 . . . . 63.51 108.808 175.812 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 69' ' ' LYS . . . . . 0.535 ' HB2' ' HE2' ' A' ' 106' ' ' TYR . 0.6 OUTLIER -59.77 -46.28 89.67 Favored 'General case' 0 C--N 1.348 0.507 0 CA-C-N 115.359 -0.837 . . . . 74.23 110.274 179.919 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 63.3 tt0 -57.08 -45.86 82.98 Favored 'General case' 0 C--N 1.352 0.675 0 O-C-N 124.564 1.165 . . . . 65.12 111.398 -178.589 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 71' ' ' THR . . . . . 0.572 ' HB ' ' HA ' ' A' ' 15' ' ' ALA . 15.1 t -79.66 -21.94 44.13 Favored 'General case' 0 C--O 1.216 -0.684 0 CA-C-O 119.188 -0.434 . . . . 71.44 110.559 -174.657 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 72' ' ' LEU . . . . . 0.524 ' HG ' ' O ' ' A' ' 68' ' ' ILE . 44.0 mt -74.62 -31.84 62.12 Favored 'General case' 0 N--CA 1.483 1.207 0 O-C-N 123.321 0.388 . . . . 72.21 110.521 172.122 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 73' ' ' ASP . . . . . 0.429 ' O ' ' HG ' ' A' ' 77' ' ' LEU . 48.5 m-20 -64.1 -60.17 3.55 Favored 'General case' 0 C--N 1.351 0.654 0 N-CA-C 108.627 -0.879 . . . . 74.35 108.627 172.702 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 48.4 m-20 -55.48 -41.35 72.86 Favored 'General case' 0 N--CA 1.483 1.21 0 C-N-CA 124.354 1.062 . . . . 74.5 111.335 -178.309 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . 0.543 ' O ' ' HG2' ' A' ' 79' ' ' LYS . 5.3 tp10 -58.88 -59.03 6.1 Favored 'General case' 0 N--CA 1.476 0.851 0 C-N-CA 124.348 1.059 . . . . 71.3 109.879 178.447 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 9.4 tt0 -72.45 -26.1 61.7 Favored 'General case' 0 CA--C 1.548 0.891 0 O-C-N 124.128 0.892 . . . . 75.21 111.851 -171.999 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . 0.429 ' HG ' ' O ' ' A' ' 73' ' ' ASP . 97.4 mt -67.61 -43.25 80.9 Favored 'General case' 0 N--CA 1.481 1.08 0 N-CA-C 109.246 -0.65 . . . . 72.03 109.246 174.165 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . 0.575 HD21 ' HA ' ' A' ' 22' ' ' LEU . 28.9 mt -57.3 -46.05 83.54 Favored 'General case' 0 N--CA 1.48 1.032 0 O-C-N 123.726 0.641 . . . . 74.21 111.196 169.55 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 79' ' ' LYS . . . . . 0.543 ' HG2' ' O ' ' A' ' 75' ' ' GLU . 36.2 mmtm -64.67 -38.13 89.93 Favored 'General case' 0 N--CA 1.478 0.955 0 C-N-CA 123.408 0.683 . . . . 61.31 112.316 -175.764 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -71.25 -30.6 67.05 Favored Glycine 0 C--N 1.342 0.906 0 CA-C-N 115.936 -0.574 . . . . 63.31 112.002 174.534 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 4.8 tt -68.8 -43.83 74.8 Favored 'General case' 0 CA--C 1.557 1.225 0 C-N-CA 123.488 0.715 . . . . 70.41 109.728 173.302 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 82' ' ' LEU . . . . . 0.415 ' HG ' ' O ' ' A' ' 78' ' ' LEU . 57.7 mt . . . . . 0 N--CA 1.478 0.947 0 C-N-CA 123.413 0.685 . . . . 74.24 110.201 -170.652 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 64.4 mt . . . . . 0 N--CA 1.481 1.121 0 CA-C-O 119.696 -0.193 . . . . 73.25 110.93 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 76.4 mt -41.31 -41.05 0.68 Allowed 'Isoleucine or valine' 0 N--CA 1.488 1.467 0 C-N-CA 125.224 1.41 . . . . 72.23 111.018 167.967 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -163.31 -151.67 6.53 Favored Glycine 0 C--O 1.242 0.641 0 N-CA-C 110.497 -1.041 . . . . 64.5 110.497 169.049 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 3.9 pt20 -73.92 167.32 21.71 Favored 'General case' 0 CA--C 1.547 0.828 0 N-CA-C 109.128 -0.693 . . . . 73.15 109.128 168.825 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 78.1 p 49.98 -88.21 0.01 OUTLIER 'General case' 0 CA--C 1.555 1.142 0 C-N-CA 125.051 1.34 . . . . 73.03 111.842 -170.469 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 28.2 m 55.64 -78.38 0.01 OUTLIER 'General case' 0 CA--C 1.559 1.303 0 C-N-CA 125.379 1.472 . . . . 73.45 113.27 176.652 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 4.9 ptm180 -45.98 -48.63 16.48 Favored 'General case' 0 N--CA 1.485 1.293 0 C-N-CA 125.699 1.599 . . . . 71.32 114.665 -169.274 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 60.2 tp60 -67.99 -52.02 40.58 Favored 'General case' 0 N--CA 1.471 0.602 0 N-CA-C 109.842 -0.429 . . . . 64.52 109.842 -176.976 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 87.3 tttt -60.68 -45.41 94.28 Favored 'General case' 0 N--CA 1.475 0.791 0 CA-C-N 115.797 -0.638 . . . . 74.34 111.3 -179.231 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 23.0 t -73.63 -46.83 44.5 Favored 'General case' 0 N--CA 1.468 0.432 0 C-N-CA 124.058 0.943 . . . . 73.04 110.983 -168.835 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 102' ' ' LEU . . . . . 0.514 ' HG ' ' HH2' ' A' ' 11' ' ' TRP . 9.4 mp -78.29 -35.51 47.86 Favored 'General case' 0 N--CA 1.473 0.718 0 O-C-N 123.347 0.404 . . . . 63.35 111.427 -176.538 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 60.6 t30 -70.85 -35.73 72.54 Favored 'General case' 0 N--CA 1.488 1.466 0 N-CA-C 109.732 -0.47 . . . . 72.14 109.732 177.874 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 104' ' ' ASN . . . . . 0.441 ' O ' ' HG2' ' A' ' 108' ' ' ARG . 24.4 t-20 -67.0 -43.68 82.29 Favored 'General case' 0 N--CA 1.479 0.998 0 N-CA-C 109.423 -0.584 . . . . 74.43 109.423 172.57 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -60.49 -34.88 74.69 Favored 'General case' 0 N--CA 1.484 1.236 0 C-N-CA 123.407 0.683 . . . . 73.3 111.698 178.703 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 106' ' ' TYR . . . . . 0.535 ' HE2' ' HB2' ' A' ' 69' ' ' LYS . 13.6 t80 -65.56 -52.89 48.97 Favored 'General case' 0 CA--C 1.539 0.536 0 N-CA-C 109.03 -0.729 . . . . 73.41 109.03 175.699 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -62.3 -35.69 91.99 Favored Glycine 0 C--N 1.353 1.508 0 O-C-N 124.095 0.872 . . . . 73.03 112.673 -177.78 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 108' ' ' ARG . . . . . 0.441 ' HG2' ' O ' ' A' ' 104' ' ' ASN . 21.4 mmt180 -75.21 -34.59 61.5 Favored 'General case' 0 N--CA 1.468 0.446 0 C-N-CA 122.879 0.471 . . . . 72.44 110.544 179.16 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 109' ' ' LEU . . . . . 0.555 HD23 ' HB2' ' A' ' 65' ' ' ALA . 41.9 tp -67.13 -41.71 85.67 Favored 'General case' 0 N--CA 1.487 1.412 0 CA-C-O 121.311 0.577 . . . . 70.34 109.857 177.447 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 33.2 t -68.12 -38.76 82.58 Favored 'General case' 0 CA--C 1.545 0.774 0 CA-C-N 114.17 -1.377 . . . . 75.11 109.81 -179.775 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . -89.8 -64.8 1.25 Allowed Glycine 0 C--N 1.355 1.608 0 C-N-CA 121.153 -0.546 . . . . 73.33 113.674 -178.165 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 112' ' ' MET . . . . . 0.578 ' SD ' ' HB2' ' A' ' 113' ' ' LEU . 0.2 OUTLIER -93.8 -71.43 0.66 Allowed 'General case' 0 N--CA 1.481 1.093 0 CA-C-N 117.853 0.826 . . . . 73.12 111.389 -175.793 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 113' ' ' LEU . . . . . 0.578 ' HB2' ' SD ' ' A' ' 112' ' ' MET . 6.1 mt 170.12 35.57 0.0 OUTLIER 'General case' 0 N--CA 1.507 2.409 0 C-N-CA 125.649 1.579 . . . . 63.21 110.342 -178.47 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 114' ' ' LEU . . . . . 0.693 ' HB3' HG21 ' A' ' 52' ' ' THR . 1.9 tt . . . . . 0 N--CA 1.506 2.357 0 C-N-CA 127.03 2.132 . . . . 75.3 111.722 176.843 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 25.2 ttt . . . . . 0 N--CA 1.487 1.375 0 CA-C-O 119.672 -0.204 . . . . 72.43 110.856 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 2' ' ' THR . . . . . 0.421 ' O ' ' HG2' ' A' ' 6' ' ' GLU . 41.6 m -49.47 -49.4 45.61 Favored 'General case' 0 N--CA 1.487 1.398 0 C-N-CA 123.65 0.78 . . . . 73.1 112.798 -173.547 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 68.8 p -60.72 -41.16 94.73 Favored 'General case' 0 N--CA 1.482 1.173 0 C-N-CA 123.609 0.764 . . . . 71.42 112.033 -178.392 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 30.4 m -69.1 -40.69 78.23 Favored 'General case' 0 N--CA 1.48 1.045 0 C-N-CA 123.261 0.625 . . . . 72.44 111.347 179.748 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 99.4 t -65.04 -46.08 92.5 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.922 0 C-N-CA 123.029 0.532 . . . . 73.13 109.885 178.942 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 6' ' ' GLU . . . . . 0.421 ' HG2' ' O ' ' A' ' 2' ' ' THR . 63.0 mm-40 -59.02 -44.69 91.75 Favored 'General case' 0 N--CA 1.476 0.844 0 C-N-CA 123.367 0.667 . . . . 64.44 110.328 174.854 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 39.2 t80 -57.49 -55.62 32.4 Favored 'General case' 0 N--CA 1.479 0.979 0 C-N-CA 124.451 1.1 . . . . 70.52 110.542 -176.036 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 45.3 mt -66.18 -37.36 79.57 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.986 0 C-N-CA 123.518 0.727 . . . . 64.54 110.322 -178.452 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 2.7 t-20 -72.28 -26.7 62.08 Favored 'General case' 0 N--CA 1.488 1.469 0 C-N-CA 123.298 0.639 . . . . 62.15 111.147 -177.442 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . 0.667 ' HB3' HG22 ' A' ' 47' ' ' VAL . 82.0 mtt180 -78.03 -35.47 49.77 Favored 'General case' 0 CA--C 1.536 0.421 0 C-N-CA 123.437 0.695 . . . . 74.4 109.648 174.688 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 11' ' ' TRP . . . . . 0.419 ' CZ3' HG12 ' A' ' 68' ' ' ILE . 73.4 m95 -67.67 -34.16 76.37 Favored 'General case' 0 N--CA 1.479 1.02 0 O-C-N 123.096 0.248 . . . . 74.45 110.381 172.028 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 54.4 mt-30 -60.0 -48.42 81.8 Favored 'General case' 0 C--N 1.359 0.993 0 N-CA-C 108.248 -1.019 . . . . 75.54 108.248 171.1 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 32.2 tpt180 -58.8 -46.81 86.75 Favored 'General case' 0 CA--C 1.552 1.045 0 CA-C-N 115.158 -0.928 . . . . 75.2 111.503 -175.754 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 14' ' ' ILE . . . . . 0.713 HD11 HG21 ' A' ' 47' ' ' VAL . 31.7 mt -67.05 -45.36 87.06 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.439 0 C-N-CA 122.665 0.386 . . . . 75.31 110.163 -179.652 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . 0.419 ' HB1' ' OE1' ' A' ' 70' ' ' GLN . . . -62.15 -42.79 99.6 Favored 'General case' 0 N--CA 1.483 1.193 0 C-N-CA 124.339 1.055 . . . . 73.31 111.792 -177.894 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 95.2 mt -75.51 -39.35 58.59 Favored 'General case' 0 N--CA 1.484 1.249 0 CA-C-N 114.593 -1.185 . . . . 74.31 110.247 -175.694 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.533 ' O ' ' HG ' ' A' ' 21' ' ' LEU . 44.2 mt -63.9 -49.14 73.84 Favored 'General case' 0 C--O 1.211 -0.948 0 O-C-N 123.565 0.54 . . . . 74.51 109.99 176.48 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 83.3 p -65.42 -30.55 71.37 Favored 'General case' 0 N--CA 1.484 1.265 0 C-N-CA 122.821 0.448 . . . . 64.1 111.515 -179.54 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 19' ' ' GLN . . . . . 0.578 ' HA ' HD22 ' A' ' 74' ' ' ASN . 5.6 tp-100 -63.42 -47.69 80.91 Favored 'General case' 0 N--CA 1.481 1.115 0 CA-C-O 121.546 0.688 . . . . 72.03 110.124 173.037 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 55.0 m -61.39 -48.12 82.68 Favored 'General case' 0 CA--C 1.538 0.502 0 CA-C-N 114.321 -1.309 . . . . 42.33 110.394 178.488 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . 0.533 ' HG ' ' O ' ' A' ' 17' ' ' LEU . 95.6 mt -60.46 -38.42 84.15 Favored 'General case' 0 N--CA 1.473 0.679 0 C-N-CA 124.218 1.007 . . . . 75.12 110.136 -178.117 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.824 ' HA ' HD21 ' A' ' 78' ' ' LEU . 35.9 tp -61.09 -55.72 29.24 Favored 'General case' 0 C--O 1.253 1.276 0 C-N-CA 123.539 0.736 . . . . 71.1 110.733 178.812 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . 0.506 ' O ' ' HG3' ' A' ' 27' ' ' ARG . 56.0 mt-10 -59.19 -55.48 34.46 Favored 'General case' 0 CA--C 1.543 0.699 0 CA-C-N 114.917 -1.038 . . . . 71.32 111.678 -178.743 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . 0.482 HD22 HD12 ' A' ' 32' ' ' LEU . 78.5 mt -58.42 -38.68 77.9 Favored 'General case' 0 N--CA 1.478 0.973 0 C-N-CA 124.714 1.206 . . . . 74.0 111.776 -175.952 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . 0.514 ' HB2' HD21 ' A' ' 33' ' ' LEU . . . -62.13 -45.16 94.67 Favored 'General case' 0 N--CA 1.478 0.934 0 C-N-CA 123.247 0.619 . . . . 74.01 111.727 176.033 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 92.6 mt-30 -73.17 -14.82 61.43 Favored 'General case' 0 CA--C 1.557 1.217 0 CA-C-N 115.42 -0.809 . . . . 74.3 111.564 177.48 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 27' ' ' ARG . . . . . 0.506 ' HG3' ' O ' ' A' ' 23' ' ' GLU . 72.7 mtt-85 -87.84 -2.15 58.43 Favored 'General case' 0 N--CA 1.491 1.616 0 C-N-CA 123.58 0.752 . . . . 72.5 111.489 170.979 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 85.45 0.02 88.32 Favored Glycine 0 N--CA 1.48 1.591 0 N-CA-C 113.9 0.32 . . . . 53.13 113.9 -179.311 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 24.2 mm-40 -85.2 68.2 10.43 Favored 'General case' 0 N--CA 1.473 0.695 0 C-N-CA 124.696 1.199 . . . . 74.32 111.287 -176.692 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 30' ' ' TRP . . . . . 0.44 ' O ' ' HG ' ' A' ' 34' ' ' LEU . 69.2 m95 -67.84 -28.7 67.78 Favored 'General case' 0 N--CA 1.48 1.046 0 CA-C-N 115.712 -0.677 . . . . 75.31 110.386 178.292 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 10.4 m-20 -53.13 -46.67 68.88 Favored 'General case' 0 N--CA 1.479 1.017 0 C-N-CA 124.738 1.215 . . . . 72.33 111.576 176.022 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 0.482 HD12 HD22 ' A' ' 24' ' ' LEU . 70.7 mt -70.44 -26.53 63.7 Favored 'General case' 0 CA--C 1.544 0.749 0 CA-C-N 114.856 -1.065 . . . . 64.55 110.758 -175.82 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . 0.514 HD21 ' HB2' ' A' ' 25' ' ' ALA . 11.0 mp -70.04 -42.86 72.34 Favored 'General case' 0 N--CA 1.485 1.325 0 C-N-CA 122.937 0.495 . . . . 74.43 110.418 172.45 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.44 ' HG ' ' O ' ' A' ' 30' ' ' TRP . 77.0 mt -65.02 -33.97 77.32 Favored 'General case' 0 N--CA 1.484 1.263 0 C-N-CA 123.495 0.718 . . . . 73.01 111.292 -179.776 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 96.5 mt-30 -71.47 -52.16 19.93 Favored 'General case' 0 N--CA 1.477 0.915 0 C-N-CA 123.446 0.698 . . . . 73.4 110.658 176.716 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 84.8 mm-40 -74.5 -12.74 60.56 Favored 'General case' 0 N--CA 1.481 1.081 0 C-N-CA 123.743 0.817 . . . . 71.32 112.594 -177.571 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . 0.43 ' O ' ' HG ' ' A' ' 41' ' ' LEU . 38.4 tt0 -52.86 -53.84 43.08 Favored 'General case' 0 N--CA 1.48 1.051 0 C-N-CA 124.066 0.947 . . . . 75.23 111.577 178.456 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 83.8 t -60.42 -39.53 81.34 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.258 0 C-N-CA 123.241 0.616 . . . . 71.43 110.901 -178.239 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 36.4 m -63.72 -43.63 95.98 Favored 'General case' 0 CA--C 1.551 0.987 0 CA-C-N 115.458 -0.792 . . . . 72.55 111.03 177.246 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 59.5 t80 -65.04 -52.66 54.61 Favored 'General case' 0 N--CA 1.479 0.977 0 C-N-CA 124.778 1.231 . . . . 70.41 110.242 -175.888 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . 0.43 ' HG ' ' O ' ' A' ' 37' ' ' GLU . 69.6 mt -63.01 -44.74 95.13 Favored 'General case' 0 C--N 1.35 0.609 0 CA-C-N 114.729 -1.123 . . . . 63.31 110.95 -177.64 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 50.9 tt0 -61.04 -47.9 84.24 Favored 'General case' 0 N--CA 1.481 1.08 0 C-N-CA 122.797 0.439 . . . . 74.1 111.009 179.709 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 43' ' ' SER . . . . . 0.503 ' O ' HG23 ' A' ' 47' ' ' VAL . 63.2 m -57.76 -53.76 54.52 Favored 'General case' 0 N--CA 1.481 1.124 0 C-N-CA 123.381 0.672 . . . . 72.51 111.407 -178.968 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 20.8 tt -69.37 -28.67 39.23 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.864 0 CA-C-N 115.54 -0.754 . . . . 73.2 112.045 -174.037 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 14.0 mm-40 -62.52 -47.42 84.0 Favored 'General case' 0 N--CA 1.479 0.982 0 C-N-CA 122.709 0.404 . . . . 50.32 110.151 169.374 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 19.2 m -61.96 -27.67 69.01 Favored 'General case' 0 N--CA 1.481 1.082 0 O-C-N 123.906 0.754 . . . . 72.03 111.139 179.987 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 47' ' ' VAL . . . . . 0.713 HG21 HD11 ' A' ' 14' ' ' ILE . 21.1 t -75.4 -50.98 22.27 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.213 0 O-C-N 122.26 -0.275 . . . . 74.23 111.602 175.086 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 48' ' ' MET . . . . . . . . . . . . . 73.9 mtm -73.4 -20.87 60.64 Favored 'General case' 0 N--CA 1.492 1.648 0 N-CA-C 112.818 0.673 . . . . 52.14 112.818 -172.35 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 16.1 pt-20 -85.05 -11.51 55.16 Favored 'General case' 0 N--CA 1.48 1.045 0 C-N-CA 122.598 0.359 . . . . 74.21 111.134 175.047 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 11.9 mptt -94.62 155.88 16.68 Favored 'General case' 0 N--CA 1.485 1.294 0 C-N-CA 124.213 1.005 . . . . 54.0 110.852 -178.567 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 8.8 tt0 -87.07 142.23 28.08 Favored 'General case' 0 CA--C 1.545 0.773 0 CA-C-N 114.901 -1.045 . . . . 75.42 110.218 -179.396 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 95.7 m -68.74 131.59 91.17 Favored Pre-proline 0 CA--C 1.555 1.173 0 C-N-CA 123.868 0.867 . . . . 53.02 110.128 174.48 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 26.9 Cg_exo -66.79 151.91 81.52 Favored 'Trans proline' 0 C--N 1.381 2.285 0 C-N-CA 122.388 2.059 . . . . 72.13 112.475 172.891 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 17.0 Cg_exo -71.4 -46.88 0.57 Allowed 'Trans proline' 0 C--N 1.373 1.824 0 C-N-CA 122.898 2.398 . . . . 75.02 112.339 174.916 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . -81.98 48.92 4.0 Favored Glycine 0 C--N 1.351 1.383 0 CA-C-N 115.792 -0.64 . . . . 73.2 114.636 -172.742 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 56' ' ' ILE . . . . . 0.507 ' HB ' HD21 ' A' ' 113' ' ' LEU . 44.2 mt -81.71 109.1 15.52 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.598 0 N-CA-C 108.331 -0.988 . . . . 62.22 108.331 170.89 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 57' ' ' THR . . . . . 0.417 ' H ' HD12 ' A' ' 60' ' ' ILE . 67.6 p -75.76 -178.36 4.2 Favored 'General case' 0 N--CA 1.476 0.84 0 C-N-CA 123.434 0.694 . . . . 72.52 110.729 -179.687 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 47.4 tpt85 -60.1 -48.44 81.72 Favored 'General case' 0 CA--C 1.546 0.811 0 C-N-CA 123.331 0.653 . . . . 63.13 109.638 174.48 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 14.9 m -59.33 -44.59 92.59 Favored 'General case' 0 C--O 1.248 0.982 0 C-N-CA 124.502 1.121 . . . . 51.43 111.625 179.754 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 60' ' ' ILE . . . . . 0.417 HD12 ' H ' ' A' ' 57' ' ' THR . 87.5 mt -66.07 -38.35 81.82 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.652 0 CA-C-N 114.87 -1.059 . . . . 74.32 110.38 179.812 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 51.9 tt0 -64.27 -40.28 95.67 Favored 'General case' 0 N--CA 1.48 1.071 0 C-N-CA 123.028 0.531 . . . . 71.23 110.655 177.642 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 40.2 m-20 -60.92 -50.34 73.81 Favored 'General case' 0 N--CA 1.479 0.993 0 C-N-CA 123.11 0.564 . . . . 64.02 110.811 178.259 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 63' ' ' MET . . . . . . . . . . . . . 71.4 mtm -63.41 -57.83 9.02 Favored 'General case' 0 N--CA 1.478 0.971 0 CA-C-N 115.856 -0.611 . . . . 75.14 110.787 -178.902 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 64' ' ' VAL . . . . . 0.493 ' O ' HG13 ' A' ' 68' ' ' ILE . 55.7 t -54.72 -57.89 5.42 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.146 0 C-N-CA 124.04 0.936 . . . . 70.31 111.412 -177.495 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . 0.48 ' HB2' HD23 ' A' ' 109' ' ' LEU . . . -63.76 -41.91 97.92 Favored 'General case' 0 N--CA 1.488 1.427 0 C-N-CA 122.393 0.277 . . . . 74.13 111.5 -178.072 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -58.26 -37.35 86.69 Favored Glycine 0 C--N 1.351 1.375 0 O-C-N 123.192 0.307 . . . . 42.24 112.446 177.813 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 67' ' ' TYR . . . . . 0.514 ' O ' HG22 ' A' ' 71' ' ' THR . 18.1 m-30 -71.67 -38.73 70.62 Favored 'General case' 0 N--CA 1.472 0.671 0 C-N-CA 123.422 0.689 . . . . 73.45 111.48 177.028 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 68' ' ' ILE . . . . . 0.507 ' O ' ' HG ' ' A' ' 72' ' ' LEU . 69.8 mt -57.93 -53.39 45.93 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.05 0 O-C-N 123.904 0.752 . . . . 61.13 109.232 177.363 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 69' ' ' LYS . . . . . 0.496 ' HB2' ' CE2' ' A' ' 106' ' ' TYR . 23.0 tptm -61.02 -38.24 85.4 Favored 'General case' 0 N--CA 1.474 0.767 0 C-N-CA 123.262 0.625 . . . . 65.32 110.93 179.109 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 70' ' ' GLN . . . . . 0.419 ' OE1' ' HB1' ' A' ' 15' ' ' ALA . 64.3 tt0 -59.67 -47.04 87.19 Favored 'General case' 0 C--N 1.349 0.586 0 O-C-N 123.746 0.654 . . . . 70.12 110.715 179.737 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 71' ' ' THR . . . . . 0.514 HG22 ' O ' ' A' ' 67' ' ' TYR . 2.2 t -77.51 -26.97 51.6 Favored 'General case' 0 C--N 1.354 0.78 0 O-C-N 122.341 -0.224 . . . . 71.44 111.601 -177.169 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 72' ' ' LEU . . . . . 0.513 HD21 ' HB2' ' A' ' 102' ' ' LEU . 41.7 mt -69.97 -41.36 74.58 Favored 'General case' 0 N--CA 1.483 1.183 0 C-N-CA 122.153 0.181 . . . . 62.23 110.892 175.853 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 73' ' ' ASP . . . . . 0.424 ' O ' ' HG ' ' A' ' 77' ' ' LEU . 18.8 t70 -78.08 -42.12 33.19 Favored 'General case' 0 N--CA 1.477 0.9 0 O-C-N 123.952 0.782 . . . . 60.13 110.517 -175.717 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 74' ' ' ASN . . . . . 0.578 HD22 ' HA ' ' A' ' 19' ' ' GLN . 3.7 m-20 -63.43 -45.15 92.25 Favored 'General case' 0 N--CA 1.482 1.151 0 C-N-CA 122.986 0.514 . . . . 62.52 110.448 176.976 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 27.2 tt0 -66.07 -36.69 83.87 Favored 'General case' 0 C--O 1.206 -1.192 0 O-C-N 123.427 0.454 . . . . 64.12 110.093 175.934 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 7.7 tt0 -56.98 -44.34 82.6 Favored 'General case' 0 N--CA 1.494 1.734 0 C-N-CA 123.818 0.847 . . . . 73.45 110.83 178.518 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . 0.424 ' HG ' ' O ' ' A' ' 73' ' ' ASP . 94.8 mt -67.67 -46.41 72.44 Favored 'General case' 0 N--CA 1.478 0.958 0 CA-C-N 114.829 -1.078 . . . . 75.23 110.983 179.59 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . 0.824 HD21 ' HA ' ' A' ' 22' ' ' LEU . 71.3 mt -61.0 -52.85 63.24 Favored 'General case' 0 N--CA 1.488 1.427 0 C-N-CA 124.219 1.008 . . . . 74.41 112.802 178.43 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 36.6 ttmt -68.19 -30.31 69.38 Favored 'General case' 0 C--N 1.315 -0.894 0 C-N-CA 125.409 1.484 . . . . 72.45 110.395 -175.328 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -71.11 -37.67 63.79 Favored Glycine 0 CA--C 1.536 1.364 0 CA-C-N 115.798 -0.637 . . . . 51.34 112.571 170.062 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 4.2 tt -63.88 -53.79 44.99 Favored 'General case' 0 N--CA 1.491 1.597 0 C-N-CA 124.043 0.937 . . . . 62.51 108.979 179.951 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 76.3 mt . . . . . 0 CA--C 1.54 0.559 0 C-N-CA 124.705 1.202 . . . . 65.34 110.048 178.788 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 76.3 mt . . . . . 0 N--CA 1.48 1.055 0 N-CA-C 112.574 0.583 . . . . 62.51 112.574 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 36.7 mt -82.28 75.03 0.93 Allowed 'Isoleucine or valine' 0 N--CA 1.475 0.811 0 N-CA-C 108.144 -1.058 . . . . 44.22 108.144 -177.193 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 75.32 -77.04 1.23 Allowed Glycine 0 C--N 1.347 1.146 0 CA-C-N 114.61 -1.177 . . . . 52.25 111.098 -169.092 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 84.4 mt-30 -104.59 -159.96 0.74 Allowed 'General case' 0 CA--C 1.549 0.922 0 C-N-CA 124.187 0.995 . . . . 71.13 110.593 -178.259 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 20.4 p -76.87 44.83 0.4 Allowed 'General case' 0 N--CA 1.478 0.97 0 C-N-CA 125.142 1.377 . . . . 70.23 113.159 176.334 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 28.5 m -62.21 -18.56 61.44 Favored 'General case' 0 CA--C 1.555 1.17 0 C-N-CA 124.785 1.234 . . . . 73.25 111.915 177.782 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 12.7 ttp85 -52.48 -55.38 22.34 Favored 'General case' 0 C--N 1.363 1.182 0 C-N-CA 124.435 1.094 . . . . 63.3 113.511 -172.278 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 7.3 tp60 -60.36 -44.41 95.61 Favored 'General case' 0 N--CA 1.478 0.935 0 O-C-N 123.916 0.76 . . . . 52.01 109.71 -173.824 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 27.0 mtpp -64.59 -40.75 96.09 Favored 'General case' 0 N--CA 1.477 0.879 0 CA-C-N 114.716 -1.129 . . . . 75.12 111.682 178.136 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 45.0 t -67.77 -47.73 68.35 Favored 'General case' 0 N--CA 1.478 0.941 0 C-N-CA 124.245 1.018 . . . . 73.4 110.752 -172.4 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 102' ' ' LEU . . . . . 0.513 ' HB2' HD21 ' A' ' 72' ' ' LEU . 10.2 mp -77.52 -30.26 52.79 Favored 'General case' 0 N--CA 1.472 0.652 0 CA-C-N 115.856 -0.611 . . . . 61.05 111.16 -179.236 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -64.28 -46.14 84.97 Favored 'General case' 0 N--CA 1.484 1.267 0 N-CA-C 109.064 -0.717 . . . . 63.34 109.064 176.492 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 104' ' ' ASN . . . . . 0.419 ' O ' ' HG2' ' A' ' 108' ' ' ARG . 6.1 t-20 -63.7 -46.27 86.26 Favored 'General case' 0 CA--C 1.539 0.525 0 CA-C-N 115.248 -0.887 . . . . 73.42 109.895 176.35 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -58.03 -37.49 74.45 Favored 'General case' 0 N--CA 1.482 1.146 0 C-N-CA 124.03 0.932 . . . . 73.35 111.438 179.348 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 106' ' ' TYR . . . . . 0.496 ' CE2' ' HB2' ' A' ' 69' ' ' LYS . 12.0 t80 -65.23 -50.37 66.1 Favored 'General case' 0 N--CA 1.475 0.793 0 C-N-CA 123.707 0.803 . . . . 72.52 109.394 177.324 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -60.95 -40.01 97.8 Favored Glycine 0 C--N 1.351 1.362 0 O-C-N 124.01 0.819 . . . . 74.3 112.966 -177.513 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 108' ' ' ARG . . . . . 0.419 ' HG2' ' O ' ' A' ' 104' ' ' ASN . 26.7 mmt180 -75.08 -29.38 60.65 Favored 'General case' 0 CA--C 1.548 0.881 0 C-N-CA 122.764 0.425 . . . . 54.31 110.244 179.307 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 109' ' ' LEU . . . . . 0.498 ' HA ' ' H ' ' A' ' 114' ' ' LEU . 45.6 tp -71.05 -36.63 72.39 Favored 'General case' 0 N--CA 1.492 1.657 0 C-N-CA 123.221 0.608 . . . . 64.42 110.475 176.361 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 45.3 t -69.85 -41.23 75.16 Favored 'General case' 0 CA--C 1.54 0.587 0 CA-C-N 115.019 -0.991 . . . . 63.0 109.604 177.758 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . -89.58 -63.68 1.28 Allowed Glycine 0 C--N 1.359 1.819 0 CA-C-O 119.42 -0.656 . . . . 53.32 114.438 -175.075 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 112' ' ' MET . . . . . . . . . . . . . 1.1 tmm? -96.26 -67.53 0.84 Allowed 'General case' 0 N--CA 1.493 1.721 0 CA-C-N 118.38 1.09 . . . . 73.11 112.366 -175.125 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 113' ' ' LEU . . . . . 0.507 HD21 ' HB ' ' A' ' 56' ' ' ILE . 1.4 tt 165.77 48.72 0.0 OUTLIER 'General case' 0 N--CA 1.508 2.458 0 C-N-CA 125.704 1.602 . . . . 73.21 107.878 179.755 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 114' ' ' LEU . . . . . 0.498 ' H ' ' HA ' ' A' ' 109' ' ' LEU . 1.3 tt . . . . . 0 N--CA 1.496 1.837 0 C-N-CA 126.76 2.024 . . . . 74.53 111.281 177.171 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 1' ' ' MET . . . . . 0.501 ' HG2' ' HB ' ' A' ' 4' ' ' THR . 38.6 ttp . . . . . 0 N--CA 1.483 1.219 0 N-CA-C 109.253 -0.647 . . . . 52.24 109.253 . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 42.5 m -50.25 -50.55 49.65 Favored 'General case' 0 N--CA 1.478 0.958 0 C-N-CA 124.85 1.26 . . . . 75.31 113.405 -170.118 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 37.0 m -56.25 -47.99 77.41 Favored 'General case' 0 N--CA 1.48 1.042 0 C-N-CA 123.249 0.619 . . . . 74.13 111.628 -176.688 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 4' ' ' THR . . . . . 0.508 HG21 HD13 ' A' ' 60' ' ' ILE . 40.9 m -68.66 -44.71 73.53 Favored 'General case' 0 C--N 1.35 0.625 0 CA-C-N 115.614 -0.721 . . . . 63.42 110.979 -179.29 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 83.9 t -62.33 -40.12 86.71 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.939 0 C-N-CA 123.115 0.566 . . . . 73.23 110.88 -177.789 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 6' ' ' GLU . . . . . 0.412 ' O ' ' HG3' ' A' ' 10' ' ' ARG . 34.2 mm-40 -69.21 -39.97 78.29 Favored 'General case' 0 N--CA 1.47 0.561 0 O-C-N 123.554 0.534 . . . . 62.11 110.591 177.226 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 30.4 t80 -65.38 -40.01 92.97 Favored 'General case' 0 CA--C 1.554 1.13 0 C-N-CA 122.67 0.388 . . . . 74.34 110.568 -179.545 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 8' ' ' ILE . . . . . 0.586 HD11 HG23 ' A' ' 60' ' ' ILE . 81.0 mt -68.06 -37.03 77.59 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.161 0 C-N-CA 123.876 0.87 . . . . 54.32 109.723 173.984 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 26.6 t-20 -64.45 -28.7 69.85 Favored 'General case' 0 N--CA 1.483 1.207 0 C-N-CA 124.001 0.92 . . . . 74.31 110.896 176.384 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . 0.636 ' HB3' HG22 ' A' ' 47' ' ' VAL . 91.5 mtt180 -82.11 -28.8 32.08 Favored 'General case' 0 CA--C 1.539 0.552 0 C-N-CA 123.474 0.71 . . . . 73.34 110.407 177.135 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 11' ' ' TRP . . . . . . . . . . . . . 53.4 m95 -70.92 -33.54 70.63 Favored 'General case' 0 N--CA 1.48 1.034 0 CA-C-O 119.745 -0.169 . . . . 72.11 110.632 167.608 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . 0.44 ' HG2' ' CE2' ' A' ' 67' ' ' TYR . 53.0 mt-30 -60.65 -49.19 78.52 Favored 'General case' 0 C--N 1.361 1.092 0 N-CA-C 107.874 -1.158 . . . . 55.23 107.874 171.838 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 28.5 tpt180 -53.19 -54.16 39.96 Favored 'General case' 0 CA--C 1.551 1.001 0 CA-C-N 114.267 -1.333 . . . . 73.25 111.345 -177.834 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 14' ' ' ILE . . . . . 0.406 HG13 ' O ' ' A' ' 10' ' ' ARG . 52.7 mt -62.38 -49.14 85.14 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.263 0 C-N-CA 122.501 0.321 . . . . 62.42 110.304 179.704 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . 0.527 ' HA ' ' HB ' ' A' ' 71' ' ' THR . . . -58.94 -44.15 91.34 Favored 'General case' 0 N--CA 1.485 1.288 0 C-N-CA 124.08 0.952 . . . . 62.2 112.319 -176.004 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 91.1 mt -74.47 -45.27 47.31 Favored 'General case' 0 N--CA 1.479 1.023 0 CA-C-N 114.956 -1.02 . . . . 73.43 110.632 -173.741 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.536 ' O ' ' HG ' ' A' ' 21' ' ' LEU . 90.2 mt -59.8 -51.21 70.72 Favored 'General case' 0 N--CA 1.474 0.748 0 O-C-N 123.588 0.555 . . . . 43.41 110.201 179.041 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 78.1 p -66.01 -37.1 85.06 Favored 'General case' 0 N--CA 1.479 0.993 0 O-C-N 123.698 0.623 . . . . 71.13 111.97 -177.088 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 6.8 tp-100 -63.26 -44.24 95.73 Favored 'General case' 0 C--O 1.25 1.1 0 CA-C-O 121.281 0.563 . . . . 75.43 110.753 178.022 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 35.9 m -59.48 -46.02 90.01 Favored 'General case' 0 CA--C 1.535 0.372 0 CA-C-N 114.978 -1.01 . . . . 74.02 109.823 174.255 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . 0.687 HD22 ' HA ' ' A' ' 33' ' ' LEU . 47.9 mt -63.95 -29.27 70.45 Favored 'General case' 0 N--CA 1.473 0.712 0 C-N-CA 123.142 0.577 . . . . 62.13 111.392 -178.836 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.651 ' HA ' HD21 ' A' ' 78' ' ' LEU . 36.5 tp -70.48 -50.99 32.25 Favored 'General case' 0 C--O 1.245 0.818 0 O-C-N 123.332 0.395 . . . . 72.25 110.043 178.842 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 23.8 mt-10 -60.96 -43.14 99.16 Favored 'General case' 0 N--CA 1.483 1.22 0 O-C-N 123.361 0.413 . . . . 74.13 111.435 177.063 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 96.5 mt -63.46 -39.64 94.99 Favored 'General case' 0 N--CA 1.475 0.782 0 C-N-CA 123.604 0.762 . . . . 64.44 110.767 -179.658 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . 0.515 ' HB2' HD21 ' A' ' 33' ' ' LEU . . . -63.75 -40.53 96.95 Favored 'General case' 0 N--CA 1.481 1.117 0 C-N-CA 123.246 0.618 . . . . 74.34 111.573 178.004 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 26' ' ' GLN . . . . . 0.455 HE21 ' HG ' ' A' ' 22' ' ' LEU . 66.9 mt-30 -59.87 -39.54 85.6 Favored 'General case' 0 N--CA 1.484 1.256 0 C-N-CA 123.527 0.731 . . . . 75.55 110.785 173.209 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 47.8 mtt180 -81.61 -5.42 58.02 Favored 'General case' 0 N--CA 1.484 1.254 0 C-N-CA 123.63 0.772 . . . . 73.12 112.155 -179.613 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 79.12 15.97 79.46 Favored Glycine 0 C--N 1.35 1.313 0 O-C-N 123.126 0.266 . . . . 40.22 113.671 177.852 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 18.7 mm-40 -83.41 51.31 1.96 Allowed 'General case' 0 N--CA 1.476 0.859 0 C-N-CA 124.805 1.242 . . . . 53.13 111.248 177.273 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 30' ' ' TRP . . . . . 0.489 ' O ' ' HG ' ' A' ' 34' ' ' LEU . 88.5 m95 -62.33 -27.0 68.75 Favored 'General case' 0 N--CA 1.475 0.808 0 C-N-CA 123.457 0.703 . . . . 72.32 111.369 -177.309 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 11.2 m-20 -51.89 -54.74 25.8 Favored 'General case' 0 N--CA 1.478 0.928 0 O-C-N 123.933 0.771 . . . . 74.04 109.816 171.242 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 93.6 mt -63.18 -28.79 70.29 Favored 'General case' 0 N--CA 1.471 0.586 0 CA-C-N 114.862 -1.063 . . . . 70.34 111.417 -177.335 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . 0.687 ' HA ' HD22 ' A' ' 21' ' ' LEU . 8.4 mp -66.62 -42.8 86.24 Favored 'General case' 0 N--CA 1.479 0.977 0 O-C-N 123.151 0.282 . . . . 75.22 110.849 172.206 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.489 ' HG ' ' O ' ' A' ' 30' ' ' TRP . 77.0 mt -68.81 -35.87 77.52 Favored 'General case' 0 N--CA 1.483 1.178 0 O-C-N 123.621 0.575 . . . . 64.34 111.792 -176.826 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 1.3 mp0 -73.51 -55.33 6.47 Favored 'General case' 0 N--CA 1.483 1.21 0 N-CA-C 110.134 -0.321 . . . . 74.11 110.134 176.636 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 36' ' ' GLN . . . . . 0.483 ' HB2' HD21 ' A' ' 21' ' ' LEU . 82.6 mm-40 -65.63 -14.87 62.06 Favored 'General case' 0 N--CA 1.487 1.381 0 C-N-CA 123.516 0.726 . . . . 74.45 112.524 179.775 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . 0.522 ' O ' ' HG ' ' A' ' 41' ' ' LEU . 29.8 tt0 -50.36 -53.62 27.76 Favored 'General case' 0 C--O 1.217 -0.657 0 O-C-N 124.228 0.955 . . . . 74.35 110.591 173.386 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 60.7 t -55.58 -43.9 74.52 Favored 'Isoleucine or valine' 0 C--O 1.249 1.052 0 C-N-CA 123.981 0.913 . . . . 55.14 111.361 -175.632 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 19.6 m -61.34 -49.15 78.13 Favored 'General case' 0 N--CA 1.476 0.86 0 CA-C-N 115.517 -0.765 . . . . 53.03 110.398 175.324 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 40.2 t80 -60.38 -40.43 90.81 Favored 'General case' 0 N--CA 1.474 0.745 0 C-N-CA 124.434 1.094 . . . . 74.2 111.448 -176.932 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . 0.522 ' HG ' ' O ' ' A' ' 37' ' ' GLU . 71.7 mt -70.69 -46.56 62.93 Favored 'General case' 0 C--N 1.349 0.57 0 C-N-CA 123.62 0.768 . . . . 73.13 110.26 -176.62 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 53.3 tt0 -58.2 -42.39 86.03 Favored 'General case' 0 N--CA 1.474 0.748 0 O-C-N 123.503 0.502 . . . . 75.21 110.638 177.304 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 43' ' ' SER . . . . . 0.468 ' O ' HG23 ' A' ' 47' ' ' VAL . 49.6 m -63.71 -57.01 11.34 Favored 'General case' 0 CA--C 1.542 0.641 0 CA-C-N 115.514 -0.766 . . . . 74.22 112.007 -177.973 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 15.9 tt -63.06 -34.15 64.93 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.88 0 C-N-CA 123.391 0.676 . . . . 72.2 111.115 -174.959 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . 0.591 ' HG2' HD22 ' A' ' 92' ' ' LEU . 23.7 mm-40 -61.02 -53.6 55.22 Favored 'General case' 0 C--N 1.359 0.992 0 O-C-N 123.252 0.345 . . . . 70.21 110.594 169.819 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 46' ' ' THR . . . . . 0.43 ' O ' ' HB2' ' A' ' 50' ' ' LYS . 96.0 m -53.26 -34.43 57.21 Favored 'General case' 0 N--CA 1.482 1.155 0 C-N-CA 123.532 0.733 . . . . 73.34 111.664 -176.976 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 47' ' ' VAL . . . . . 0.636 HG22 ' HB3' ' A' ' 10' ' ' ARG . 41.2 t -75.64 -48.57 29.64 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.938 0 C-N-CA 123.189 0.595 . . . . 73.25 111.782 179.019 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 48' ' ' MET . . . . . . . . . . . . . 76.2 mtm -68.78 -30.53 69.15 Favored 'General case' 0 N--CA 1.489 1.485 0 C-N-CA 122.611 0.365 . . . . 74.34 111.736 -177.736 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 51.2 mt-10 -75.64 -18.48 59.66 Favored 'General case' 0 N--CA 1.48 1.063 0 C-N-CA 124.121 0.968 . . . . 71.43 110.867 175.845 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . 0.447 ' HE2' HH12 ' A' ' 10' ' ' ARG . 0.1 OUTLIER -93.36 142.52 27.23 Favored 'General case' 0 C--O 1.237 0.409 0 C-N-CA 122.936 0.494 . . . . 71.4 110.056 -175.738 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 36.8 tt0 -79.46 141.41 36.8 Favored 'General case' 0 C--O 1.244 0.814 0 N-CA-C 108.954 -0.758 . . . . 71.54 108.954 173.628 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 52' ' ' THR . . . . . 0.685 HG21 ' HB3' ' A' ' 114' ' ' LEU . 32.1 m -73.78 131.29 82.04 Favored Pre-proline 0 CA--C 1.552 1.033 0 O-C-N 123.624 0.578 . . . . 73.05 110.263 177.255 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 53' ' ' PRO . . . . . 0.413 ' HG2' ' HA ' ' A' ' 4' ' ' THR . 25.5 Cg_exo -65.29 155.12 70.3 Favored 'Trans proline' 0 C--N 1.371 1.743 0 C-N-CA 122.94 2.427 . . . . 74.53 112.814 174.784 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 32.8 Cg_exo -61.49 -47.7 11.05 Favored 'Trans proline' 0 C--N 1.376 1.999 0 C-N-CA 123.603 2.869 . . . . 53.34 112.812 179.268 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . -65.52 84.85 0.08 OUTLIER Glycine 0 C--N 1.347 1.148 0 CA-C-N 115.156 -0.929 . . . . 72.13 113.932 -173.553 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 62.6 mt -121.15 103.99 14.53 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.467 0 N-CA-C 107.932 -1.136 . . . . 73.21 107.932 173.75 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 57' ' ' THR . . . . . 0.444 ' H ' HD12 ' A' ' 60' ' ' ILE . 58.0 p -91.97 -174.36 3.77 Favored 'General case' 0 CA--C 1.544 0.743 0 C-N-CA 123.476 0.711 . . . . 75.01 109.668 175.175 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 3.6 tmt_? -60.52 -52.31 65.72 Favored 'General case' 0 CA--C 1.545 0.774 0 C-N-CA 123.949 0.9 . . . . 73.42 110.905 178.727 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 57.6 p -62.7 -39.11 92.96 Favored 'General case' 0 N--CA 1.481 1.085 0 C-N-CA 123.373 0.669 . . . . 71.44 111.635 -179.563 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 60' ' ' ILE . . . . . 0.586 HG23 HD11 ' A' ' 8' ' ' ILE . 87.0 mt -63.13 -47.98 89.91 Favored 'Isoleucine or valine' 0 C--N 1.349 0.55 0 CA-C-N 115.108 -0.951 . . . . 71.21 110.795 179.065 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 27.9 pt20 -70.97 -25.13 62.58 Favored 'General case' 0 N--CA 1.481 1.104 0 CA-C-N 117.491 0.132 . . . . 74.34 110.997 -177.885 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 53.8 m-20 -65.58 -48.56 71.93 Favored 'General case' 0 N--CA 1.482 1.132 0 C-N-CA 122.268 0.227 . . . . 71.53 111.256 172.647 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 63' ' ' MET . . . . . . . . . . . . . 73.4 mtm -65.87 -45.03 83.59 Favored 'General case' 0 N--CA 1.478 0.953 0 O-C-N 123.448 0.467 . . . . 64.54 111.061 178.29 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 64' ' ' VAL . . . . . 0.45 ' O ' HG13 ' A' ' 68' ' ' ILE . 55.6 t -64.49 -64.59 0.66 Allowed 'Isoleucine or valine' 0 N--CA 1.475 0.796 0 C-N-CA 123.337 0.655 . . . . 62.34 110.389 -178.921 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -63.48 -29.81 71.03 Favored 'General case' 0 N--CA 1.482 1.134 0 C-N-CA 123.053 0.541 . . . . 54.11 111.534 -177.149 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -60.24 -54.01 40.89 Favored Glycine 0 C--N 1.35 1.333 0 O-C-N 123.871 0.732 . . . . 74.21 111.378 174.71 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 67' ' ' TYR . . . . . 0.44 ' CE2' ' HG2' ' A' ' 12' ' ' GLN . 12.1 m-85 -66.44 -33.9 76.73 Favored 'General case' 0 N--CA 1.469 0.513 0 C-N-CA 122.999 0.52 . . . . 73.01 112.109 179.99 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 68' ' ' ILE . . . . . 0.521 ' O ' ' HG ' ' A' ' 72' ' ' LEU . 70.0 mt -59.97 -56.13 19.49 Favored 'Isoleucine or valine' 0 C--N 1.357 0.924 0 N-CA-C 108.982 -0.747 . . . . 71.24 108.982 175.958 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 54.7 tptt -54.42 -48.31 71.8 Favored 'General case' 0 N--CA 1.475 0.777 0 O-C-N 123.994 0.809 . . . . 62.35 110.927 -179.366 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 56.6 mt-30 -57.76 -46.41 84.58 Favored 'General case' 0 N--CA 1.474 0.767 0 O-C-N 124.021 0.825 . . . . 70.13 111.272 179.836 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 71' ' ' THR . . . . . 0.527 ' HB ' ' HA ' ' A' ' 15' ' ' ALA . 14.0 t -79.29 -18.96 51.63 Favored 'General case' 0 C--N 1.353 0.745 0 CA-C-O 118.981 -0.533 . . . . 64.51 111.233 -175.749 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 72' ' ' LEU . . . . . 0.521 ' HG ' ' O ' ' A' ' 68' ' ' ILE . 39.8 mt -70.67 -41.31 72.25 Favored 'General case' 0 N--CA 1.485 1.278 0 N-CA-C 109.627 -0.508 . . . . 64.51 109.627 171.918 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 6.2 m-20 -62.22 -50.17 72.83 Favored 'General case' 0 N--CA 1.474 0.762 0 O-C-N 123.676 0.61 . . . . 73.43 110.187 174.007 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 71.5 m-20 -59.47 -52.0 67.45 Favored 'General case' 0 N--CA 1.481 1.109 0 C-N-CA 122.975 0.51 . . . . 63.31 110.557 -178.712 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . 0.416 ' O ' ' HG2' ' A' ' 79' ' ' LYS . 40.1 tp10 -52.75 -56.21 17.28 Favored 'General case' 0 N--CA 1.485 1.286 0 C-N-CA 125.109 1.364 . . . . 74.5 111.455 178.547 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 10.0 tt0 -70.56 -42.14 71.52 Favored 'General case' 0 N--CA 1.473 0.724 0 C-N-CA 123.088 0.555 . . . . 73.41 111.51 -171.336 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 84.4 mt -62.11 -38.4 88.76 Favored 'General case' 0 N--CA 1.483 1.217 0 O-C-N 123.397 0.436 . . . . 44.4 110.677 178.207 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . 0.651 HD21 ' HA ' ' A' ' 22' ' ' LEU . 46.0 mt -63.35 -49.1 75.22 Favored 'General case' 0 N--CA 1.476 0.845 0 O-C-N 123.452 0.47 . . . . 54.32 111.396 174.525 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 79' ' ' LYS . . . . . 0.416 ' HG2' ' O ' ' A' ' 75' ' ' GLU . 46.6 mmtm -62.87 -34.03 76.52 Favored 'General case' 0 N--CA 1.485 1.291 0 C-N-CA 122.978 0.511 . . . . 74.54 111.635 -177.766 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -75.28 -35.78 47.23 Favored Glycine 0 C--N 1.346 1.113 0 CA-C-N 115.197 -0.911 . . . . 54.43 112.408 177.125 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 1.5 tt -67.28 -37.37 83.32 Favored 'General case' 0 N--CA 1.477 0.877 0 C-N-CA 123.786 0.834 . . . . 71.3 109.03 178.172 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 82' ' ' LEU . . . . . 0.483 ' HG ' ' O ' ' A' ' 78' ' ' LEU . 60.1 mt . . . . . 0 C--N 1.352 0.697 0 C-N-CA 123.768 0.827 . . . . 74.52 111.565 179.683 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 92' ' ' LEU . . . . . 0.591 HD22 ' HG2' ' A' ' 45' ' ' GLU . 43.7 mt . . . . . 0 N--CA 1.492 1.647 0 N-CA-C 112.629 0.603 . . . . 71.24 112.629 . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 49.4 mt -53.41 111.12 0.26 Allowed 'Isoleucine or valine' 0 CA--C 1.558 1.26 0 C-N-CA 123.892 0.877 . . . . 74.13 110.182 167.203 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -76.86 0.61 65.44 Favored Glycine 0 C--N 1.35 1.314 0 CA-C-N 115.82 -0.627 . . . . 71.43 114.114 -175.561 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 9.9 tt0 -69.69 -11.58 60.96 Favored 'General case' 0 N--CA 1.48 1.071 0 C-N-CA 123.858 0.863 . . . . 64.13 110.67 169.254 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 19.6 t 73.25 17.49 3.97 Favored 'General case' 0 C--N 1.358 0.973 0 C-N-CA 124.944 1.298 . . . . 71.41 111.453 176.856 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 13.5 t -86.57 16.7 4.41 Favored 'General case' 0 CA--C 1.553 1.067 0 C-N-CA 123.732 0.813 . . . . 45.53 111.571 -179.346 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 14.3 mtm-85 -65.59 -58.13 6.49 Favored 'General case' 0 N--CA 1.489 1.515 0 C-N-CA 123.839 0.855 . . . . 74.34 112.554 -167.441 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 44.8 tt0 -63.4 -37.81 88.73 Favored 'General case' 0 CA--C 1.542 0.65 0 CA-C-N 115.296 -0.865 . . . . 72.14 109.675 178.344 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 51.5 tttm -68.17 -26.45 65.75 Favored 'General case' 0 CA--C 1.546 0.816 0 CA-C-N 114.794 -1.094 . . . . 72.22 111.357 177.766 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 47.2 t -73.23 -48.39 35.4 Favored 'General case' 0 N--CA 1.471 0.608 0 C-N-CA 123.502 0.721 . . . . 32.42 109.159 -178.509 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 9.5 mp -69.3 -30.1 68.1 Favored 'General case' 0 N--CA 1.484 1.266 0 O-C-N 123.498 0.499 . . . . 51.14 111.418 176.225 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 20.9 t-20 -71.01 -50.33 35.37 Favored 'General case' 0 N--CA 1.478 0.964 0 CA-C-O 121.055 0.455 . . . . 71.31 110.499 179.642 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 10.8 m120 -71.09 -18.9 62.52 Favored 'General case' 0 N--CA 1.479 1.016 0 C-N-CA 123.072 0.549 . . . . 50.1 111.091 176.449 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -64.91 -47.43 77.77 Favored 'General case' 0 C--N 1.349 0.572 0 O-C-N 123.626 0.579 . . . . 75.03 109.795 169.18 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 106' ' ' TYR . . . . . . . . . . . . . 1.1 t80 -58.11 -45.02 87.97 Favored 'General case' 0 N--CA 1.482 1.161 0 N-CA-C 109.482 -0.562 . . . . 73.53 109.482 174.225 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -58.79 -44.85 95.62 Favored Glycine 0 C--N 1.35 1.361 0 CA-C-N 115.778 -0.646 . . . . 54.31 113.345 -179.777 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 31.4 ptt180 -81.7 -14.53 56.44 Favored 'General case' 0 N--CA 1.476 0.828 0 C-N-CA 122.746 0.418 . . . . 73.22 111.051 -179.979 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 109' ' ' LEU . . . . . 0.567 HD13 ' HB2' ' A' ' 114' ' ' LEU . 36.4 tp -70.83 -43.37 68.7 Favored 'General case' 0 N--CA 1.486 1.373 0 N-CA-C 109.218 -0.66 . . . . 73.45 109.218 171.012 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 19.1 m -71.83 -36.44 70.2 Favored 'General case' 0 CA--C 1.547 0.837 0 CA-C-N 114.984 -1.007 . . . . 70.41 110.376 177.762 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . -91.02 -61.61 1.26 Allowed Glycine 0 C--N 1.358 1.789 0 N-CA-C 114.585 0.594 . . . . 65.22 114.585 -177.568 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 112' ' ' MET . . . . . . . . . . . . . 12.5 tpt -91.83 -69.72 0.73 Allowed 'General case' 0 N--CA 1.488 1.431 0 N-CA-C 112.961 0.726 . . . . 42.4 112.961 -172.377 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 18.8 tp 170.75 21.92 0.0 OUTLIER 'General case' 0 N--CA 1.493 1.721 0 C-N-CA 124.54 1.136 . . . . 70.34 110.593 -178.543 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 114' ' ' LEU . . . . . 0.685 ' HB3' HG21 ' A' ' 52' ' ' THR . 39.0 tp . . . . . 0 N--CA 1.499 1.999 0 C-N-CA 124.788 1.235 . . . . 74.05 111.698 -175.922 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 25.3 ttt . . . . . 0 CA--C 1.558 1.257 0 N-CA-C 110.369 -0.234 . . . . 54.1 110.369 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 74.1 p -55.63 -56.48 19.85 Favored 'General case' 0 N--CA 1.489 1.523 0 C-N-CA 123.957 0.903 . . . . 42.31 112.546 -171.971 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 34.1 t -65.23 -30.63 71.54 Favored 'General case' 0 N--CA 1.478 0.94 0 C-N-CA 123.208 0.603 . . . . 61.14 111.474 -177.178 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 4' ' ' THR . . . . . 0.468 ' HA ' ' HG3' ' A' ' 53' ' ' PRO . 28.0 m -72.27 -43.03 64.88 Favored 'General case' 0 N--CA 1.471 0.624 0 C-N-CA 123.162 0.585 . . . . 70.31 111.214 179.078 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 76.6 t -63.59 -45.77 96.72 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.759 0 N-CA-C 109.2 -0.667 . . . . 62.14 109.2 179.29 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 24.1 mm-40 -56.66 -51.63 68.01 Favored 'General case' 0 N--CA 1.475 0.783 0 O-C-N 124.058 0.849 . . . . 74.51 110.627 174.226 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 34.0 t80 -58.11 -53.65 55.84 Favored 'General case' 0 N--CA 1.481 1.122 0 C-N-CA 124.195 0.998 . . . . 73.34 111.496 -173.577 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 8' ' ' ILE . . . . . 0.408 ' O ' ' HG3' ' A' ' 12' ' ' GLN . 72.1 mt -61.77 -45.32 98.94 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.967 0 C-N-CA 123.54 0.736 . . . . 61.15 110.151 178.776 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 26.2 t-20 -62.01 -32.86 73.38 Favored 'General case' 0 N--CA 1.488 1.436 0 C-N-CA 123.894 0.878 . . . . 74.24 111.954 -177.897 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . 0.412 ' O ' HG13 ' A' ' 14' ' ' ILE . 96.6 mtt180 -78.13 -34.75 49.75 Favored 'General case' 0 C--O 1.214 -0.773 0 CA-C-N 115.954 -0.566 . . . . 74.31 110.042 178.694 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 11' ' ' TRP . . . . . . . . . . . . . 53.0 m95 -67.28 -33.76 75.98 Favored 'General case' 0 N--CA 1.482 1.163 0 O-C-N 122.916 0.135 . . . . 74.22 111.131 172.037 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . 0.444 ' HG2' ' CE2' ' A' ' 67' ' ' TYR . 51.4 mt-30 -61.42 -48.41 81.31 Favored 'General case' 0 C--O 1.218 -0.562 0 N-CA-C 108.327 -0.99 . . . . 73.41 108.327 171.939 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 79.2 ttt180 -62.56 -48.59 78.83 Favored 'General case' 0 C--O 1.216 -0.687 0 O-C-N 124.638 1.211 . . . . 74.33 111.373 -175.799 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 14' ' ' ILE . . . . . 0.412 HG13 ' O ' ' A' ' 10' ' ' ARG . 90.9 mt -62.44 -43.12 97.93 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.002 0 C-N-CA 123.615 0.766 . . . . 61.41 109.69 -179.312 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . 0.619 ' HA ' ' HB ' ' A' ' 71' ' ' THR . . . -60.79 -44.3 97.0 Favored 'General case' 0 N--CA 1.482 1.139 0 C-N-CA 123.373 0.669 . . . . 73.32 111.799 176.645 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 87.8 mt -74.76 -35.58 62.58 Favored 'General case' 0 N--CA 1.485 1.301 0 CA-C-N 115.143 -0.935 . . . . 73.4 111.038 -175.027 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.508 ' O ' ' HG ' ' A' ' 21' ' ' LEU . 72.4 mt -72.05 -47.31 52.57 Favored 'General case' 0 N--CA 1.475 0.798 0 C-N-CA 122.912 0.485 . . . . 74.21 109.742 -177.721 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 79.3 p -65.1 -36.0 82.9 Favored 'General case' 0 N--CA 1.48 1.048 0 C-N-CA 123.04 0.536 . . . . 72.31 111.091 176.951 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 6.4 tp-100 -61.88 -45.57 93.16 Favored 'General case' 0 N--CA 1.475 0.79 0 C-N-CA 123.391 0.676 . . . . 74.12 110.189 174.971 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . 0.404 ' O ' ' HG ' ' A' ' 24' ' ' LEU . 66.5 m -58.79 -52.93 63.63 Favored 'General case' 0 C--O 1.202 -1.442 0 CA-C-N 114.929 -1.032 . . . . 75.24 109.584 174.7 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . 0.643 HD22 ' HA ' ' A' ' 33' ' ' LEU . 52.6 mt -62.22 -27.69 69.16 Favored 'General case' 0 N--CA 1.473 0.699 0 C-N-CA 123.676 0.79 . . . . 74.43 111.323 -175.963 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.673 ' HA ' HD21 ' A' ' 78' ' ' LEU . 56.8 tp -70.51 -54.09 13.59 Favored 'General case' 0 N--CA 1.472 0.651 0 C-N-CA 122.953 0.501 . . . . 74.12 109.894 176.691 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . 0.441 ' O ' ' HG3' ' A' ' 27' ' ' ARG . 44.6 mt-10 -59.12 -52.74 64.43 Favored 'General case' 0 CA--C 1.545 0.776 0 O-C-N 123.929 0.768 . . . . 74.44 110.246 179.506 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . 0.461 ' HB3' ' HB2' ' A' ' 29' ' ' GLU . 92.2 mt -53.56 -42.56 67.65 Favored 'General case' 0 N--CA 1.479 1.007 0 C-N-CA 125.441 1.496 . . . . 75.11 112.174 176.578 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . 0.512 ' HB2' HD21 ' A' ' 33' ' ' LEU . . . -58.28 -47.68 82.87 Favored 'General case' 0 N--CA 1.484 1.237 0 C-N-CA 122.944 0.498 . . . . 74.02 110.901 176.918 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 90.8 mt-30 -66.59 -30.34 70.61 Favored 'General case' 0 CA--C 1.555 1.157 0 CA-C-N 114.99 -1.005 . . . . 73.33 111.141 178.721 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 27' ' ' ARG . . . . . 0.441 ' HG3' ' O ' ' A' ' 23' ' ' GLU . 94.9 mtt180 -78.38 -17.81 55.94 Favored 'General case' 0 N--CA 1.483 1.202 0 C-N-CA 123.857 0.863 . . . . 75.45 111.326 178.253 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 92.43 9.27 61.83 Favored Glycine 0 N--CA 1.475 1.283 0 C-N-CA 122.922 0.296 . . . . 51.13 113.564 -178.231 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 29' ' ' GLU . . . . . 0.461 ' HB2' ' HB3' ' A' ' 24' ' ' LEU . 5.4 mm-40 -82.58 53.72 2.42 Favored 'General case' 0 CA--C 1.55 0.973 0 C-N-CA 124.387 1.075 . . . . 72.21 111.014 178.09 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 30' ' ' TRP . . . . . . . . . . . . . 86.4 m95 -63.56 -28.89 70.25 Favored 'General case' 0 N--CA 1.483 1.187 0 C-N-CA 123.902 0.881 . . . . 73.11 111.717 -176.404 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 31' ' ' ASP . . . . . 0.485 ' O ' ' HG3' ' A' ' 35' ' ' GLN . 3.4 m-20 -53.23 -46.37 69.1 Favored 'General case' 0 N--CA 1.475 0.823 0 C-N-CA 123.603 0.761 . . . . 53.42 110.548 174.789 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 0.438 HD12 HD22 ' A' ' 24' ' ' LEU . 64.9 mt -67.14 -28.25 67.98 Favored 'General case' 0 CA--C 1.549 0.94 0 CA-C-N 115.501 -0.772 . . . . 74.22 111.34 -176.527 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . 0.643 ' HA ' HD22 ' A' ' 21' ' ' LEU . 9.6 mp -68.61 -43.81 75.6 Favored 'General case' 0 N--CA 1.486 1.36 0 C-N-CA 123.122 0.569 . . . . 72.42 110.116 173.365 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 79.3 mt -64.36 -36.97 85.86 Favored 'General case' 0 CA--C 1.551 0.986 0 CA-C-N 115.324 -0.853 . . . . 73.02 111.348 178.844 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 35' ' ' GLN . . . . . 0.485 ' HG3' ' O ' ' A' ' 31' ' ' ASP . 90.4 mt-30 -69.74 -51.55 33.23 Favored 'General case' 0 N--CA 1.481 1.119 0 C-N-CA 123.292 0.637 . . . . 72.12 110.312 177.608 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 36' ' ' GLN . . . . . 0.443 ' HB2' HD21 ' A' ' 21' ' ' LEU . 77.2 mm-40 -70.87 -14.25 62.33 Favored 'General case' 0 N--CA 1.477 0.888 0 CA-C-N 115.248 -0.887 . . . . 73.42 112.993 -177.73 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 38.3 tt0 -45.31 -51.38 11.07 Favored 'General case' 0 N--CA 1.487 1.377 0 CA-C-N 118.287 0.494 . . . . 73.12 111.373 174.241 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 81.4 t -61.12 -54.57 33.52 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.793 0 O-C-N 123.877 0.736 . . . . 72.51 110.74 -179.027 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 21.9 m -65.51 -52.09 55.21 Favored 'General case' 0 CA--C 1.551 1.006 0 C-N-CA 123.525 0.73 . . . . 71.44 112.507 -173.441 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 44.4 t80 -60.58 -51.53 69.01 Favored 'General case' 0 N--CA 1.478 0.951 0 C-N-CA 124.792 1.237 . . . . 71.34 111.904 -179.077 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . 0.54 ' HA ' HG22 ' A' ' 44' ' ' ILE . 64.4 mt -77.81 -23.35 49.1 Favored 'General case' 0 CA--C 1.546 0.793 0 CA-C-N 116.317 -0.401 . . . . 75.32 111.604 -174.688 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 51.8 tt0 -66.54 -44.49 82.24 Favored 'General case' 0 N--CA 1.484 1.255 0 N-CA-C 109.435 -0.579 . . . . 65.45 109.435 168.7 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 43' ' ' SER . . . . . 0.432 ' O ' HG23 ' A' ' 47' ' ' VAL . 74.3 m -60.79 -43.51 98.0 Favored 'General case' 0 N--CA 1.476 0.859 0 C-N-CA 123.251 0.62 . . . . 71.33 111.582 179.465 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 44' ' ' ILE . . . . . 0.54 HG22 ' HA ' ' A' ' 41' ' ' LEU . 12.5 tt -69.02 -40.45 80.86 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.972 0 O-C-N 123.121 0.263 . . . . 54.44 110.464 -178.145 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 14.3 mm-40 -58.81 -42.51 89.34 Favored 'General case' 0 N--CA 1.484 1.251 0 C-N-CA 122.895 0.478 . . . . 62.05 110.767 172.747 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 99.4 m -62.0 -43.37 98.97 Favored 'General case' 0 N--CA 1.48 1.059 0 C-N-CA 123.919 0.888 . . . . 51.53 111.578 -179.437 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 47' ' ' VAL . . . . . 0.432 HG23 ' O ' ' A' ' 43' ' ' SER . 58.0 t -67.95 -41.89 85.07 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.012 0 C-N-CA 122.269 0.228 . . . . 63.03 110.938 178.889 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 48' ' ' MET . . . . . . . . . . . . . 78.4 mtm -68.91 -34.45 75.41 Favored 'General case' 0 N--CA 1.484 1.244 0 N-CA-C 112.479 0.548 . . . . 42.54 112.479 -177.468 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 13.1 pt-20 -82.33 -24.22 34.7 Favored 'General case' 0 N--CA 1.487 1.407 0 C-N-CA 122.355 0.262 . . . . 72.21 111.359 179.574 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 13.4 mptt -83.72 143.66 29.87 Favored 'General case' 0 N--CA 1.479 1.021 0 C-N-CA 122.914 0.486 . . . . 75.51 110.228 177.808 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 51.1 tt0 -74.55 137.48 42.44 Favored 'General case' 0 CA--C 1.542 0.645 0 CA-C-N 114.975 -1.011 . . . . 72.32 110.581 -178.869 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 17.4 m -62.95 132.76 95.09 Favored Pre-proline 0 CA--C 1.561 1.397 0 O-C-N 123.799 0.687 . . . . 62.24 110.381 175.637 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 53' ' ' PRO . . . . . 0.468 ' HG3' ' HA ' ' A' ' 4' ' ' THR . 61.0 Cg_endo -70.05 156.26 63.0 Favored 'Trans proline' 0 C--N 1.377 2.072 0 C-N-CA 122.645 2.23 . . . . 63.11 112.424 177.376 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 35.6 Cg_endo -64.5 -47.57 5.51 Favored 'Trans proline' 0 C--N 1.374 1.891 0 C-N-CA 122.803 2.335 . . . . 71.22 113.284 175.61 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . -67.14 83.34 0.12 Allowed Glycine 0 C--N 1.347 1.154 0 O-C-N 123.866 0.729 . . . . 71.32 113.613 -174.115 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 60.5 mt -124.86 103.02 11.71 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.455 0 C-N-CA 124.203 1.001 . . . . 72.34 108.455 175.164 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 57' ' ' THR . . . . . 0.423 ' H ' HD12 ' A' ' 60' ' ' ILE . 81.9 p -83.67 -178.9 7.17 Favored 'General case' 0 N--CA 1.473 0.712 0 N-CA-C 109.244 -0.65 . . . . 62.34 109.244 170.547 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 27.1 tpt180 -69.04 -35.53 76.69 Favored 'General case' 0 N--CA 1.472 0.626 0 N-CA-C 110.016 -0.364 . . . . 74.31 110.016 177.261 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 35.9 m -60.49 -47.9 84.1 Favored 'General case' 0 CA--C 1.546 0.799 0 C-N-CA 123.212 0.605 . . . . 71.34 110.716 176.508 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 60' ' ' ILE . . . . . 0.423 HD12 ' H ' ' A' ' 57' ' ' THR . 86.1 mt -61.75 -42.73 95.52 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.814 0 CA-C-N 115.097 -0.956 . . . . 74.31 110.405 176.347 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 64.5 tt0 -65.26 -36.3 83.7 Favored 'General case' 0 N--CA 1.476 0.864 0 C-N-CA 123.754 0.822 . . . . 52.15 111.597 -178.129 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 37.2 m-20 -75.68 -38.1 59.01 Favored 'General case' 0 N--CA 1.481 1.079 0 C-N-CA 122.831 0.452 . . . . 62.24 111.786 179.924 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 63' ' ' MET . . . . . . . . . . . . . 72.3 mtm -66.8 -51.55 54.43 Favored 'General case' 0 N--CA 1.482 1.125 0 C-N-CA 122.4 0.28 . . . . 75.45 110.446 176.649 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 64' ' ' VAL . . . . . 0.488 ' O ' HG13 ' A' ' 68' ' ' ILE . 55.5 t -59.58 -58.97 4.7 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.765 0 C-N-CA 123.524 0.73 . . . . 73.35 110.768 179.128 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . 0.485 ' HB2' HD23 ' A' ' 109' ' ' LEU . . . -62.26 -35.94 80.53 Favored 'General case' 0 N--CA 1.488 1.475 0 C-N-CA 122.567 0.347 . . . . 51.14 111.876 -178.405 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -59.27 -41.68 96.93 Favored Glycine 0 C--N 1.347 1.172 0 N-CA-C 111.776 -0.529 . . . . 72.42 111.776 175.138 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 67' ' ' TYR . . . . . 0.444 ' CE2' ' HG2' ' A' ' 12' ' ' GLN . 10.7 m-30 -78.86 -29.81 44.75 Favored 'General case' 0 N--CA 1.467 0.422 0 N-CA-C 113.198 0.814 . . . . 74.42 113.198 -179.902 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 68' ' ' ILE . . . . . 0.488 HG13 ' O ' ' A' ' 64' ' ' VAL . 59.4 mt -64.85 -51.64 64.35 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.095 0 N-CA-C 108.414 -0.958 . . . . 74.11 108.414 174.702 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 20.2 tptm -55.21 -45.17 75.89 Favored 'General case' 0 N--CA 1.474 0.767 0 O-C-N 123.913 0.758 . . . . 73.21 110.57 175.119 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 55.4 tt0 -61.38 -45.39 94.55 Favored 'General case' 0 C--N 1.352 0.717 0 O-C-N 123.818 0.699 . . . . 75.35 110.848 -176.3 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 71' ' ' THR . . . . . 0.619 ' HB ' ' HA ' ' A' ' 15' ' ' ALA . 11.1 t -78.3 -28.1 47.4 Favored 'General case' 0 C--N 1.353 0.752 0 O-C-N 122.999 0.187 . . . . 75.54 110.999 -173.864 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 72' ' ' LEU . . . . . 0.433 ' O ' ' HB2' ' A' ' 76' ' ' GLN . 36.0 mt -73.64 -29.54 62.4 Favored 'General case' 0 N--CA 1.474 0.748 0 O-C-N 123.407 0.442 . . . . 74.41 110.658 174.966 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 33.3 t70 -77.22 -43.49 33.4 Favored 'General case' 0 N--CA 1.48 1.055 0 O-C-N 123.907 0.754 . . . . 75.32 110.678 178.927 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 74' ' ' ASN . . . . . 0.431 ' HA ' HD22 ' A' ' 22' ' ' LEU . 82.7 m-20 -59.66 -49.57 77.25 Favored 'General case' 0 N--CA 1.472 0.638 0 CA-C-N 115.613 -0.721 . . . . 65.5 109.676 176.499 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . 0.43 ' HA ' ' HB2' ' A' ' 78' ' ' LEU . 25.5 tt0 -74.7 -23.1 58.55 Favored 'General case' 0 CA--C 1.552 1.027 0 CA-C-N 115.082 -0.963 . . . . 64.42 111.494 179.609 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 76' ' ' GLN . . . . . 0.433 ' HB2' ' O ' ' A' ' 72' ' ' LEU . 8.9 tt0 -58.88 -48.31 81.84 Favored 'General case' 0 N--CA 1.488 1.426 0 N-CA-C 109.085 -0.709 . . . . 72.42 109.085 172.283 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 82.6 mt -67.56 -43.72 79.97 Favored 'General case' 0 CA--C 1.548 0.869 0 CA-C-N 115.169 -0.923 . . . . 72.22 111.183 177.451 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . 0.673 HD21 ' HA ' ' A' ' 22' ' ' LEU . 61.1 mt -62.18 -58.75 6.61 Favored 'General case' 0 N--CA 1.486 1.343 0 C-N-CA 123.35 0.66 . . . . 74.32 112.474 -178.421 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 46.3 mmtm -64.49 -34.47 78.29 Favored 'General case' 0 CA--C 1.553 1.08 0 C-N-CA 123.159 0.584 . . . . 72.24 110.611 176.794 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -62.5 -28.3 71.01 Favored Glycine 0 C--N 1.346 1.137 0 CA-C-N 116.695 -0.23 . . . . 72.2 112.928 175.396 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 8.6 tt -86.16 -47.13 9.76 Favored 'General case' 0 CA--C 1.545 0.769 0 C-N-CA 123.871 0.868 . . . . 72.45 109.728 175.281 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 50.4 mt . . . . . 0 N--CA 1.478 0.938 0 C-N-CA 123.682 0.793 . . . . 53.4 110.667 -166.415 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 97.7 mt . . . . . 0 N--CA 1.491 1.576 0 N-CA-C 110.863 -0.051 . . . . 71.22 110.863 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 60.4 mt -59.04 -71.61 0.1 Allowed 'Isoleucine or valine' 0 N--CA 1.482 1.146 0 C-N-CA 124.023 0.929 . . . . 75.41 111.768 -178.608 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -139.53 -123.26 2.05 Favored Glycine 0 C--N 1.346 1.135 0 N-CA-C 112.099 -0.401 . . . . 44.01 112.099 -173.949 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -88.46 148.2 24.29 Favored 'General case' 0 N--CA 1.477 0.91 0 C-N-CA 122.896 0.478 . . . . 73.33 109.881 176.099 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 70.2 p 52.26 -79.88 0.01 OUTLIER 'General case' 0 CA--C 1.559 1.289 0 C-N-CA 125.79 1.636 . . . . 63.13 111.972 -175.705 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 28.1 m 66.74 -80.35 0.03 OUTLIER 'General case' 0 CA--C 1.555 1.145 0 C-N-CA 125.188 1.395 . . . . 54.1 111.905 175.779 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 98' ' ' ARG . . . . . 0.47 ' HB2' HD13 ' A' ' 44' ' ' ILE . 0.0 OUTLIER -62.64 -43.9 97.64 Favored 'General case' 0 N--CA 1.488 1.446 0 N-CA-C 112.581 0.586 . . . . 71.13 112.581 -170.243 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 3.8 pt20 -70.5 -40.06 73.78 Favored 'General case' 0 N--CA 1.477 0.885 0 C-N-CA 122.61 0.364 . . . . 74.32 110.331 -174.768 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 23.6 tptm -66.9 -46.12 75.85 Favored 'General case' 0 CA--C 1.55 0.96 0 C-N-CA 124.144 0.978 . . . . 73.04 110.579 -179.498 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 31.4 t -72.68 -39.56 66.97 Favored 'General case' 0 N--CA 1.476 0.835 0 CA-C-N 115.155 -0.93 . . . . 70.45 111.546 -174.437 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 11.2 mp -78.39 -29.69 47.41 Favored 'General case' 0 N--CA 1.485 1.281 0 C-N-CA 122.684 0.394 . . . . 73.13 111.54 -179.838 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 50.1 t-20 -64.97 -45.85 83.96 Favored 'General case' 0 N--CA 1.482 1.13 0 N-CA-C 108.563 -0.903 . . . . 65.31 108.563 172.239 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 104' ' ' ASN . . . . . 0.404 ' O ' ' HD3' ' A' ' 108' ' ' ARG . 40.3 t-20 -59.71 -47.0 87.39 Favored 'General case' 0 N--CA 1.478 0.945 0 CA-C-N 115.269 -0.878 . . . . 71.34 109.557 176.017 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -63.87 -33.63 76.13 Favored 'General case' 0 CA--C 1.538 0.503 0 CA-C-N 115.112 -0.949 . . . . 73.53 111.627 -178.488 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 106' ' ' TYR . . . . . . . . . . . . . 3.9 t80 -70.54 -54.23 12.98 Favored 'General case' 0 N--CA 1.476 0.838 0 C-N-CA 122.897 0.479 . . . . 74.31 110.071 -179.063 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -62.64 -32.03 82.02 Favored Glycine 0 C--N 1.345 1.064 0 CA-C-N 115.512 -0.767 . . . . 74.43 112.573 -178.781 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 108' ' ' ARG . . . . . 0.404 ' HD3' ' O ' ' A' ' 104' ' ' ASN . 9.7 mpt_? -83.28 -21.5 33.27 Favored 'General case' 0 C--O 1.217 -0.641 0 C-N-CA 122.935 0.494 . . . . 74.24 110.62 176.463 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 109' ' ' LEU . . . . . 0.525 HD13 ' HB2' ' A' ' 114' ' ' LEU . 43.9 tp -68.79 -31.18 70.0 Favored 'General case' 0 N--CA 1.494 1.728 0 CA-C-N 118.841 0.746 . . . . 55.03 109.603 170.633 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 25.7 t -72.81 -46.57 52.44 Favored 'General case' 0 CA--C 1.551 1.002 0 CA-C-N 115.382 -0.826 . . . . 60.5 110.205 170.592 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . -89.97 -63.0 1.27 Allowed Glycine 0 C--N 1.358 1.793 0 N-CA-C 115.67 1.028 . . . . 45.2 115.67 -172.201 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 112' ' ' MET . . . . . . . . . . . . . 54.8 mmm -92.67 -69.51 0.74 Allowed 'General case' 0 N--CA 1.49 1.542 0 CA-C-N 118.277 1.038 . . . . 72.12 113.683 -175.472 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 15.2 tp 173.27 28.76 0.0 OUTLIER 'General case' 0 N--CA 1.492 1.629 0 C-N-CA 123.34 0.656 . . . . 62.42 109.673 -169.769 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 114' ' ' LEU . . . . . 0.525 ' HB2' HD13 ' A' ' 109' ' ' LEU . 6.3 tt . . . . . 0 N--CA 1.501 2.115 0 C-N-CA 125.454 1.502 . . . . 73.31 111.267 -172.394 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 1' ' ' MET . . . . . 0.49 ' SD ' ' HB ' ' A' ' 4' ' ' THR . 13.7 tpt . . . . . 0 N--CA 1.482 1.138 0 CA-C-O 119.272 -0.394 . . . . 65.11 111.217 . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 62.5 m -53.94 -47.4 71.29 Favored 'General case' 0 N--CA 1.489 1.498 0 C-N-CA 124.205 1.002 . . . . 71.25 112.572 -175.388 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 46.9 t -62.69 -38.25 89.68 Favored 'General case' 0 N--CA 1.481 1.124 0 C-N-CA 123.025 0.53 . . . . 50.32 110.656 177.347 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 4' ' ' THR . . . . . 0.49 ' HB ' ' SD ' ' A' ' 1' ' ' MET . 11.9 m -69.35 -33.39 73.02 Favored 'General case' 0 CA--C 1.547 0.853 0 C-N-CA 123.508 0.723 . . . . 73.41 111.059 179.552 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 62.9 t -64.58 -48.56 84.39 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.175 0 C-N-CA 123.504 0.722 . . . . 70.13 109.837 177.376 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 26.7 mm-40 -62.29 -41.03 98.16 Favored 'General case' 0 N--CA 1.477 0.923 0 O-C-N 123.904 0.752 . . . . 74.0 110.896 175.753 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 65.2 t80 -60.99 -46.4 90.9 Favored 'General case' 0 CA--C 1.547 0.855 0 C-N-CA 124.487 1.115 . . . . 63.11 110.937 -176.608 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 8' ' ' ILE . . . . . 0.429 HG13 ' O ' ' A' ' 4' ' ' THR . 85.0 mt -62.14 -52.62 58.09 Favored 'Isoleucine or valine' 0 C--N 1.356 0.882 0 O-C-N 123.778 0.674 . . . . 74.31 109.559 175.906 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 28.4 t-20 -58.67 -34.29 71.08 Favored 'General case' 0 N--CA 1.481 1.118 0 O-C-N 124.177 0.923 . . . . 65.21 111.781 -174.762 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 99.2 mtt180 -78.19 -37.07 46.48 Favored 'General case' 0 N--CA 1.471 0.616 0 C-N-CA 123.039 0.535 . . . . 72.44 111.021 -179.8 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 11' ' ' TRP . . . . . . . . . . . . . 51.3 m95 -71.59 -25.8 62.33 Favored 'General case' 0 N--CA 1.484 1.226 0 N-CA-C 111.549 0.203 . . . . 74.35 111.549 172.518 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . 0.506 ' HG2' ' CE2' ' A' ' 67' ' ' TYR . 53.0 mt-30 -67.25 -44.81 78.49 Favored 'General case' 0 C--O 1.208 -1.101 0 N-CA-C 108.163 -1.051 . . . . 73.45 108.163 170.399 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 15.0 tpt180 -60.48 -44.17 96.19 Favored 'General case' 0 CA--C 1.545 0.762 0 O-C-N 124.152 0.908 . . . . 71.33 110.816 -177.042 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 14' ' ' ILE . . . . . 0.431 HD11 HG21 ' A' ' 47' ' ' VAL . 58.3 mt -68.32 -45.84 81.89 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.997 0 C-N-CA 122.601 0.36 . . . . 74.3 110.035 177.916 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . 0.579 ' HA ' ' HB ' ' A' ' 71' ' ' THR . . . -56.87 -49.0 76.81 Favored 'General case' 0 N--CA 1.484 1.251 0 C-N-CA 123.76 0.824 . . . . 64.02 111.551 -179.976 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 96.8 mt -73.33 -43.71 60.3 Favored 'General case' 0 N--CA 1.475 0.802 0 CA-C-N 114.422 -1.263 . . . . 71.45 110.675 -173.154 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.493 ' O ' ' HG ' ' A' ' 21' ' ' LEU . 40.7 mt -61.05 -53.53 56.03 Favored 'General case' 0 N--CA 1.481 1.077 0 O-C-N 123.606 0.566 . . . . 74.11 110.566 178.68 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 87.2 p -65.69 -33.55 76.14 Favored 'General case' 0 N--CA 1.478 0.953 0 O-C-N 123.682 0.614 . . . . 45.2 111.231 -176.04 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 6.7 tp-100 -69.11 -37.32 78.32 Favored 'General case' 0 N--CA 1.479 0.975 0 C-N-CA 122.845 0.458 . . . . 53.24 110.836 175.601 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 68.9 m -70.05 -33.24 71.7 Favored 'General case' 0 CA--C 1.539 0.542 0 CA-C-N 115.826 -0.624 . . . . 63.03 110.66 174.423 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . 0.622 HD22 ' HA ' ' A' ' 33' ' ' LEU . 50.5 mt -73.91 -29.2 61.93 Favored 'General case' 0 N--CA 1.474 0.755 0 C-N-CA 123.146 0.578 . . . . 65.14 110.044 178.294 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.709 ' HA ' HD21 ' A' ' 78' ' ' LEU . 50.3 tp -67.29 -48.46 67.58 Favored 'General case' 0 N--CA 1.47 0.545 0 C-N-CA 123.366 0.666 . . . . 71.41 109.357 174.425 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 38.3 mm-40 -51.06 -59.4 4.21 Favored 'General case' 0 N--CA 1.47 0.555 0 C-N-CA 124.169 0.988 . . . . 74.21 111.374 173.263 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 93.6 mt -59.09 -46.54 88.02 Favored 'General case' 0 CA--C 1.539 0.548 0 O-C-N 124.233 0.958 . . . . 55.4 111.358 -175.585 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . 0.525 ' HB2' HD21 ' A' ' 33' ' ' LEU . . . -60.06 -45.24 93.53 Favored 'General case' 0 N--CA 1.48 1.038 0 C-N-CA 123.413 0.685 . . . . 73.12 112.047 -177.915 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 97.1 mt-30 -67.04 -32.03 72.96 Favored 'General case' 0 N--CA 1.483 1.2 0 C-N-CA 123.169 0.587 . . . . 73.1 111.269 178.15 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 92.5 mtt-85 -83.97 -2.2 56.13 Favored 'General case' 0 N--CA 1.479 1.005 0 C-N-CA 123.591 0.757 . . . . 72.51 111.239 176.716 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 92.7 2.33 67.34 Favored Glycine 0 C--N 1.356 1.679 0 C-N-CA 123.37 0.509 . . . . 71.02 114.2 171.256 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 58.9 mm-40 -83.66 70.01 10.24 Favored 'General case' 0 CA--C 1.548 0.896 0 C-N-CA 124.123 0.969 . . . . 75.35 111.563 -179.827 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 30' ' ' TRP . . . . . . . . . . . . . 65.3 m95 -69.93 -39.31 76.19 Favored 'General case' 0 N--CA 1.482 1.173 0 C-N-CA 123.983 0.913 . . . . 72.33 111.628 -176.626 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 18.2 m-20 -62.06 -31.9 72.36 Favored 'General case' 0 N--CA 1.477 0.901 0 CA-C-N 115.517 -0.765 . . . . 74.53 111.001 -177.616 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 62.1 mt -70.69 -28.03 64.46 Favored 'General case' 0 CA--C 1.542 0.663 0 C-N-CA 122.569 0.347 . . . . 64.13 111.021 178.677 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . 0.622 ' HA ' HD22 ' A' ' 21' ' ' LEU . 10.1 mp -66.9 -47.55 71.43 Favored 'General case' 0 N--CA 1.493 1.69 0 C-N-CA 122.799 0.439 . . . . 70.55 109.913 169.724 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 80.2 mt -61.74 -33.62 74.37 Favored 'General case' 0 N--CA 1.481 1.118 0 O-C-N 124.282 0.989 . . . . 55.22 111.677 -178.777 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 35' ' ' GLN . . . . . 0.492 HE21 ' N ' ' A' ' 35' ' ' GLN . 0.0 OUTLIER -70.8 -55.9 7.54 Favored 'General case' 0 N--CA 1.477 0.905 0 C-N-CA 123.716 0.806 . . . . 62.43 109.58 175.396 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 36' ' ' GLN . . . . . 0.435 ' HB2' HD21 ' A' ' 21' ' ' LEU . 89.6 mm-40 -66.03 -12.69 56.99 Favored 'General case' 0 N--CA 1.482 1.128 0 O-C-N 123.84 0.713 . . . . 61.23 112.742 -176.873 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . 0.542 ' O ' ' HG ' ' A' ' 41' ' ' LEU . 43.3 tt0 -47.87 -40.41 21.47 Favored 'General case' 0 C--O 1.211 -0.95 0 C-N-CA 123.941 0.896 . . . . 73.12 111.656 172.87 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 43.1 t -58.22 -48.89 83.53 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.521 0 C-N-CA 123.052 0.541 . . . . 64.42 110.935 178.838 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 23.3 m -66.24 -38.96 89.15 Favored 'General case' 0 N--CA 1.475 0.786 0 CA-C-N 115.139 -0.937 . . . . 62.45 111.167 178.558 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 36.3 t80 -57.28 -52.05 66.9 Favored 'General case' 0 C--N 1.352 0.69 0 C-N-CA 124.887 1.275 . . . . 72.1 109.164 178.749 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . 0.542 ' HG ' ' O ' ' A' ' 37' ' ' GLU . 17.2 mt -59.38 -58.29 9.26 Favored 'General case' 0 C--N 1.363 1.193 0 O-C-N 124.702 1.251 . . . . 73.31 109.629 -178.601 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 48.1 tt0 -52.21 -49.61 63.58 Favored 'General case' 0 N--CA 1.476 0.828 0 O-C-N 123.994 0.809 . . . . 70.52 111.758 -174.094 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 36.9 m -64.85 -54.36 32.23 Favored 'General case' 0 CA--C 1.549 0.917 0 CA-C-N 115.991 -0.55 . . . . 73.01 111.859 -177.584 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 44' ' ' ILE . . . . . 0.554 HD11 HD11 ' A' ' 102' ' ' LEU . 14.1 tt -65.42 -36.23 77.2 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.105 0 C-N-CA 123.162 0.585 . . . . 64.31 111.238 -173.328 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 12.5 mm-40 -64.57 -47.36 79.02 Favored 'General case' 0 C--N 1.348 0.508 0 C-N-CA 123.773 0.829 . . . . 73.22 110.058 174.898 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 87.1 m -62.87 -26.1 68.61 Favored 'General case' 0 N--CA 1.477 0.902 0 O-C-N 123.443 0.464 . . . . 64.34 111.593 -179.314 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 47' ' ' VAL . . . . . 0.431 HG21 HD11 ' A' ' 14' ' ' ILE . 63.0 t -73.64 -54.05 16.29 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.008 0 O-C-N 122.173 -0.329 . . . . 72.5 110.906 172.831 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 48' ' ' MET . . . . . . . . . . . . . 70.4 mtm -72.22 -24.17 61.35 Favored 'General case' 0 N--CA 1.487 1.389 0 C-N-CA 123.104 0.562 . . . . 70.13 112.215 -171.324 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 32.7 mm-40 -82.34 -24.5 34.52 Favored 'General case' 0 N--CA 1.48 1.043 0 C-N-CA 123.96 0.904 . . . . 63.11 111.329 176.607 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 13.7 mptt -97.22 165.27 12.12 Favored 'General case' 0 N--CA 1.479 1.004 0 CA-C-O 121.802 0.81 . . . . 63.01 111.393 -175.663 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 8.5 tt0 -90.76 133.34 35.25 Favored 'General case' 0 C--O 1.24 0.594 0 CA-C-N 113.968 -1.469 . . . . 72.35 110.529 -172.81 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 89.9 m -78.26 127.94 79.67 Favored Pre-proline 0 CA--C 1.553 1.07 0 N-CA-C 108.755 -0.831 . . . . 63.11 108.755 169.754 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 57.0 Cg_endo -68.49 156.8 64.34 Favored 'Trans proline' 0 CA--C 1.562 1.901 0 C-N-CA 122.907 2.405 . . . . 65.31 112.574 176.996 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 7.6 Cg_exo -74.43 -50.06 0.16 Allowed 'Trans proline' 0 C--N 1.374 1.902 0 C-N-CA 122.798 2.332 . . . . 64.23 112.153 173.607 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . -80.86 72.64 2.68 Favored Glycine 0 C--N 1.349 1.274 0 CA-C-N 115.447 -0.797 . . . . 75.21 112.389 -177.141 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 70.0 mt -83.66 -85.01 0.08 OUTLIER 'Isoleucine or valine' 0 CA--C 1.559 1.291 0 N-CA-C 108.574 -0.898 . . . . 72.24 108.574 178.507 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 36.8 p 138.18 163.32 0.0 OUTLIER 'General case' 0 N--CA 1.495 1.794 0 C-N-CA 131.201 3.8 . . . . 73.51 107.165 167.342 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 46.0 tpt85 -60.28 -52.28 65.97 Favored 'General case' 0 CA--C 1.549 0.934 0 C-N-CA 123.82 0.848 . . . . 53.41 111.996 -174.084 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 43.4 m -63.95 -36.61 84.52 Favored 'General case' 0 N--CA 1.476 0.85 0 C-N-CA 123.426 0.691 . . . . 41.14 112.07 -178.646 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 78.1 mt -71.15 -35.17 57.48 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.645 0 CA-C-N 116.339 -0.392 . . . . 74.42 110.06 178.038 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 57.7 tt0 -60.88 -38.77 86.78 Favored 'General case' 0 CA--C 1.543 0.693 0 C-N-CA 123.123 0.569 . . . . 73.35 109.899 175.05 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 44.4 m-20 -65.35 -42.69 92.56 Favored 'General case' 0 N--CA 1.479 0.987 0 CA-C-N 115.909 -0.587 . . . . 73.43 112.045 175.088 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 63' ' ' MET . . . . . . . . . . . . . 71.3 mtm -68.18 -49.36 61.4 Favored 'General case' 0 N--CA 1.484 1.259 0 C-N-CA 122.566 0.346 . . . . 53.42 111.6 -178.933 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 64' ' ' VAL . . . . . 0.455 ' O ' HG13 ' A' ' 68' ' ' ILE . 70.8 t -60.14 -56.91 14.37 Favored 'Isoleucine or valine' 0 C--N 1.35 0.607 0 C-N-CA 123.879 0.872 . . . . 60.54 110.675 177.518 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -62.38 -28.2 69.61 Favored 'General case' 0 N--CA 1.489 1.498 0 O-C-N 123.405 0.44 . . . . 64.33 111.282 -179.848 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -63.65 -42.73 98.64 Favored Glycine 0 C--N 1.347 1.154 0 N-CA-C 111.753 -0.539 . . . . 55.32 111.753 172.608 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 67' ' ' TYR . . . . . 0.506 ' CE2' ' HG2' ' A' ' 12' ' ' GLN . 17.1 m-30 -79.59 -27.24 41.12 Favored 'General case' 0 N--CA 1.48 1.051 0 N-CA-C 112.855 0.687 . . . . 74.03 112.855 -179.621 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 68' ' ' ILE . . . . . 0.525 ' O ' ' HG ' ' A' ' 72' ' ' LEU . 38.9 mt -66.29 -49.59 74.63 Favored 'Isoleucine or valine' 0 C--N 1.35 0.592 0 N-CA-C 107.405 -1.331 . . . . 35.42 107.405 171.581 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 69' ' ' LYS . . . . . 0.659 ' HB2' ' HE2' ' A' ' 106' ' ' TYR . 0.3 OUTLIER -54.78 -46.75 74.46 Favored 'General case' 0 C--N 1.356 0.872 0 O-C-N 123.989 0.805 . . . . 71.23 110.619 177.66 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 62.0 tt0 -57.43 -51.11 70.75 Favored 'General case' 0 C--N 1.349 0.569 0 O-C-N 124.926 1.391 . . . . 71.34 110.506 -178.843 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 71' ' ' THR . . . . . 0.579 ' HB ' ' HA ' ' A' ' 15' ' ' ALA . 12.8 t -72.57 -19.67 61.45 Favored 'General case' 0 C--O 1.215 -0.757 0 CA-C-O 118.566 -0.731 . . . . 73.11 111.607 -179.199 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 72' ' ' LEU . . . . . 0.716 HD21 ' HB3' ' A' ' 102' ' ' LEU . 17.0 mt -79.74 -28.78 40.44 Favored 'General case' 0 N--CA 1.49 1.566 0 C-N-CA 122.945 0.498 . . . . 70.32 111.499 174.559 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 29.8 m-20 -65.53 -53.24 45.07 Favored 'General case' 0 N--CA 1.473 0.719 0 N-CA-C 107.882 -1.155 . . . . 62.24 107.882 170.519 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 35.0 m-20 -61.54 -33.53 73.99 Favored 'General case' 0 N--CA 1.477 0.879 0 CA-C-N 114.666 -1.152 . . . . 64.1 110.961 179.553 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . 0.455 ' O ' ' HG2' ' A' ' 79' ' ' LYS . 27.2 tp10 -61.84 -60.63 3.36 Favored 'General case' 0 N--CA 1.474 0.737 0 C-N-CA 124.238 1.015 . . . . 73.01 109.455 176.876 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 10.3 tt0 -63.5 -36.34 83.45 Favored 'General case' 0 CA--C 1.545 0.787 0 CA-C-N 116.108 -0.496 . . . . 72.23 111.862 -175.715 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . 0.431 ' O ' ' HB2' ' A' ' 81' ' ' LEU . 93.1 mt -68.22 -54.42 17.92 Favored 'General case' 0 N--CA 1.471 0.594 0 C-N-CA 122.84 0.456 . . . . 72.24 110.537 -179.281 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . 0.709 HD21 ' HA ' ' A' ' 22' ' ' LEU . 51.0 mt -62.24 -52.66 62.84 Favored 'General case' 0 N--CA 1.484 1.248 0 C-N-CA 122.979 0.512 . . . . 71.4 112.08 -178.532 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 79' ' ' LYS . . . . . 0.455 ' HG2' ' O ' ' A' ' 75' ' ' GLU . 26.3 mmtp -73.87 -28.08 61.39 Favored 'General case' 0 N--CA 1.476 0.86 0 O-C-N 123.716 0.635 . . . . 73.31 110.805 -173.81 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -75.42 -24.19 71.38 Favored Glycine 0 C--N 1.344 1.019 0 CA-C-N 116.02 -0.536 . . . . 64.31 112.287 171.285 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 81' ' ' LEU . . . . . 0.431 ' HB2' ' O ' ' A' ' 77' ' ' LEU . 5.1 tt -80.51 -41.96 23.33 Favored 'General case' 0 N--CA 1.475 0.791 0 C-N-CA 123.662 0.785 . . . . 71.41 109.829 178.087 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 96.4 mt . . . . . 0 N--CA 1.475 0.799 0 N-CA-C 109.754 -0.461 . . . . 71.21 109.754 -173.131 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 80.3 mt . . . . . 0 N--CA 1.469 0.516 0 N-CA-C 107.946 -1.131 . . . . 71.32 107.946 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 93' ' ' ILE . . . . . 0.482 HG22 ' HG2' ' A' ' 95' ' ' GLN . 43.8 mt -128.24 138.02 55.82 Favored 'Isoleucine or valine' 0 C--O 1.241 0.625 0 N-CA-C 107.53 -1.285 . . . . 73.41 107.53 177.383 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -63.08 -30.59 77.94 Favored Glycine 0 C--N 1.353 1.481 0 O-C-N 124.114 0.884 . . . . 64.14 114.362 -171.671 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 95' ' ' GLN . . . . . 0.482 ' HG2' HG22 ' A' ' 93' ' ' ILE . 30.0 pt20 -73.12 -0.29 13.68 Favored 'General case' 0 N--CA 1.486 1.343 0 C-N-CA 123.338 0.655 . . . . 74.45 112.407 178.437 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 20.9 m 66.12 30.27 9.48 Favored 'General case' 0 C--N 1.358 0.96 0 C-N-CA 124.987 1.315 . . . . 75.13 111.978 171.503 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 14.9 t -74.6 14.11 0.52 Allowed 'General case' 0 N--CA 1.481 1.106 0 C-N-CA 123.679 0.792 . . . . 72.24 112.923 -176.265 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 98' ' ' ARG . . . . . 0.401 ' O ' HD13 ' A' ' 102' ' ' LEU . 60.6 ttp180 -53.57 -53.09 56.7 Favored 'General case' 0 N--CA 1.476 0.857 0 C-N-CA 124.377 1.071 . . . . 63.24 111.622 179.145 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 99' ' ' GLN . . . . . 0.409 HE22 ' HG3' ' A' ' 75' ' ' GLU . 9.7 mm100 -61.94 -47.0 86.87 Favored 'General case' 0 N--CA 1.479 0.997 0 CA-C-O 121.488 0.661 . . . . 70.13 109.63 -176.76 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 38.9 ttmt -62.36 -40.53 96.73 Favored 'General case' 0 CA--C 1.54 0.584 0 CA-C-N 113.781 -1.554 . . . . 61.34 111.729 -178.385 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 38.7 t -71.95 -44.37 63.7 Favored 'General case' 0 N--CA 1.474 0.737 0 C-N-CA 123.753 0.821 . . . . 55.52 110.942 -172.464 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 102' ' ' LEU . . . . . 0.716 ' HB3' HD21 ' A' ' 72' ' ' LEU . 8.9 mp -72.08 -37.57 69.57 Favored 'General case' 0 CA--C 1.546 0.819 0 CA-C-N 115.314 -0.857 . . . . 51.14 110.682 -179.662 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 9.8 t30 -68.82 -31.9 71.21 Favored 'General case' 0 N--CA 1.48 1.051 0 CA-C-N 115.698 -0.683 . . . . 74.52 110.503 176.176 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 49.0 t30 -74.47 -36.11 63.3 Favored 'General case' 0 N--CA 1.482 1.173 0 C-N-CA 123.596 0.759 . . . . 52.52 110.017 176.947 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -61.21 -49.59 76.52 Favored 'General case' 0 N--CA 1.475 0.794 0 C-N-CA 123.057 0.543 . . . . 53.03 110.134 177.4 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 106' ' ' TYR . . . . . 0.659 ' HE2' ' HB2' ' A' ' 69' ' ' LYS . 1.7 t80 -63.85 -48.88 74.97 Favored 'General case' 0 C--N 1.354 0.795 0 O-C-N 123.993 0.808 . . . . 72.35 109.472 175.62 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -56.93 -38.3 83.91 Favored Glycine 0 C--N 1.35 1.31 0 O-C-N 124.017 0.823 . . . . 35.42 113.772 -173.691 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 70.8 mtm180 -75.63 -42.82 50.61 Favored 'General case' 0 C--O 1.239 0.545 0 C-N-CA 123.386 0.674 . . . . 75.03 110.533 176.767 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 32.7 tp -61.82 -28.27 69.35 Favored 'General case' 0 N--CA 1.491 1.578 0 C-N-CA 123.141 0.576 . . . . 72.13 110.894 177.251 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 39.5 t -83.08 -38.62 22.26 Favored 'General case' 0 N--CA 1.452 -0.363 0 CA-C-N 114.711 -1.131 . . . . 62.21 109.449 178.144 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . -79.09 -64.99 1.85 Allowed Glycine 0 C--N 1.356 1.643 0 CA-C-O 119.214 -0.77 . . . . 50.13 113.558 -173.228 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 112' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -99.32 -66.53 0.9 Allowed 'General case' 0 N--CA 1.485 1.3 0 CA-C-N 118.793 1.297 . . . . 70.21 109.525 172.637 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER 170.43 27.31 0.0 OUTLIER 'General case' 0 CA--C 1.573 1.831 0 O-C-N 124.712 1.258 . . . . 74.02 109.626 -171.633 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 N--CA 1.501 2.109 0 C-N-CA 125.92 1.688 . . . . 72.04 111.368 -178.324 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 25.9 ttt . . . . . 0 CA--C 1.555 1.162 0 CA-C-O 119.621 -0.228 . . . . 73.5 110.906 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 4.6 p -53.85 -35.33 61.39 Favored 'General case' 0 N--CA 1.489 1.477 0 C-N-CA 123.501 0.72 . . . . 70.44 112.471 -178.957 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 63.5 p -62.22 -48.07 81.62 Favored 'General case' 0 N--CA 1.48 1.069 0 C-N-CA 123.701 0.8 . . . . 72.32 110.555 176.524 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 22.1 m -66.26 -37.63 85.93 Favored 'General case' 0 CA--C 1.54 0.594 0 CA-C-N 115.023 -0.99 . . . . 75.13 111.194 -179.876 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 78.1 t -65.75 -44.63 93.11 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.936 0 C-N-CA 123.192 0.597 . . . . 54.1 110.433 -179.175 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 11.7 mm-40 -61.54 -41.57 97.54 Favored 'General case' 0 C--N 1.353 0.761 0 O-C-N 123.581 0.551 . . . . 73.43 110.703 173.782 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 44.6 t80 -63.05 -47.85 81.18 Favored 'General case' 0 N--CA 1.481 1.101 0 C-N-CA 123.852 0.861 . . . . 75.44 111.439 -176.958 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 8' ' ' ILE . . . . . 0.434 HD11 HG23 ' A' ' 60' ' ' ILE . 73.1 mt -65.0 -41.54 92.37 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.033 0 C-N-CA 123.682 0.793 . . . . 74.1 109.541 177.472 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 4.0 t-20 -65.76 -29.15 69.62 Favored 'General case' 0 N--CA 1.479 1.022 0 C-N-CA 123.756 0.822 . . . . 72.51 111.104 179.23 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . 0.749 ' HB3' HG22 ' A' ' 47' ' ' VAL . 57.6 mtt180 -78.55 -30.64 46.99 Favored 'General case' 0 N--CA 1.469 0.477 0 C-N-CA 123.689 0.796 . . . . 74.13 110.381 177.431 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 11' ' ' TRP . . . . . 0.479 ' HH2' ' HG ' ' A' ' 102' ' ' LEU . 76.8 m95 -74.98 -27.57 60.21 Favored 'General case' 0 N--CA 1.477 0.902 0 CA-C-O 119.492 -0.29 . . . . 61.13 110.945 170.381 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . 0.426 ' HG3' ' O ' ' A' ' 8' ' ' ILE . 51.5 mt-30 -64.49 -44.18 91.8 Favored 'General case' 0 C--O 1.212 -0.896 0 N-CA-C 107.744 -1.206 . . . . 64.14 107.744 168.959 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 30.9 tpt180 -59.04 -50.98 72.02 Favored 'General case' 0 CA--C 1.547 0.862 0 O-C-N 124.087 0.867 . . . . 74.35 110.689 -177.222 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 56.4 mt -63.97 -49.53 81.26 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.313 0 C-N-CA 122.666 0.387 . . . . 63.52 110.335 179.187 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . 0.558 ' HA ' ' HB ' ' A' ' 71' ' ' THR . . . -59.06 -43.51 91.72 Favored 'General case' 0 N--CA 1.485 1.31 0 C-N-CA 123.864 0.865 . . . . 71.02 112.115 -176.373 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 95.1 mt -77.41 -39.6 46.49 Favored 'General case' 0 N--CA 1.481 1.082 0 CA-C-N 115.248 -0.887 . . . . 75.34 110.658 -174.848 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.509 ' O ' ' HG ' ' A' ' 21' ' ' LEU . 53.9 mt -64.45 -47.04 80.55 Favored 'General case' 0 N--CA 1.483 1.186 0 O-C-N 123.302 0.377 . . . . 75.23 110.511 179.718 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 18' ' ' SER . . . . . 0.424 ' HB3' ' CE1' ' A' ' 40' ' ' TYR . 71.7 p -68.65 -35.5 77.34 Favored 'General case' 0 N--CA 1.477 0.882 0 O-C-N 123.768 0.667 . . . . 71.51 111.143 178.592 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 19' ' ' GLN . . . . . 0.491 ' O ' ' HG2' ' A' ' 23' ' ' GLU . 6.3 tp-100 -62.41 -41.17 98.48 Favored 'General case' 0 C--N 1.357 0.913 0 O-C-N 123.586 0.554 . . . . 74.41 109.878 174.702 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 68.6 m -63.37 -49.19 74.81 Favored 'General case' 0 C--N 1.352 0.702 0 O-C-N 123.818 0.699 . . . . 71.34 109.288 175.564 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . 0.509 ' HG ' ' O ' ' A' ' 17' ' ' LEU . 83.8 mt -57.22 -31.53 65.59 Favored 'General case' 0 N--CA 1.479 1.016 0 C-N-CA 123.811 0.844 . . . . 64.33 110.665 179.995 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.553 ' HA ' HD21 ' A' ' 78' ' ' LEU . 37.9 tp -73.33 -52.45 13.84 Favored 'General case' 0 CA--C 1.543 0.674 0 O-C-N 123.862 0.727 . . . . 64.24 110.727 178.491 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . 0.573 ' HB3' ' NH1' ' A' ' 27' ' ' ARG . 46.5 mm-40 -51.79 -55.2 21.21 Favored 'General case' 0 N--CA 1.491 1.586 0 CA-C-O 122.159 0.981 . . . . 72.12 110.454 177.734 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 70.4 mt -56.36 -51.36 68.59 Favored 'General case' 0 CA--C 1.545 0.77 0 CA-C-N 112.878 -1.965 . . . . 74.32 110.425 179.79 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . 0.504 ' HB2' HD21 ' A' ' 33' ' ' LEU . . . -60.91 -41.52 96.26 Favored 'General case' 0 N--CA 1.49 1.527 0 C-N-CA 123.396 0.679 . . . . 70.42 112.68 -175.962 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 94.6 mt-30 -64.51 -38.22 90.27 Favored 'General case' 0 N--CA 1.478 0.943 0 C-N-CA 123.537 0.735 . . . . 71.3 110.264 179.265 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 27' ' ' ARG . . . . . 0.573 ' NH1' ' HB3' ' A' ' 23' ' ' GLU . 58.0 mtt180 -81.65 -15.66 53.85 Favored 'General case' 0 N--CA 1.488 1.453 0 N-CA-C 112.306 0.484 . . . . 71.23 112.306 175.517 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 88.79 24.93 31.21 Favored Glycine 0 C--N 1.349 1.305 0 N-CA-C 114.527 0.571 . . . . 74.55 114.527 177.417 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 49.7 mm-40 -84.33 60.55 6.05 Favored 'General case' 0 N--CA 1.477 0.895 0 C-N-CA 124.239 1.016 . . . . 64.22 110.699 175.491 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 30' ' ' TRP . . . . . 0.471 ' O ' ' HG ' ' A' ' 34' ' ' LEU . 88.5 m95 -66.17 -30.57 71.07 Favored 'General case' 0 N--CA 1.477 0.88 0 C-N-CA 123.911 0.884 . . . . 74.54 112.575 -171.952 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 4.8 m-20 -61.18 -40.64 94.65 Favored 'General case' 0 N--CA 1.483 1.197 0 C-N-CA 123.332 0.653 . . . . 74.41 110.563 175.642 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 64.2 mt -71.6 -26.54 62.63 Favored 'General case' 0 CA--C 1.543 0.683 0 CA-C-N 115.211 -0.904 . . . . 61.02 110.396 179.842 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . 0.504 HD21 ' HB2' ' A' ' 25' ' ' ALA . 7.6 mp -66.29 -44.59 83.11 Favored 'General case' 0 N--CA 1.489 1.492 0 N-CA-C 110.476 -0.194 . . . . 62.54 110.476 169.039 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.471 ' HG ' ' O ' ' A' ' 30' ' ' TRP . 83.0 mt -63.63 -34.53 78.04 Favored 'General case' 0 N--CA 1.48 1.058 0 O-C-N 123.896 0.747 . . . . 74.44 111.124 -178.548 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 96.8 mt-30 -65.71 -58.04 6.62 Favored 'General case' 0 N--CA 1.483 1.186 0 CA-C-O 121.168 0.508 . . . . 63.41 110.033 174.687 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 36' ' ' GLN . . . . . 0.422 ' HB2' HD21 ' A' ' 21' ' ' LEU . 80.1 mm-40 -73.82 -10.39 59.62 Favored 'General case' 0 N--CA 1.477 0.896 0 CA-C-N 114.885 -1.052 . . . . 54.11 112.654 -174.207 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 37.1 tt0 -53.38 -52.31 59.7 Favored 'General case' 0 N--CA 1.475 0.79 0 C-N-CA 124.591 1.156 . . . . 73.44 110.692 175.224 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 46.8 t -58.7 -43.97 88.89 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.141 0 O-C-N 123.76 0.662 . . . . 75.23 110.179 -179.18 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 42.7 m -56.95 -53.23 60.4 Favored 'General case' 0 CA--C 1.546 0.809 0 CA-C-N 115.403 -0.817 . . . . 74.2 111.631 176.211 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 40' ' ' TYR . . . . . 0.424 ' CE1' ' HB3' ' A' ' 18' ' ' SER . 58.2 t80 -63.0 -49.62 73.94 Favored 'General case' 0 N--CA 1.474 0.758 0 C-N-CA 123.797 0.839 . . . . 71.55 111.159 -173.502 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . 0.763 ' HB3' HD21 ' A' ' 92' ' ' LEU . 72.2 mt -60.23 -48.34 82.15 Favored 'General case' 0 C--O 1.257 1.486 0 C-N-CA 124.48 1.112 . . . . 72.12 111.285 -178.022 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 49.8 tt0 -61.07 -44.03 98.0 Favored 'General case' 0 N--CA 1.475 0.786 0 CA-C-N 115.557 -0.747 . . . . 73.15 110.43 -179.85 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 43' ' ' SER . . . . . 0.518 ' O ' HG23 ' A' ' 47' ' ' VAL . 69.4 m -60.94 -57.7 11.56 Favored 'General case' 0 C--N 1.354 0.767 0 CA-C-N 115.378 -0.828 . . . . 73.42 111.442 -178.511 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 3.9 tt -58.38 -41.22 80.84 Favored 'Isoleucine or valine' 0 C--O 1.251 1.156 0 C-N-CA 123.266 0.626 . . . . 72.15 111.375 -174.682 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . 0.406 ' CG ' HD22 ' A' ' 92' ' ' LEU . 40.9 mm-40 -59.19 -49.8 76.47 Favored 'General case' 0 C--N 1.367 1.333 0 N-CA-C 111.542 0.201 . . . . 75.11 111.542 173.442 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 46' ' ' THR . . . . . 0.49 ' O ' ' HD3' ' A' ' 50' ' ' LYS . 97.3 m -55.72 -41.78 74.36 Favored 'General case' 0 N--CA 1.482 1.155 0 O-C-N 123.958 0.786 . . . . 55.45 111.617 -178.292 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 47' ' ' VAL . . . . . 0.749 HG22 ' HB3' ' A' ' 10' ' ' ARG . 26.2 t -70.05 -37.71 73.04 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.997 0 C-N-CA 122.884 0.474 . . . . 73.33 110.623 -177.94 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 48' ' ' MET . . . . . . . . . . . . . 79.1 mtm -72.22 -19.93 61.64 Favored 'General case' 0 N--CA 1.481 1.113 0 CA-C-N 116.183 -0.462 . . . . 71.21 111.76 175.375 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 48.2 mt-10 -83.02 -7.47 59.66 Favored 'General case' 0 N--CA 1.49 1.57 0 C-N-CA 123.285 0.634 . . . . 74.11 111.759 172.918 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . 0.49 ' HD3' ' O ' ' A' ' 46' ' ' THR . 12.7 mptt -95.44 132.0 40.98 Favored 'General case' 0 N--CA 1.482 1.169 0 C-N-CA 123.485 0.714 . . . . 72.52 110.235 177.691 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 34.2 tt0 -68.57 151.99 45.99 Favored 'General case' 0 C--O 1.247 0.923 0 C-N-CA 123.524 0.729 . . . . 74.5 109.389 172.787 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 20.0 m -59.69 118.85 35.3 Favored Pre-proline 0 CA--C 1.556 1.185 0 CA-C-O 118.744 -0.646 . . . . 73.32 109.792 173.471 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 53' ' ' PRO . . . . . 0.511 ' HD2' HD11 ' A' ' 56' ' ' ILE . 31.6 Cg_exo -62.72 153.62 71.1 Favored 'Trans proline' 0 C--N 1.377 2.075 0 C-N-CA 122.602 2.202 . . . . 55.12 112.79 177.844 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 54' ' ' PRO . . . . . 0.445 ' HD3' ' HA ' ' A' ' 53' ' ' PRO . 22.7 Cg_exo -66.98 -47.98 2.14 Favored 'Trans proline' 0 C--N 1.373 1.861 0 C-N-CA 123.199 2.599 . . . . 73.35 112.506 177.591 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . -83.94 59.86 4.91 Favored Glycine 0 C--N 1.346 1.092 0 CA-C-N 115.966 -0.561 . . . . 62.33 114.07 -173.233 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 56' ' ' ILE . . . . . 0.511 HD11 ' HD2' ' A' ' 53' ' ' PRO . 56.1 mt -100.72 116.23 43.79 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.763 0 N-CA-C 108.133 -1.062 . . . . 44.44 108.133 169.971 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 57' ' ' THR . . . . . 0.423 ' H ' HD12 ' A' ' 60' ' ' ILE . 71.6 p -101.73 -166.88 1.34 Allowed 'General case' 0 CA--C 1.545 0.763 0 C-N-CA 124.178 0.991 . . . . 62.32 109.523 177.634 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 16.6 tpt85 -61.25 -63.42 1.29 Allowed 'General case' 0 N--CA 1.474 0.773 0 C-N-CA 123.715 0.806 . . . . 75.11 111.017 -179.828 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 26.0 m -54.73 -38.0 66.6 Favored 'General case' 0 N--CA 1.482 1.142 0 C-N-CA 123.482 0.713 . . . . 62.02 111.778 -178.41 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 60' ' ' ILE . . . . . 0.434 HG23 HD11 ' A' ' 8' ' ' ILE . 80.2 mt -63.51 -46.72 94.35 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.703 0 C-N-CA 123.481 0.712 . . . . 72.14 110.655 178.079 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 61' ' ' GLN . . . . . 0.535 ' HG3' ' HG ' ' A' ' 109' ' ' LEU . 50.9 tt0 -61.77 -39.35 91.36 Favored 'General case' 0 N--CA 1.476 0.849 0 C-N-CA 123.073 0.549 . . . . 63.25 111.106 179.896 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 9.0 m-20 -69.15 -37.42 78.23 Favored 'General case' 0 N--CA 1.479 1.002 0 C-N-CA 123.175 0.59 . . . . 74.02 111.944 179.298 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 63' ' ' MET . . . . . . . . . . . . . 72.1 mtm -68.42 -49.79 57.46 Favored 'General case' 0 N--CA 1.48 1.029 0 C-N-CA 122.41 0.284 . . . . 74.05 110.564 177.477 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 64' ' ' VAL . . . . . 0.513 ' O ' HG13 ' A' ' 68' ' ' ILE . 60.6 t -60.49 -59.76 3.65 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.664 0 C-N-CA 123.873 0.869 . . . . 71.04 110.216 -179.87 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . 0.568 ' HB2' HD23 ' A' ' 109' ' ' LEU . . . -60.36 -38.56 84.23 Favored 'General case' 0 N--CA 1.483 1.179 0 O-C-N 123.635 0.584 . . . . 64.02 111.571 -179.24 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -58.59 -42.36 96.06 Favored Glycine 0 C--N 1.35 1.307 0 O-C-N 123.218 0.324 . . . . 70.03 112.457 175.961 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 67' ' ' TYR . . . . . 0.428 ' O ' HG22 ' A' ' 71' ' ' THR . 12.3 m-85 -70.35 -36.26 74.08 Favored 'General case' 0 N--CA 1.473 0.702 0 C-N-CA 123.083 0.553 . . . . 72.12 111.681 177.007 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 68' ' ' ILE . . . . . 0.513 HG13 ' O ' ' A' ' 64' ' ' VAL . 65.0 mt -60.02 -56.61 16.31 Favored 'Isoleucine or valine' 0 C--N 1.361 1.072 0 N-CA-C 108.852 -0.796 . . . . 75.23 108.852 177.785 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 69' ' ' LYS . . . . . 0.498 ' HB2' ' HE2' ' A' ' 106' ' ' TYR . 28.3 tptp -53.69 -47.27 70.63 Favored 'General case' 0 C--N 1.354 0.771 0 O-C-N 124.283 0.989 . . . . 75.42 110.001 179.997 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 59.8 tt0 -58.93 -48.04 82.89 Favored 'General case' 0 C--N 1.35 0.603 0 O-C-N 124.653 1.221 . . . . 75.35 111.364 -176.292 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 71' ' ' THR . . . . . 0.558 ' HB ' ' HA ' ' A' ' 15' ' ' ALA . 10.5 t -76.99 -22.68 52.79 Favored 'General case' 0 N--CA 1.475 0.805 0 O-C-N 123.433 0.458 . . . . 63.45 111.234 -175.949 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 72' ' ' LEU . . . . . 0.512 ' HG ' ' O ' ' A' ' 68' ' ' ILE . 21.1 mt -74.08 -34.81 64.12 Favored 'General case' 0 N--CA 1.476 0.845 0 O-C-N 123.261 0.351 . . . . 63.31 110.261 173.756 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 73' ' ' ASP . . . . . 0.443 ' HA ' HE21 ' A' ' 76' ' ' GLN . 73.4 m-20 -75.39 -38.44 59.94 Favored 'General case' 0 N--CA 1.473 0.679 0 O-C-N 124.092 0.87 . . . . 73.02 110.535 176.492 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 74' ' ' ASN . . . . . 0.424 ' O ' ' HG ' ' A' ' 78' ' ' LEU . 92.4 m-20 -60.25 -51.87 67.71 Favored 'General case' 0 N--CA 1.48 1.068 0 N-CA-C 109.112 -0.699 . . . . 73.2 109.112 176.819 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 5.4 tt0 -59.95 -42.83 94.9 Favored 'General case' 0 C--N 1.356 0.872 0 CA-C-N 115.518 -0.764 . . . . 75.23 110.869 176.031 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 76' ' ' GLN . . . . . 0.443 HE21 ' HA ' ' A' ' 73' ' ' ASP . 7.8 tt0 -57.09 -43.84 82.6 Favored 'General case' 0 N--CA 1.486 1.337 0 C-N-CA 123.985 0.914 . . . . 72.0 111.415 -179.201 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 94.5 mt -70.6 -37.32 73.88 Favored 'General case' 0 CA--C 1.536 0.412 0 CA-C-N 115.112 -0.949 . . . . 64.31 110.814 -179.473 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . 0.553 HD21 ' HA ' ' A' ' 22' ' ' LEU . 72.2 mt -64.84 -42.21 95.11 Favored 'General case' 0 N--CA 1.481 1.106 0 O-C-N 123.699 0.625 . . . . 75.14 111.419 174.928 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 47.3 mmtm -74.24 -34.84 63.77 Favored 'General case' 0 N--CA 1.476 0.865 0 C-N-CA 123.139 0.576 . . . . 61.14 110.674 -176.148 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -70.71 -37.11 67.08 Favored Glycine 0 C--N 1.347 1.194 0 O-C-N 123.91 0.756 . . . . 71.41 111.672 175.828 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 6.7 tt -65.57 -56.83 10.15 Favored 'General case' 0 N--CA 1.481 1.109 0 C-N-CA 123.839 0.855 . . . . 71.53 108.881 177.373 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 80.7 mt . . . . . 0 CA--C 1.543 0.696 0 C-N-CA 124.248 1.019 . . . . 61.14 111.934 -178.44 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 92' ' ' LEU . . . . . 0.763 HD21 ' HB3' ' A' ' 41' ' ' LEU . 89.7 mt . . . . . 0 N--CA 1.473 0.681 0 N-CA-C 108.493 -0.929 . . . . 73.53 108.493 . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 38.3 mt -112.72 -20.32 6.28 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.872 0 C-N-CA 124.852 1.261 . . . . 72.03 108.449 175.434 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 102.35 -62.76 0.48 Allowed Glycine 0 C--N 1.353 1.473 0 CA-C-N 115.962 -0.563 . . . . 72.11 111.915 173.972 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 9.9 pt20 -77.25 -171.81 2.2 Favored 'General case' 0 N--CA 1.482 1.165 0 C-N-CA 123.255 0.622 . . . . 61.52 111.935 -176.942 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 71.7 p -74.81 11.67 1.01 Allowed 'General case' 0 N--CA 1.472 0.647 0 CA-C-O 117.847 -1.073 . . . . 74.1 113.797 -174.944 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 96.0 m -48.58 -42.19 33.0 Favored 'General case' 0 N--CA 1.483 1.199 0 C-N-CA 124.173 0.989 . . . . 72.35 112.397 177.528 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 98' ' ' ARG . . . . . 0.569 ' HD2' HD12 ' A' ' 92' ' ' LEU . 18.5 mtm105 -68.11 -53.65 23.81 Favored 'General case' 0 N--CA 1.475 0.815 0 C-N-CA 124.074 0.95 . . . . 73.45 109.696 -176.687 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 7.7 tp-100 -61.93 -35.16 77.57 Favored 'General case' 0 N--CA 1.477 0.913 0 C-N-CA 124.605 1.162 . . . . 70.22 110.617 -178.226 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -72.75 -39.44 66.83 Favored 'General case' 0 N--CA 1.472 0.656 0 C-N-CA 124.645 1.178 . . . . 73.44 108.966 179.734 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 42.6 t -69.65 -38.3 77.07 Favored 'General case' 0 C--N 1.352 0.678 0 C-N-CA 124.008 0.923 . . . . 75.21 111.585 -176.265 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 102' ' ' LEU . . . . . 0.479 ' HG ' ' HH2' ' A' ' 11' ' ' TRP . 10.8 mp -80.8 -32.7 35.2 Favored 'General case' 0 N--CA 1.472 0.628 0 O-C-N 123.551 0.532 . . . . 62.45 110.649 -179.838 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 25.0 t-20 -68.61 -37.34 79.7 Favored 'General case' 0 N--CA 1.486 1.325 0 CA-C-O 120.975 0.416 . . . . 62.15 109.958 172.852 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 104' ' ' ASN . . . . . 0.667 ' HA ' HH21 ' A' ' 108' ' ' ARG . 28.4 t-20 -65.92 -44.84 83.95 Favored 'General case' 0 C--N 1.356 0.89 0 N-CA-C 108.812 -0.811 . . . . 74.33 108.812 174.661 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -56.5 -41.8 77.29 Favored 'General case' 0 C--N 1.346 0.433 0 O-C-N 124.052 0.845 . . . . 75.43 110.973 178.164 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 106' ' ' TYR . . . . . 0.498 ' HE2' ' HB2' ' A' ' 69' ' ' LYS . 17.2 t80 -68.02 -58.32 4.71 Favored 'General case' 0 CA--C 1.547 0.83 0 C-N-CA 123.339 0.656 . . . . 73.23 110.973 -176.642 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -65.34 -37.04 93.45 Favored Glycine 0 C--N 1.353 1.478 0 CA-C-N 115.797 -0.638 . . . . 53.44 112.413 -173.232 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 108' ' ' ARG . . . . . 0.667 HH21 ' HA ' ' A' ' 104' ' ' ASN . 0.0 OUTLIER -80.34 -22.73 41.14 Favored 'General case' 0 CA--C 1.538 0.507 0 C-N-CA 123.514 0.726 . . . . 73.14 110.673 179.422 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 109' ' ' LEU . . . . . 0.568 HD23 ' HB2' ' A' ' 65' ' ' ALA . 41.0 tp -67.15 -37.24 83.45 Favored 'General case' 0 N--CA 1.498 1.974 0 CA-C-O 121.402 0.62 . . . . 73.55 109.543 170.55 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 30.4 t -70.7 -36.15 73.12 Favored 'General case' 0 CA--C 1.55 0.976 0 CA-C-N 114.418 -1.265 . . . . 51.44 110.295 173.529 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . -90.33 -68.25 1.2 Allowed Glycine 0 C--N 1.371 2.509 0 N-CA-C 115.759 1.064 . . . . 70.54 115.759 -176.511 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 112' ' ' MET . . . . . . . . . . . . . 5.5 tmm? -95.97 -62.99 1.2 Allowed 'General case' 0 N--CA 1.498 1.967 0 CA-C-N 118.911 1.356 . . . . 64.23 111.078 -177.49 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 113' ' ' LEU . . . . . 0.406 HD23 ' HA ' ' A' ' 113' ' ' LEU . 5.8 mt 157.47 66.38 0.0 OUTLIER 'General case' 0 N--CA 1.494 1.749 0 C-N-CA 128.141 2.576 . . . . 63.42 107.198 179.526 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 114' ' ' LEU . . . . . 0.47 ' H ' ' HA ' ' A' ' 109' ' ' LEU . 7.1 tt . . . . . 0 N--CA 1.483 1.211 0 C-N-CA 126.958 2.103 . . . . 72.31 112.698 171.12 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 18.5 ptt? . . . . . 0 N--CA 1.479 1.001 0 CA-C-O 120.923 0.392 . . . . 64.21 110.739 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 8.8 t -55.52 -36.22 66.49 Favored 'General case' 0 N--CA 1.487 1.412 0 C-N-CA 123.268 0.627 . . . . 73.12 111.27 -178.205 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 18.4 m -55.11 -50.07 70.16 Favored 'General case' 0 C--N 1.356 0.855 0 C-N-CA 124.382 1.073 . . . . 72.23 110.85 174.416 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 4' ' ' THR . . . . . 0.463 HG21 HD13 ' A' ' 60' ' ' ILE . 24.2 m -69.14 -39.09 79.04 Favored 'General case' 0 C--O 1.217 -0.616 0 CA-C-N 115.19 -0.914 . . . . 73.32 111.741 -177.508 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 74.6 t -61.91 -47.37 93.52 Favored 'Isoleucine or valine' 0 C--O 1.255 1.378 0 C-N-CA 122.698 0.399 . . . . 43.31 110.143 -177.276 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 27.6 mm-40 -61.43 -48.35 81.6 Favored 'General case' 0 C--N 1.351 0.639 0 CA-C-N 115.669 -0.696 . . . . 45.21 110.114 174.862 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 38.4 t80 -54.18 -49.88 68.31 Favored 'General case' 0 N--CA 1.485 1.31 0 C-N-CA 124.633 1.173 . . . . 64.32 111.472 -176.568 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 8' ' ' ILE . . . . . 0.449 HG13 ' O ' ' A' ' 4' ' ' THR . 64.0 mt -64.02 -47.33 90.87 Favored 'Isoleucine or valine' 0 C--N 1.359 0.988 0 C-N-CA 123.506 0.722 . . . . 72.02 110.123 179.624 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 2.9 t-20 -62.15 -28.94 70.0 Favored 'General case' 0 N--CA 1.484 1.251 0 O-C-N 123.559 0.537 . . . . 64.34 111.272 -176.811 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 96.9 mtt180 -72.82 -40.27 65.95 Favored 'General case' 0 CA--C 1.543 0.692 0 C-N-CA 123.803 0.841 . . . . 52.12 110.584 174.347 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 11' ' ' TRP . . . . . . . . . . . . . 84.0 m95 -65.8 -29.96 70.52 Favored 'General case' 0 N--CA 1.486 1.328 0 C-N-CA 122.801 0.441 . . . . 74.2 111.591 172.99 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . 0.459 ' HG2' ' CE2' ' A' ' 67' ' ' TYR . 38.2 mt-30 -65.21 -46.29 81.31 Favored 'General case' 0 C--O 1.211 -0.953 0 N-CA-C 107.796 -1.187 . . . . 72.31 107.796 173.352 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 61.6 ttt180 -59.62 -41.27 90.03 Favored 'General case' 0 CA--C 1.547 0.851 0 O-C-N 124.034 0.834 . . . . 63.3 111.71 -179.767 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 77.9 mt -64.41 -49.91 78.65 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.478 0 C-N-CA 123.098 0.559 . . . . 71.31 110.094 178.537 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . 0.463 ' HA ' ' HB ' ' A' ' 71' ' ' THR . . . -57.36 -46.55 83.22 Favored 'General case' 0 N--CA 1.478 0.933 0 C-N-CA 124.629 1.172 . . . . 74.3 111.656 178.869 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 89.5 mt -80.17 -34.33 37.63 Favored 'General case' 0 N--CA 1.477 0.896 0 CA-C-N 114.579 -1.191 . . . . 72.23 111.402 -171.968 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.512 ' O ' ' HG ' ' A' ' 21' ' ' LEU . 21.0 mt -67.71 -49.46 62.54 Favored 'General case' 0 N--CA 1.481 1.092 0 N-CA-C 109.642 -0.503 . . . . 73.43 109.642 177.542 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 85.0 p -62.56 -37.72 87.25 Favored 'General case' 0 N--CA 1.478 0.953 0 O-C-N 123.513 0.508 . . . . 64.42 111.052 178.588 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 19' ' ' GLN . . . . . 0.424 HE21 ' NE2' ' A' ' 70' ' ' GLN . 6.2 tp-100 -56.95 -46.92 81.78 Favored 'General case' 0 C--N 1.358 0.951 0 C-N-CA 123.497 0.719 . . . . 74.12 110.159 172.163 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 63.9 m -65.7 -42.11 91.56 Favored 'General case' 0 C--O 1.213 -0.819 0 O-C-N 123.707 0.629 . . . . 75.43 110.688 179.018 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . 0.512 ' HG ' ' O ' ' A' ' 17' ' ' LEU . 87.1 mt -63.43 -34.23 77.3 Favored 'General case' 0 N--CA 1.476 0.832 0 C-N-CA 123.56 0.744 . . . . 53.33 109.882 -178.032 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.589 ' HA ' HD21 ' A' ' 78' ' ' LEU . 56.1 tp -66.97 -54.72 19.16 Favored 'General case' 0 C--N 1.352 0.682 0 C-N-CA 123.535 0.734 . . . . 73.43 110.12 176.026 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 9.5 mm-40 -50.82 -52.58 39.82 Favored 'General case' 0 N--CA 1.479 1.01 0 C-N-CA 124.341 1.056 . . . . 71.34 111.439 178.15 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . 0.469 HD22 HD12 ' A' ' 32' ' ' LEU . 62.4 mt -70.15 -34.54 73.15 Favored 'General case' 0 CA--C 1.539 0.557 0 C-N-CA 124.602 1.161 . . . . 74.02 111.078 -173.334 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . 0.45 ' HB2' HD21 ' A' ' 33' ' ' LEU . . . -60.64 -44.01 96.89 Favored 'General case' 0 N--CA 1.479 1.012 0 CA-C-O 120.902 0.382 . . . . 34.13 110.65 173.754 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 95.1 mt-30 -69.48 -31.79 70.29 Favored 'General case' 0 CA--C 1.549 0.918 0 CA-C-N 115.303 -0.862 . . . . 55.24 111.518 179.016 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 78.3 mtt180 -90.48 -2.57 57.93 Favored 'General case' 0 N--CA 1.483 1.198 0 C-N-CA 123.756 0.822 . . . . 71.24 112.315 -177.834 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 85.38 10.04 78.12 Favored Glycine 0 N--CA 1.479 1.566 0 N-CA-C 114.433 0.533 . . . . 74.11 114.433 174.891 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 29' ' ' GLU . . . . . 0.422 ' HB2' ' HB3' ' A' ' 24' ' ' LEU . 15.3 mm-40 -90.37 55.08 2.93 Favored 'General case' 0 N--CA 1.478 0.942 0 C-N-CA 124.79 1.236 . . . . 71.44 111.126 178.261 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 30' ' ' TRP . . . . . 0.489 ' HA ' HD13 ' A' ' 33' ' ' LEU . 83.5 m95 -63.02 -23.38 67.43 Favored 'General case' 0 N--CA 1.491 1.58 0 C-N-CA 123.875 0.87 . . . . 71.04 111.6 179.441 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 4.1 m-20 -55.61 -47.83 75.89 Favored 'General case' 0 N--CA 1.473 0.702 0 C-N-CA 124.984 1.314 . . . . 51.43 110.18 175.22 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 0.469 HD12 HD22 ' A' ' 24' ' ' LEU . 82.0 mt -72.3 -24.33 61.31 Favored 'General case' 0 CA--C 1.544 0.723 0 CA-C-N 114.306 -1.315 . . . . 53.4 110.954 -177.872 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . 0.489 HD13 ' HA ' ' A' ' 30' ' ' TRP . 9.4 mp -66.23 -45.18 81.57 Favored 'General case' 0 C--N 1.363 1.184 0 N-CA-C 110.101 -0.333 . . . . 73.23 110.101 171.228 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 88.8 mt -65.54 -38.63 90.17 Favored 'General case' 0 N--CA 1.482 1.136 0 C-N-CA 123.325 0.65 . . . . 72.41 111.784 -178.677 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 95.7 mt-30 -71.09 -49.68 41.81 Favored 'General case' 0 N--CA 1.478 0.938 0 C-N-CA 122.588 0.355 . . . . 74.5 110.681 179.211 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 85.2 mm-40 -73.95 -14.2 61.01 Favored 'General case' 0 N--CA 1.483 1.182 0 C-N-CA 123.102 0.561 . . . . 53.32 112.464 179.314 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . 0.453 ' O ' ' HG ' ' A' ' 41' ' ' LEU . 42.9 tt0 -51.92 -52.13 52.1 Favored 'General case' 0 N--CA 1.484 1.236 0 C-N-CA 123.94 0.896 . . . . 73.42 111.32 176.485 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 62.9 t -56.63 -47.84 81.59 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.755 0 O-C-N 123.889 0.743 . . . . 71.53 110.661 -178.856 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 32.0 m -67.04 -37.0 83.31 Favored 'General case' 0 CA--C 1.538 0.508 0 CA-C-N 115.455 -0.793 . . . . 75.55 111.801 -177.695 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 43.8 t80 -70.69 -49.47 46.77 Favored 'General case' 0 N--CA 1.47 0.541 0 C-N-CA 123.248 0.619 . . . . 72.14 110.65 -176.875 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . 0.564 HD22 HD22 ' A' ' 92' ' ' LEU . 22.2 mt -68.36 -41.88 80.03 Favored 'General case' 0 N--CA 1.478 0.939 0 O-C-N 123.851 0.719 . . . . 74.13 110.144 -176.749 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 41.1 tt0 -57.43 -56.03 27.16 Favored 'General case' 0 C--N 1.358 0.965 0 O-C-N 123.924 0.765 . . . . 70.54 110.788 176.119 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 43' ' ' SER . . . . . 0.537 ' O ' HG23 ' A' ' 47' ' ' VAL . 73.0 m -57.54 -56.98 14.93 Favored 'General case' 0 C--N 1.352 0.704 0 O-C-N 124.046 0.841 . . . . 74.21 110.692 -177.587 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 14.6 tt -59.2 -40.8 82.01 Favored 'Isoleucine or valine' 0 C--N 1.354 0.803 0 O-C-N 123.799 0.687 . . . . 63.4 111.39 -172.139 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 38.1 mm-40 -64.07 -47.55 79.65 Favored 'General case' 0 C--N 1.358 0.964 0 CA-C-O 119.435 -0.317 . . . . 71.44 111.412 176.429 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 18.3 m -66.53 -27.6 67.89 Favored 'General case' 0 CA--C 1.551 0.983 0 O-C-N 123.457 0.473 . . . . 73.51 111.849 -177.222 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 47' ' ' VAL . . . . . 0.537 HG23 ' O ' ' A' ' 43' ' ' SER . 59.1 t -80.97 -38.37 16.81 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.384 0 C-N-CA 123.335 0.654 . . . . 72.02 110.612 -179.194 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 48' ' ' MET . . . . . . . . . . . . . 68.5 mtm -73.13 -21.9 60.63 Favored 'General case' 0 N--CA 1.486 1.374 0 C-N-CA 122.755 0.422 . . . . 62.45 110.407 172.894 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 17.2 tp10 -88.0 -18.74 28.34 Favored 'General case' 0 N--CA 1.481 1.096 0 C-N-CA 124.251 1.02 . . . . 73.2 110.167 174.793 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 14.2 tppt? -78.36 138.76 38.7 Favored 'General case' 0 C--O 1.24 0.581 0 N-CA-C 109.27 -0.641 . . . . 64.5 109.27 -179.852 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 8.6 tt0 -68.5 124.99 25.08 Favored 'General case' 0 C--O 1.241 0.639 0 CA-C-N 115.423 -0.808 . . . . 71.31 109.558 -177.899 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 52' ' ' THR . . . . . 0.463 HG21 ' HB3' ' A' ' 114' ' ' LEU . 29.7 m -61.08 121.34 61.82 Favored Pre-proline 0 CA--C 1.555 1.155 0 C-N-CA 123.672 0.789 . . . . 73.21 110.612 178.686 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 55.7 Cg_endo -67.19 155.88 68.69 Favored 'Trans proline' 0 C--N 1.376 1.988 0 C-N-CA 122.414 2.076 . . . . 65.23 111.764 176.484 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 18.1 Cg_exo -67.08 -52.87 0.56 Allowed 'Trans proline' 0 C--N 1.376 1.992 0 C-N-CA 122.399 2.066 . . . . 75.32 111.72 177.574 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . -70.11 86.8 0.31 Allowed Glycine 0 C--N 1.349 1.251 0 O-C-N 124.09 0.869 . . . . 63.24 112.912 -175.618 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 56' ' ' ILE . . . . . 0.472 ' O ' ' HB ' ' A' ' 60' ' ' ILE . 71.9 mt -115.5 -50.28 4.82 Favored 'Isoleucine or valine' 0 C--O 1.209 -1.044 0 C-N-CA 124.646 1.178 . . . . 73.21 108.99 176.416 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 10.4 p 60.43 -177.37 0.1 Allowed 'General case' 0 CA--C 1.557 1.23 0 C-N-CA 125.872 1.669 . . . . 53.0 111.077 -178.2 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -55.57 -42.85 75.3 Favored 'General case' 0 N--CA 1.479 1.011 0 C-N-CA 124.345 1.058 . . . . 71.44 110.144 176.168 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 49.3 m -61.76 -53.97 48.83 Favored 'General case' 0 CA--C 1.545 0.788 0 CA-C-N 115.697 -0.683 . . . . 30.1 112.759 -173.264 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 60' ' ' ILE . . . . . 0.472 ' HB ' ' O ' ' A' ' 56' ' ' ILE . 26.1 mt -79.28 -23.74 12.52 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.182 0 N-CA-C 109.631 -0.507 . . . . 70.15 109.631 -174.648 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 61' ' ' GLN . . . . . 0.47 ' HG3' ' HG ' ' A' ' 109' ' ' LEU . 53.2 tt0 -58.75 -48.23 81.92 Favored 'General case' 0 C--N 1.358 0.942 0 N-CA-C 109.866 -0.42 . . . . 75.35 109.866 172.005 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 3.4 m-20 -71.56 -37.68 71.05 Favored 'General case' 0 CA--C 1.547 0.842 0 CA-C-N 115.973 -0.558 . . . . 62.41 112.416 178.616 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 63' ' ' MET . . . . . . . . . . . . . 69.2 mtm -64.93 -59.79 3.78 Favored 'General case' 0 N--CA 1.488 1.466 0 CA-C-N 117.775 0.261 . . . . 70.13 111.284 179.172 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 64' ' ' VAL . . . . . 0.456 ' O ' HG13 ' A' ' 68' ' ' ILE . 55.5 t -57.64 -49.44 80.64 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.033 0 C-N-CA 123.516 0.726 . . . . 74.23 111.984 178.263 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . 0.498 ' HB2' HD23 ' A' ' 109' ' ' LEU . . . -64.7 -33.21 75.41 Favored 'General case' 0 N--CA 1.495 1.795 0 CA-C-N 118.977 0.808 . . . . 50.2 111.279 -179.638 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -64.36 -39.02 96.61 Favored Glycine 0 C--N 1.347 1.19 0 N-CA-C 112.182 -0.367 . . . . 52.44 112.182 174.795 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 67' ' ' TYR . . . . . 0.47 ' O ' HG22 ' A' ' 71' ' ' THR . 14.2 m-30 -65.48 -42.6 92.06 Favored 'General case' 0 N--CA 1.471 0.61 0 C-N-CA 123.636 0.774 . . . . 74.13 110.752 175.306 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 68' ' ' ILE . . . . . 0.542 ' O ' ' HG ' ' A' ' 72' ' ' LEU . 78.5 mt -59.34 -49.97 81.57 Favored 'Isoleucine or valine' 0 C--N 1.355 0.836 0 O-C-N 124.619 1.199 . . . . 74.23 109.38 178.689 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 69' ' ' LYS . . . . . 0.576 ' HB2' ' HE2' ' A' ' 106' ' ' TYR . 27.9 tptp -57.37 -46.09 83.76 Favored 'General case' 0 N--CA 1.472 0.666 0 C-N-CA 124.013 0.925 . . . . 74.24 110.393 -179.26 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 70' ' ' GLN . . . . . 0.424 ' NE2' HE21 ' A' ' 19' ' ' GLN . 53.5 tt0 -59.35 -48.21 82.49 Favored 'General case' 0 C--N 1.354 0.802 0 CA-C-N 115.306 -0.861 . . . . 72.32 111.058 -179.411 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 71' ' ' THR . . . . . 0.47 HG22 ' O ' ' A' ' 67' ' ' TYR . 9.2 t -76.08 -23.74 55.03 Favored 'General case' 0 C--O 1.24 0.584 0 O-C-N 123.401 0.438 . . . . 74.12 110.227 -174.438 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 72' ' ' LEU . . . . . 0.631 ' HA ' HH12 ' A' ' 98' ' ' ARG . 39.5 mt -61.37 -51.73 67.56 Favored 'General case' 0 C--N 1.363 1.158 0 N-CA-C 108.648 -0.871 . . . . 72.42 108.648 171.796 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 28.6 m-20 -64.51 -48.57 74.65 Favored 'General case' 0 N--CA 1.484 1.231 0 O-C-N 123.945 0.778 . . . . 75.51 112.429 179.716 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 94.6 m-20 -52.02 -56.63 13.09 Favored 'General case' 0 N--CA 1.491 1.593 0 C-N-CA 124.03 0.932 . . . . 63.2 110.729 -179.989 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 15.6 tt0 -70.49 -30.52 67.32 Favored 'General case' 0 CA--C 1.551 1.014 0 CA-C-N 114.787 -1.097 . . . . 74.24 110.762 -176.527 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 8.4 tt0 -64.22 -41.26 97.11 Favored 'General case' 0 N--CA 1.487 1.419 0 C-N-CA 123.49 0.716 . . . . 55.11 110.77 176.744 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 95.2 mt -67.26 -38.99 86.03 Favored 'General case' 0 N--CA 1.47 0.57 0 CA-C-N 115.7 -0.682 . . . . 73.42 109.929 178.085 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . 0.589 HD21 ' HA ' ' A' ' 22' ' ' LEU . 74.9 mt -58.78 -51.25 70.8 Favored 'General case' 0 C--N 1.357 0.898 0 CA-C-N 115.867 -0.606 . . . . 74.5 111.454 172.042 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 2.9 mptm? -61.33 -38.97 88.81 Favored 'General case' 0 N--CA 1.481 1.122 0 C-N-CA 123.956 0.902 . . . . 73.15 111.313 -179.442 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -67.94 -29.83 73.82 Favored Glycine 0 C--N 1.341 0.857 0 O-C-N 123.738 0.649 . . . . 62.13 112.204 177.429 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 81' ' ' LEU . . . . . 0.431 HD22 ' HH2' ' A' ' 30' ' ' TRP . 4.3 tt -78.2 -39.28 41.13 Favored 'General case' 0 CA--C 1.554 1.115 0 C-N-CA 123.5 0.72 . . . . 72.32 109.582 176.088 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 82' ' ' LEU . . . . . 0.433 ' HG ' ' O ' ' A' ' 78' ' ' LEU . 94.0 mt . . . . . 0 N--CA 1.48 1.073 0 C-N-CA 123.184 0.594 . . . . 74.13 111.057 -171.997 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 92' ' ' LEU . . . . . 0.564 HD22 HD22 ' A' ' 41' ' ' LEU . 11.9 mt . . . . . 0 N--CA 1.476 0.875 0 N-CA-C 110.552 -0.166 . . . . 70.0 110.552 . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 49.4 mt -77.24 -43.52 31.13 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.244 0 N-CA-C 109.076 -0.713 . . . . 72.14 109.076 173.14 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -171.62 -29.41 0.02 OUTLIER Glycine 0 C--N 1.346 1.115 0 CA-C-N 115.14 -0.936 . . . . 72.21 112.289 -179.226 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 14.1 pt20 -140.99 -177.41 5.08 Favored 'General case' 0 N--CA 1.481 1.102 0 C-N-CA 123.61 0.764 . . . . 73.52 110.112 179.544 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 50.2 m -66.91 83.01 0.11 Allowed 'General case' 0 CA--C 1.541 0.615 0 C-N-CA 124.233 1.013 . . . . 74.33 112.249 -174.618 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 89.7 m -88.12 -41.85 12.75 Favored 'General case' 0 CA--C 1.54 0.558 0 C-N-CA 123.744 0.818 . . . . 64.41 110.075 176.526 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 98' ' ' ARG . . . . . 0.631 HH12 ' HA ' ' A' ' 72' ' ' LEU . 1.7 tmt_? -49.88 -57.65 6.99 Favored 'General case' 0 N--CA 1.478 0.948 0 C-N-CA 125.075 1.35 . . . . 64.2 112.929 -165.57 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 8.9 tt0 -60.51 -52.4 65.35 Favored 'General case' 0 N--CA 1.477 0.916 0 O-C-N 123.789 0.681 . . . . 64.43 110.861 -170.318 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 65.5 tttp -64.78 -42.99 94.65 Favored 'General case' 0 CA--C 1.542 0.673 0 O-C-N 124.15 0.906 . . . . 51.42 111.473 -178.397 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 26.5 t -69.37 -40.24 77.55 Favored 'General case' 0 N--CA 1.467 0.419 0 C-N-CA 123.426 0.691 . . . . 71.11 111.613 -173.122 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 102' ' ' LEU . . . . . 0.49 ' HG ' HG23 ' A' ' 68' ' ' ILE . 3.4 tp -80.38 -34.65 36.19 Favored 'General case' 0 N--CA 1.471 0.6 0 C-N-CA 122.787 0.435 . . . . 62.25 110.47 -176.372 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 7.6 t30 -63.41 -40.03 96.11 Favored 'General case' 0 N--CA 1.479 1.016 0 C-N-CA 122.933 0.493 . . . . 54.41 109.907 172.902 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 12.0 t30 -67.07 -41.28 86.69 Favored 'General case' 0 N--CA 1.473 0.722 0 CA-C-N 115.651 -0.704 . . . . 71.52 110.126 177.188 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -59.14 -45.17 91.66 Favored 'General case' 0 N--CA 1.47 0.566 0 O-C-N 123.598 0.561 . . . . 55.33 110.402 177.44 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 106' ' ' TYR . . . . . 0.576 ' HE2' ' HB2' ' A' ' 69' ' ' LYS . 19.9 t80 -60.71 -55.4 33.67 Favored 'General case' 0 C--N 1.355 0.821 0 O-C-N 124.046 0.841 . . . . 74.41 110.477 178.999 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -66.09 -44.04 92.13 Favored Glycine 0 C--N 1.349 1.302 0 O-C-N 124.318 1.011 . . . . 43.14 112.494 -171.058 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 20.4 mmm180 -67.1 -33.3 75.18 Favored 'General case' 0 CA--C 1.541 0.633 0 C-N-CA 123.258 0.623 . . . . 72.44 111.048 177.512 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 109' ' ' LEU . . . . . 0.535 ' HA ' ' N ' ' A' ' 114' ' ' LEU . 35.6 tp -68.33 -43.43 77.57 Favored 'General case' 0 N--CA 1.485 1.287 0 C-N-CA 122.819 0.448 . . . . 62.1 110.359 176.327 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 33.2 t -68.06 -31.73 71.57 Favored 'General case' 0 CA--C 1.54 0.595 0 CA-C-N 114.701 -1.136 . . . . 70.11 110.296 -178.326 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . -89.64 -65.18 1.25 Allowed Glycine 0 C--N 1.36 1.898 0 CA-C-O 119.109 -0.828 . . . . 73.24 113.941 -179.502 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 112' ' ' MET . . . . . 0.484 ' O ' ' HG ' ' A' ' 113' ' ' LEU . 10.0 tpt -98.1 -72.52 0.65 Allowed 'General case' 0 N--CA 1.486 1.347 0 CA-C-N 118.609 1.204 . . . . 74.11 112.273 174.637 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 113' ' ' LEU . . . . . 0.484 ' HG ' ' O ' ' A' ' 112' ' ' MET . 12.2 mt 171.25 45.88 0.0 OUTLIER 'General case' 0 N--CA 1.505 2.305 0 C-N-CA 125.445 1.498 . . . . 62.44 109.561 -174.406 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 114' ' ' LEU . . . . . 0.535 ' N ' ' HA ' ' A' ' 109' ' ' LEU . 2.1 tt . . . . . 0 N--CA 1.507 2.388 0 C-N-CA 126.633 1.973 . . . . 62.13 111.343 172.075 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . 0.4 ' O ' HG23 ' A' ' 5' ' ' VAL . 24.6 ptm . . . . . 0 N--CA 1.483 1.221 0 CA-C-O 119.706 -0.188 . . . . 71.02 111.327 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 26.2 p -56.05 -39.65 72.35 Favored 'General case' 0 N--CA 1.484 1.267 0 C-N-CA 123.286 0.634 . . . . 75.24 111.739 -179.934 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 48.3 m -68.46 -30.76 69.7 Favored 'General case' 0 CA--C 1.54 0.593 0 C-N-CA 123.375 0.67 . . . . 65.14 111.637 177.124 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . 0.516 ' HA ' ' HG3' ' A' ' 53' ' ' PRO . 12.4 m -74.42 -35.99 63.43 Favored 'General case' 0 C--N 1.351 0.668 0 C-N-CA 123.04 0.536 . . . . 73.12 111.226 177.207 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . 0.4 HG23 ' O ' ' A' ' 1' ' ' MET . 48.7 t -66.27 -40.29 86.47 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.745 0 N-CA-C 109.248 -0.649 . . . . 73.03 109.248 175.478 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . 0.511 ' O ' ' HG3' ' A' ' 10' ' ' ARG . 5.0 tm-20 -65.34 -37.21 86.37 Favored 'General case' 0 CA--C 1.542 0.652 0 CA-C-N 114.466 -1.243 . . . . 65.11 110.062 176.157 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' PHE . . . . . 0.421 ' O ' ' HB2' ' A' ' 10' ' ' ARG . 69.0 t80 -67.88 -44.62 76.63 Favored 'General case' 0 N--CA 1.48 1.069 0 C-N-CA 124.516 1.126 . . . . 63.31 112.103 178.4 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . 0.49 HD11 HG23 ' A' ' 60' ' ' ILE . 83.9 mt -65.49 -37.68 80.63 Favored 'Isoleucine or valine' 0 C--O 1.214 -0.813 0 N-CA-C 108.752 -0.832 . . . . 74.45 108.752 175.611 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 28.4 t-20 -65.2 -28.87 69.69 Favored 'General case' 0 N--CA 1.482 1.131 0 C-N-CA 124.594 1.157 . . . . 63.53 110.937 175.762 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . 0.6 ' HB3' HG22 ' A' ' 47' ' ' VAL . 65.4 mtt180 -62.56 -53.78 49.53 Favored 'General case' 0 N--CA 1.484 1.251 0 CA-C-O 121.766 0.793 . . . . 74.24 109.216 172.408 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' TRP . . . . . . . . . . . . . 98.3 m95 -73.89 -20.62 60.35 Favored 'General case' 0 N--CA 1.475 0.801 0 CA-C-N 114.927 -1.033 . . . . 74.23 112.741 -177.963 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . 0.439 ' HG3' ' O ' ' A' ' 8' ' ' ILE . 58.7 mt-30 -72.18 -38.86 69.01 Favored 'General case' 0 C--O 1.214 -0.813 0 N-CA-C 108.795 -0.817 . . . . 60.53 108.795 170.117 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 16.5 tpt180 -58.57 -52.34 66.07 Favored 'General case' 0 CA--C 1.54 0.563 0 O-C-N 123.812 0.695 . . . . 74.03 109.702 178.996 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' ILE . . . . . 0.463 HG22 ' OG1' ' A' ' 71' ' ' THR . 22.8 mt -65.04 -46.83 90.21 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.24 0 O-C-N 123.459 0.474 . . . . 63.12 111.03 179.507 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . 0.568 ' HA ' ' HB ' ' A' ' 71' ' ' THR . . . -58.54 -46.78 86.1 Favored 'General case' 0 N--CA 1.491 1.604 0 C-N-CA 123.703 0.801 . . . . 62.23 111.919 -177.278 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 82.7 mt -70.26 -44.6 68.11 Favored 'General case' 0 N--CA 1.479 1.014 0 CA-C-N 114.891 -1.049 . . . . 75.13 111.101 -176.445 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.496 ' O ' ' HG ' ' A' ' 21' ' ' LEU . 74.3 mt -64.83 -45.29 86.78 Favored 'General case' 0 CA--C 1.544 0.717 0 O-C-N 123.607 0.567 . . . . 74.04 111.092 -179.531 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . 0.408 ' HB3' ' OH ' ' A' ' 40' ' ' TYR . 80.4 p -64.68 -39.01 92.93 Favored 'General case' 0 N--CA 1.484 1.248 0 C-N-CA 123.159 0.584 . . . . 74.45 111.392 -179.36 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 6.0 tp-100 -58.98 -48.3 82.04 Favored 'General case' 0 C--N 1.354 0.777 0 O-C-N 123.972 0.795 . . . . 74.25 110.079 175.045 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 38.4 m -56.74 -50.97 70.65 Favored 'General case' 0 C--N 1.354 0.793 0 O-C-N 124.14 0.9 . . . . 74.35 110.188 177.517 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . 0.497 HD22 ' HA ' ' A' ' 33' ' ' LEU . 81.1 mt -65.32 -30.23 71.06 Favored 'General case' 0 CA--C 1.538 0.507 0 C-N-CA 123.754 0.822 . . . . 62.43 111.163 -175.497 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.707 ' HA ' HD21 ' A' ' 78' ' ' LEU . 63.9 tp -64.72 -58.13 7.09 Favored 'General case' 0 C--N 1.353 0.752 0 N-CA-C 109.534 -0.543 . . . . 74.34 109.534 176.989 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 39.3 mt-10 -57.12 -47.28 81.49 Favored 'General case' 0 N--CA 1.475 0.779 0 O-C-N 124.396 1.06 . . . . 63.33 110.991 -178.015 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 95.9 mt -64.33 -40.33 95.68 Favored 'General case' 0 N--CA 1.473 0.714 0 C-N-CA 123.899 0.88 . . . . 74.15 111.442 -177.372 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . 0.493 ' HB2' HD21 ' A' ' 33' ' ' LEU . . . -61.42 -44.73 96.62 Favored 'General case' 0 N--CA 1.476 0.863 0 C-N-CA 122.895 0.478 . . . . 43.33 110.847 178.195 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 89.6 mt-30 -64.84 -30.81 71.83 Favored 'General case' 0 N--CA 1.477 0.883 0 O-C-N 124.088 0.868 . . . . 62.43 111.2 178.351 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 53.6 mtt180 -83.16 -5.79 59.25 Favored 'General case' 0 N--CA 1.481 1.106 0 C-N-CA 123.568 0.747 . . . . 73.2 112.071 177.271 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 86.67 7.65 78.21 Favored Glycine 0 C--N 1.349 1.271 0 N-CA-C 114.027 0.371 . . . . 63.35 114.027 178.144 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 11.2 mm-40 -82.37 57.63 3.74 Favored 'General case' 0 CA--C 1.546 0.791 0 C-N-CA 124.281 1.032 . . . . 61.42 111.251 178.382 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' TRP . . . . . 0.401 ' O ' ' HG ' ' A' ' 34' ' ' LEU . 84.7 m95 -63.43 -32.04 73.37 Favored 'General case' 0 N--CA 1.477 0.917 0 C-N-CA 123.656 0.782 . . . . 72.13 110.942 -178.769 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 10.1 m-20 -56.66 -42.17 78.52 Favored 'General case' 0 N--CA 1.476 0.846 0 C-N-CA 124.032 0.933 . . . . 64.51 110.706 177.846 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 83.3 mt -66.12 -34.51 78.21 Favored 'General case' 0 N--CA 1.474 0.742 0 C-N-CA 123.395 0.678 . . . . 60.04 111.199 179.743 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . 0.497 ' HA ' HD22 ' A' ' 21' ' ' LEU . 9.9 mp -66.22 -39.61 89.71 Favored 'General case' 0 N--CA 1.481 1.101 0 C-N-CA 122.563 0.345 . . . . 64.14 110.299 173.023 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.401 ' HG ' ' O ' ' A' ' 30' ' ' TRP . 84.9 mt -73.66 -22.94 59.81 Favored 'General case' 0 N--CA 1.478 0.945 0 C-N-CA 123.504 0.722 . . . . 72.33 111.661 -179.091 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 48.7 mt-30 -85.98 -32.73 21.37 Favored 'General case' 0 N--CA 1.486 1.372 0 C-N-CA 123.515 0.726 . . . . 61.35 110.774 176.09 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 25.5 mm-40 -86.19 -12.66 49.2 Favored 'General case' 0 N--CA 1.479 1.02 0 C-N-CA 124.017 0.927 . . . . 72.5 111.521 176.136 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . 0.747 ' HG3' ' HB3' ' A' ' 89' ' ' LEU . 36.3 tt0 -44.57 -65.0 0.58 Allowed 'General case' 0 N--CA 1.477 0.889 0 C-N-CA 124.543 1.137 . . . . 53.34 113.055 -178.531 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 93.2 t -65.49 -33.26 62.44 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.692 0 C-N-CA 122.955 0.502 . . . . 61.32 110.866 -175.911 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 57.7 m -63.85 -38.31 90.62 Favored 'General case' 0 N--CA 1.476 0.831 0 C-N-CA 123.069 0.548 . . . . 75.54 111.415 175.406 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 40' ' ' TYR . . . . . 0.408 ' OH ' ' HB3' ' A' ' 18' ' ' SER . 42.4 t80 -78.11 -43.04 30.09 Favored 'General case' 0 C--N 1.344 0.348 0 C-N-CA 123.326 0.65 . . . . 72.34 110.547 -174.705 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . 0.476 ' HG ' ' O ' ' A' ' 37' ' ' GLU . 63.2 mt -64.95 -41.52 95.42 Favored 'General case' 0 C--O 1.245 0.854 0 O-C-N 123.955 0.785 . . . . 63.13 109.554 178.529 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 53.9 tt0 -56.71 -53.4 58.22 Favored 'General case' 0 C--N 1.358 0.962 0 CA-C-N 115.157 -0.929 . . . . 71.41 110.014 173.713 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . 0.562 ' O ' HG23 ' A' ' 47' ' ' VAL . 71.5 m -56.45 -57.16 13.51 Favored 'General case' 0 C--N 1.35 0.607 0 O-C-N 124.216 0.947 . . . . 72.05 111.658 -178.606 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 16.8 tt -61.03 -41.03 87.64 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.812 0 O-C-N 123.728 0.642 . . . . 72.33 111.335 -172.328 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 30.6 mt-10 -72.24 -37.07 69.23 Favored 'General case' 0 N--CA 1.477 0.89 0 N-CA-C 111.975 0.361 . . . . 74.14 111.975 178.824 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 46' ' ' THR . . . . . 0.505 ' O ' ' HB2' ' A' ' 50' ' ' LYS . 96.0 m -57.65 -40.2 78.74 Favored 'General case' 0 N--CA 1.486 1.36 0 C-N-CA 123.008 0.523 . . . . 61.53 110.589 174.424 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 47' ' ' VAL . . . . . 0.6 HG22 ' HB3' ' A' ' 10' ' ' ARG . 87.3 t -68.69 -49.56 63.49 Favored 'Isoleucine or valine' 0 C--O 1.243 0.724 0 C-N-CA 124.201 1.001 . . . . 51.24 111.371 -179.517 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 48' ' ' MET . . . . . . . . . . . . . 78.6 mtm -62.12 -43.74 98.18 Favored 'General case' 0 N--CA 1.482 1.165 0 O-C-N 123.877 0.735 . . . . 72.4 111.399 -176.608 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 46.0 mt-10 -85.02 4.12 35.36 Favored 'General case' 0 N--CA 1.476 0.84 0 C-N-CA 123.721 0.808 . . . . 63.05 111.944 -174.779 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . 0.505 ' HB2' ' O ' ' A' ' 46' ' ' THR . 1.5 tppt? -103.62 135.82 44.49 Favored 'General case' 0 N--CA 1.476 0.834 0 N-CA-C 109.56 -0.533 . . . . 73.44 109.56 179.117 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 9.0 tt0 -69.42 148.61 49.35 Favored 'General case' 0 CA--C 1.547 0.831 0 C-N-CA 123.653 0.781 . . . . 75.04 111.856 -169.615 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 15.9 m -68.68 130.58 91.78 Favored Pre-proline 0 CA--C 1.554 1.104 0 C-N-CA 124.511 1.124 . . . . 65.54 110.461 176.548 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 53' ' ' PRO . . . . . 0.516 ' HG3' ' HA ' ' A' ' 4' ' ' THR . 94.7 Cg_endo -75.38 155.89 41.25 Favored 'Trans proline' 0 CA--C 1.557 1.662 0 C-N-CA 122.591 2.194 . . . . 75.31 112.289 178.0 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_endo -70.03 -46.86 0.97 Allowed 'Trans proline' 0 C--N 1.369 1.643 0 C-N-CA 122.764 2.31 . . . . 61.21 113.413 179.029 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . -79.92 70.74 2.85 Favored Glycine 0 C--N 1.348 1.227 0 N-CA-C 114.336 0.495 . . . . 75.44 114.336 -170.179 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 56' ' ' ILE . . . . . 0.715 HG21 HD11 ' A' ' 113' ' ' LEU . 8.3 mm -101.75 142.86 15.5 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.906 0 C-N-CA 124.012 0.925 . . . . 61.45 108.781 175.518 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 72.9 p -113.18 174.32 5.96 Favored 'General case' 0 N--CA 1.478 0.93 0 N-CA-C 109.005 -0.739 . . . . 74.41 109.005 170.134 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 16.0 tpt180 -59.13 -42.74 91.36 Favored 'General case' 0 N--CA 1.478 0.934 0 C-N-CA 123.128 0.571 . . . . 70.04 109.584 176.197 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 19.8 m -56.64 -50.61 71.54 Favored 'General case' 0 C--N 1.356 0.88 0 C-N-CA 123.972 0.909 . . . . 75.42 111.082 176.733 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 60' ' ' ILE . . . . . 0.494 HD13 HG21 ' A' ' 4' ' ' THR . 99.1 mt -60.28 -42.17 89.61 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.809 0 O-C-N 123.972 0.795 . . . . 75.23 110.985 179.483 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 54.7 tt0 -58.73 -47.34 84.93 Favored 'General case' 0 CA--C 1.542 0.656 0 C-N-CA 123.51 0.724 . . . . 72.31 110.785 -179.715 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 14.4 m-20 -72.77 -32.82 65.89 Favored 'General case' 0 N--CA 1.48 1.027 0 N-CA-C 112.827 0.677 . . . . 64.23 112.827 -178.077 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 63' ' ' MET . . . . . . . . . . . . . 58.7 mtm -74.48 -41.82 60.08 Favored 'General case' 0 N--CA 1.485 1.317 0 CA-C-N 117.568 0.167 . . . . 74.44 110.938 179.673 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 64' ' ' VAL . . . . . 0.496 ' O ' HG13 ' A' ' 68' ' ' ILE . 56.1 t -64.0 -54.14 35.21 Favored 'Isoleucine or valine' 0 C--N 1.352 0.71 0 C-N-CA 123.492 0.717 . . . . 72.32 109.616 176.253 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -62.04 -32.7 73.24 Favored 'General case' 0 N--CA 1.477 0.923 0 O-C-N 123.639 0.587 . . . . 75.31 111.129 178.306 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -63.26 -40.2 98.75 Favored Glycine 0 C--N 1.348 1.205 0 N-CA-C 111.689 -0.564 . . . . 53.32 111.689 174.627 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 16.8 m-30 -75.21 -32.3 61.13 Favored 'General case' 0 C--N 1.352 0.685 0 C-N-CA 123.573 0.749 . . . . 73.23 111.722 178.702 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 68' ' ' ILE . . . . . 0.512 ' O ' ' HG ' ' A' ' 72' ' ' LEU . 62.1 mt -63.17 -56.15 19.05 Favored 'Isoleucine or valine' 0 C--N 1.357 0.903 0 N-CA-C 107.979 -1.119 . . . . 70.32 107.979 175.345 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 51.7 tptt -53.11 -43.51 66.94 Favored 'General case' 0 N--CA 1.477 0.896 0 C-N-CA 124.622 1.169 . . . . 75.21 111.527 177.481 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 61.5 tt0 -59.9 -52.39 65.63 Favored 'General case' 0 N--CA 1.472 0.629 0 CA-C-N 115.731 -0.668 . . . . 70.23 111.249 179.982 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 71' ' ' THR . . . . . 0.568 ' HB ' ' HA ' ' A' ' 15' ' ' ALA . 11.4 t -74.95 -27.07 60.03 Favored 'General case' 0 C--N 1.35 0.619 0 O-C-N 123.285 0.366 . . . . 73.34 110.275 -173.703 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 72' ' ' LEU . . . . . 0.512 ' HG ' ' O ' ' A' ' 68' ' ' ILE . 19.4 mt -61.78 -55.41 30.39 Favored 'General case' 0 C--N 1.358 0.949 0 N-CA-C 108.872 -0.788 . . . . 75.15 108.872 175.19 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -67.83 -41.95 82.24 Favored 'General case' 0 N--CA 1.479 0.982 0 N-CA-C 113.937 1.088 . . . . 74.21 113.937 -175.916 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 94.7 m-20 -60.88 -55.41 33.32 Favored 'General case' 0 N--CA 1.493 1.714 0 CA-C-O 121.869 0.842 . . . . 74.21 110.121 177.299 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . 0.518 ' O ' ' HG2' ' A' ' 79' ' ' LYS . 62.5 tt0 -70.08 -19.9 63.24 Favored 'General case' 0 CA--C 1.549 0.936 0 CA-C-N 114.516 -1.22 . . . . 64.01 110.801 -178.876 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 76' ' ' GLN . . . . . 0.428 ' HB2' ' O ' ' A' ' 72' ' ' LEU . 10.0 tt0 -72.92 -41.12 64.89 Favored 'General case' 0 N--CA 1.489 1.512 0 C-N-CA 123.127 0.571 . . . . 64.03 109.879 176.602 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 93.3 mt -59.58 -41.4 90.15 Favored 'General case' 0 N--CA 1.474 0.77 0 O-C-N 123.938 0.774 . . . . 73.42 109.467 172.926 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . 0.707 HD21 ' HA ' ' A' ' 22' ' ' LEU . 70.1 mt -58.16 -51.25 70.49 Favored 'General case' 0 N--CA 1.478 0.947 0 CA-C-N 115.611 -0.722 . . . . 63.15 111.972 170.87 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 79' ' ' LYS . . . . . 0.518 ' HG2' ' O ' ' A' ' 75' ' ' GLU . 41.3 mmtm -57.1 -42.58 81.03 Favored 'General case' 0 N--CA 1.481 1.105 0 C-N-CA 123.495 0.718 . . . . 74.45 110.827 -176.662 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 80' ' ' GLY . . . . . 0.647 ' HA2' ' HA ' ' A' ' 84' ' ' GLN . . . -67.26 -40.63 92.17 Favored Glycine 0 C--N 1.344 1.004 0 O-C-N 124.583 1.177 . . . . 42.31 113.001 179.259 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 3.1 tt -64.49 -48.3 75.69 Favored 'General case' 0 N--CA 1.475 0.805 0 C-N-CA 123.895 0.878 . . . . 74.55 109.375 179.301 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 85.7 mt -64.1 -62.69 1.46 Allowed 'General case' 0 CA--C 1.543 0.685 0 C-N-CA 124.391 1.076 . . . . 73.42 111.708 -171.885 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 7.9 tt0 -155.62 10.27 0.29 Allowed 'General case' 0 N--CA 1.488 1.426 0 N-CA-C 111.437 0.162 . . . . 73.23 111.437 -177.018 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 84' ' ' GLN . . . . . 0.647 ' HA ' ' HA2' ' A' ' 80' ' ' GLY . 28.6 tt0 72.41 -7.15 1.43 Allowed 'General case' 0 N--CA 1.493 1.7 0 C-N-CA 124.984 1.314 . . . . 71.42 112.832 -179.091 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 85' ' ' ARG . . . . . . . . . . . . . 36.3 ttp180 -82.08 140.39 33.88 Favored 'General case' 0 N--CA 1.479 0.987 0 C-N-CA 123.303 0.641 . . . . 63.41 110.721 -176.706 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 65.1 mt -65.93 -20.27 66.15 Favored 'General case' 0 N--CA 1.487 1.388 0 C-N-CA 124.381 1.072 . . . . 75.45 112.846 -174.763 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 11.3 p-10 -121.18 139.82 52.84 Favored 'General case' 0 N--CA 1.478 0.965 0 N-CA-C 108.401 -0.963 . . . . 71.43 108.401 172.15 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 26.1 mm-40 -151.29 -162.2 1.49 Allowed 'General case' 0 N--CA 1.486 1.362 0 C-N-CA 124.042 0.937 . . . . 72.5 110.093 -174.773 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . 0.747 ' HB3' ' HG3' ' A' ' 37' ' ' GLU . 96.4 mt 68.71 -94.96 0.03 OUTLIER 'General case' 0 C--N 1.361 1.072 0 C-N-CA 125.31 1.444 . . . . 74.1 109.678 -177.54 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 26.0 t -116.81 -78.19 0.58 Allowed 'General case' 0 C--O 1.242 0.667 0 N-CA-C 108.48 -0.933 . . . . 70.32 108.48 174.593 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 34.6 t -177.85 160.6 1.51 Allowed 'General case' 0 C--N 1.355 0.842 0 C-N-CA 123.082 0.553 . . . . 72.04 110.651 -179.886 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 85.1 mt -115.0 -71.11 0.76 Allowed 'General case' 0 N--CA 1.474 0.764 0 N-CA-C 108.364 -0.976 . . . . 73.3 108.364 170.068 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 49.8 mt -120.71 13.34 6.35 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.605 0 CA-C-O 122.003 0.906 . . . . 70.34 109.186 176.865 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 87.37 -11.91 64.33 Favored Glycine 0 N--CA 1.475 1.285 0 CA-C-N 116.042 -0.526 . . . . 64.42 113.967 -178.567 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 33.7 tt0 -132.77 174.1 10.67 Favored 'General case' 0 N--CA 1.477 0.894 0 N-CA-C 108.395 -0.965 . . . . 73.03 108.395 -178.398 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 45.6 m -62.6 81.74 0.02 OUTLIER 'General case' 0 N--CA 1.477 0.893 0 C-N-CA 123.936 0.894 . . . . 60.24 111.62 177.247 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 35.4 m -72.27 -43.33 64.43 Favored 'General case' 0 C--O 1.224 -0.289 0 CA-C-N 115.143 -0.935 . . . . 64.31 109.615 175.748 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 98' ' ' ARG . . . . . 0.495 ' NH1' ' HB3' ' A' ' 75' ' ' GLU . 6.9 ttp180 -59.92 -48.53 81.34 Favored 'General case' 0 CA--C 1.536 0.431 0 O-C-N 124.215 0.947 . . . . 52.54 112.705 -169.417 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 1.5 tm0? -62.96 -55.41 26.1 Favored 'General case' 0 N--CA 1.472 0.651 0 N-CA-C 109.595 -0.52 . . . . 61.14 109.595 -175.071 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 65.4 tttp -56.5 -54.2 48.59 Favored 'General case' 0 CA--C 1.543 0.7 0 O-C-N 123.963 0.789 . . . . 73.22 111.105 -179.868 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 46.8 t -67.53 -55.58 12.94 Favored 'General case' 0 CA--C 1.538 0.516 0 C-N-CA 123.686 0.794 . . . . 64.45 112.022 -171.775 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 8.0 mp -76.83 -30.54 56.4 Favored 'General case' 0 N--CA 1.485 1.282 0 N-CA-C 112.518 0.562 . . . . 63.14 112.518 -172.142 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 8.2 t30 -75.64 -41.87 53.03 Favored 'General case' 0 N--CA 1.485 1.316 0 CA-C-N 118.34 0.518 . . . . 63.51 110.257 177.46 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 104' ' ' ASN . . . . . 0.478 ' O ' ' HG2' ' A' ' 108' ' ' ARG . 28.0 t-20 -62.8 -44.28 96.57 Favored 'General case' 0 N--CA 1.481 1.084 0 N-CA-C 109.165 -0.68 . . . . 54.35 109.165 173.725 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -59.62 -38.27 80.88 Favored 'General case' 0 C--N 1.353 0.745 0 C-N-CA 123.843 0.857 . . . . 55.21 111.436 178.561 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 106' ' ' TYR . . . . . . . . . . . . . 4.3 t80 -61.0 -48.64 80.89 Favored 'General case' 0 CA--C 1.54 0.583 0 N-CA-C 108.738 -0.838 . . . . 75.31 108.738 175.104 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -61.93 -36.86 93.46 Favored Glycine 0 C--N 1.353 1.474 0 O-C-N 123.845 0.716 . . . . 64.14 112.786 -179.813 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 108' ' ' ARG . . . . . 0.478 ' HG2' ' O ' ' A' ' 104' ' ' ASN . 34.1 mmt180 -70.59 -40.38 73.28 Favored 'General case' 0 N--CA 1.473 0.679 0 C-N-CA 123.177 0.591 . . . . 61.21 110.035 -179.79 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 109' ' ' LEU . . . . . 0.413 ' HA ' ' N ' ' A' ' 114' ' ' LEU . 59.7 tp -66.75 -39.66 87.99 Favored 'General case' 0 N--CA 1.48 1.064 0 C-N-CA 123.741 0.816 . . . . 72.53 110.271 178.924 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 23.3 t -76.03 -27.76 57.44 Favored 'General case' 0 CA--C 1.543 0.696 0 CA-C-N 114.888 -1.051 . . . . 63.42 110.397 -179.802 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . -90.03 -67.04 1.21 Allowed Glycine 0 C--N 1.361 1.941 0 CA-C-O 119.194 -0.781 . . . . 61.14 113.698 -177.665 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 112' ' ' MET . . . . . 0.683 ' HB2' ' HB3' ' A' ' 118' ' ' ALA . 3.1 tmm? -97.15 -66.14 0.92 Allowed 'General case' 0 N--CA 1.481 1.088 0 CA-C-N 118.369 1.085 . . . . 75.21 110.605 179.289 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 113' ' ' LEU . . . . . 0.715 HD11 HG21 ' A' ' 56' ' ' ILE . 19.7 tp 160.21 54.35 0.0 OUTLIER 'General case' 0 N--CA 1.489 1.498 0 C-N-CA 126.378 1.871 . . . . 74.24 108.501 -178.501 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 114' ' ' LEU . . . . . 0.413 ' N ' ' HA ' ' A' ' 109' ' ' LEU . 22.3 tp 61.05 58.75 2.18 Favored 'General case' 0 CA--C 1.543 0.702 0 C-N-CA 125.764 1.626 . . . . 72.53 111.911 176.271 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 115' ' ' VAL . . . . . . . . . . . . . 24.3 m -132.97 140.92 39.13 Favored Pre-proline 0 N--CA 1.478 0.931 0 CA-C-N 114.857 -1.065 . . . . 74.15 108.326 170.586 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 10.1 Cg_exo -70.57 79.69 1.18 Allowed 'Trans proline' 0 C--N 1.374 1.887 0 C-N-CA 122.768 2.312 . . . . 72.41 111.817 -179.938 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 31.0 t70 -158.75 -71.97 0.09 Allowed 'General case' 0 C--N 1.349 0.571 0 CA-C-N 115.315 -0.857 . . . . 74.3 110.664 -178.055 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 118' ' ' ALA . . . . . 0.683 ' HB3' ' HB2' ' A' ' 112' ' ' MET . . . -103.34 108.33 58.71 Favored Pre-proline 0 N--CA 1.477 0.883 0 C-N-CA 123.441 0.696 . . . . 73.34 111.042 -173.559 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 119' ' ' PRO . . . . . . . . . . . . . 83.2 Cg_endo -91.54 142.52 2.85 Favored 'Trans proline' 0 C--N 1.369 1.649 0 C-N-CA 122.913 2.409 . . . . 74.25 111.035 167.402 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . -154.43 165.07 31.79 Favored Glycine 0 N--CA 1.466 0.696 0 N-CA-C 112.302 -0.319 . . . . 61.14 112.302 -176.338 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . -159.37 157.47 30.41 Favored 'General case' 0 N--CA 1.472 0.645 0 C-N-CA 123.238 0.615 . . . . 75.23 110.046 179.992 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 122' ' ' SER . . . . . . . . . . . . . 30.9 m . . . . . 0 C--O 1.249 1.07 0 C-N-CA 123.656 0.782 . . . . 75.21 109.367 -179.077 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 25.3 ttt . . . . . 0 CA--C 1.553 1.078 0 CA-C-O 119.495 -0.288 . . . . 61.41 110.856 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 37.1 p -56.03 -49.08 74.68 Favored 'General case' 0 N--CA 1.487 1.405 0 N-CA-C 112.704 0.631 . . . . 72.14 112.704 -172.142 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 55.2 m -68.41 -26.67 65.65 Favored 'General case' 0 N--CA 1.483 1.183 0 C-N-CA 122.459 0.304 . . . . 73.42 111.774 -178.597 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . 0.515 HG21 HD13 ' A' ' 60' ' ' ILE . 28.2 m -75.02 -41.3 59.56 Favored 'General case' 0 C--N 1.349 0.566 0 C-N-CA 123.191 0.596 . . . . 73.42 110.755 177.37 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 87.9 t -68.32 -36.36 74.7 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.817 0 C-N-CA 123.381 0.673 . . . . 65.11 109.438 177.361 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 42.2 mm-40 -62.37 -46.62 87.82 Favored 'General case' 0 N--CA 1.478 0.931 0 C-N-CA 123.761 0.824 . . . . 74.34 110.566 173.252 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 31.0 t80 -64.93 -47.91 76.0 Favored 'General case' 0 N--CA 1.475 0.821 0 O-C-N 123.989 0.805 . . . . 74.32 110.603 -175.878 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . 0.499 HD11 HG23 ' A' ' 60' ' ' ILE . 77.4 mt -65.75 -36.96 78.81 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.856 0 C-N-CA 123.607 0.763 . . . . 70.43 110.439 178.577 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 26.0 t-20 -73.29 -27.8 61.75 Favored 'General case' 0 N--CA 1.489 1.489 0 C-N-CA 123.201 0.6 . . . . 73.25 111.195 -179.681 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . 0.587 ' HB3' HG22 ' A' ' 47' ' ' VAL . 62.7 mtt85 -72.11 -37.43 69.51 Favored 'General case' 0 CA--C 1.54 0.595 0 C-N-CA 123.054 0.542 . . . . 71.44 109.754 173.038 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' TRP . . . . . . . . . . . . . 86.5 m95 -76.14 -20.92 57.17 Favored 'General case' 0 N--CA 1.475 0.824 0 CA-C-N 116.043 -0.526 . . . . 70.13 111.549 172.012 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 53.5 mt-30 -68.15 -46.38 70.93 Favored 'General case' 0 C--N 1.359 0.982 0 N-CA-C 107.553 -1.276 . . . . 65.12 107.553 168.839 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . 0.668 ' HE ' HD11 ' A' ' 17' ' ' LEU . 16.2 tpt180 -59.02 -46.66 87.64 Favored 'General case' 0 CA--C 1.548 0.868 0 O-C-N 123.8 0.688 . . . . 74.41 110.927 -177.622 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' ILE . . . . . 0.441 HD13 HG13 ' A' ' 44' ' ' ILE . 56.8 mt -66.21 -52.81 43.5 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.095 0 O-C-N 123.201 0.313 . . . . 72.44 110.607 177.8 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . 0.569 ' HA ' ' HB ' ' A' ' 71' ' ' THR . . . -56.56 -45.15 81.43 Favored 'General case' 0 N--CA 1.488 1.436 0 C-N-CA 123.828 0.851 . . . . 34.12 111.794 -177.032 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 97.0 mt -78.58 -40.6 34.23 Favored 'General case' 0 N--CA 1.481 1.119 0 CA-C-N 114.923 -1.035 . . . . 72.45 111.39 -171.904 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.668 HD11 ' HE ' ' A' ' 13' ' ' ARG . 30.3 mt -64.0 -51.3 64.89 Favored 'General case' 0 C--N 1.36 1.05 0 CA-C-O 119.166 -0.445 . . . . 74.1 110.478 177.536 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 80.5 p -62.31 -36.47 82.25 Favored 'General case' 0 N--CA 1.478 0.945 0 O-C-N 123.789 0.681 . . . . 75.04 111.123 -179.94 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 19' ' ' GLN . . . . . 0.502 HE21 ' NE2' ' A' ' 70' ' ' GLN . 6.7 tp-100 -62.19 -44.39 96.68 Favored 'General case' 0 C--N 1.358 0.976 0 C-N-CA 123.288 0.635 . . . . 72.42 110.305 175.105 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 63.4 m -62.04 -43.84 97.97 Favored 'General case' 0 C--O 1.214 -0.782 0 O-C-N 123.918 0.761 . . . . 63.43 109.663 176.975 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . 0.714 HD22 ' HA ' ' A' ' 33' ' ' LEU . 52.4 mt -64.15 -31.92 73.3 Favored 'General case' 0 C--N 1.351 0.638 0 C-N-CA 123.268 0.627 . . . . 75.24 110.54 -178.009 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.721 ' HA ' HD21 ' A' ' 78' ' ' LEU . 50.7 tp -66.85 -54.64 20.38 Favored 'General case' 0 N--CA 1.48 1.039 0 C-N-CA 123.096 0.558 . . . . 55.11 110.082 176.173 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . 0.412 ' HB3' ' NH1' ' A' ' 27' ' ' ARG . 11.6 mm-40 -52.69 -52.48 55.81 Favored 'General case' 0 CA--C 1.547 0.858 0 C-N-CA 124.593 1.157 . . . . 74.15 111.414 177.935 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.448 HD22 HD12 ' A' ' 32' ' ' LEU . 77.8 mt -63.45 -43.78 96.39 Favored 'General case' 0 CA--C 1.538 0.516 0 CA-C-N 114.485 -1.234 . . . . 65.34 110.941 -176.752 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . 0.516 ' HB2' HD21 ' A' ' 33' ' ' LEU . . . -58.28 -48.35 80.75 Favored 'General case' 0 N--CA 1.483 1.214 0 C-N-CA 123.264 0.625 . . . . 62.33 110.884 -179.838 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 96.3 mt-30 -63.77 -37.46 87.46 Favored 'General case' 0 CA--C 1.545 0.777 0 CA-C-N 114.815 -1.084 . . . . 74.3 110.904 179.716 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . 0.412 ' NH1' ' HB3' ' A' ' 23' ' ' GLU . 78.2 mtt180 -87.97 3.78 47.41 Favored 'General case' 0 N--CA 1.482 1.152 0 C-N-CA 123.793 0.837 . . . . 74.2 112.793 -178.222 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 83.97 12.12 77.57 Favored Glycine 0 C--N 1.351 1.405 0 N-CA-C 115.06 0.784 . . . . 75.42 115.06 171.876 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . 0.433 ' HB2' ' HB3' ' A' ' 24' ' ' LEU . 14.3 mm-40 -91.02 50.71 1.82 Allowed 'General case' 0 CA--C 1.55 0.977 0 C-N-CA 124.649 1.18 . . . . 70.44 110.464 176.053 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 30' ' ' TRP . . . . . 0.602 ' HA ' HD13 ' A' ' 33' ' ' LEU . 75.3 m95 -64.55 -26.67 68.52 Favored 'General case' 0 N--CA 1.485 1.295 0 C-N-CA 123.204 0.601 . . . . 75.13 111.005 -178.257 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 8.8 m-20 -57.03 -42.81 81.13 Favored 'General case' 0 N--CA 1.478 0.927 0 C-N-CA 123.274 0.63 . . . . 63.22 110.393 172.98 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.448 HD12 HD22 ' A' ' 24' ' ' LEU . 76.1 mt -72.08 -18.93 61.89 Favored 'General case' 0 CA--C 1.547 0.839 0 CA-C-N 116.237 -0.438 . . . . 72.42 111.354 -178.882 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . 0.714 ' HA ' HD22 ' A' ' 21' ' ' LEU . 10.2 mp -69.37 -46.95 65.73 Favored 'General case' 0 N--CA 1.485 1.307 0 N-CA-C 109.254 -0.647 . . . . 65.53 109.254 167.317 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 59.8 mt -61.41 -38.68 87.97 Favored 'General case' 0 N--CA 1.483 1.212 0 O-C-N 123.99 0.807 . . . . 74.21 111.306 179.291 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -69.05 -45.27 70.83 Favored 'General case' 0 N--CA 1.481 1.116 0 C-N-CA 123.955 0.902 . . . . 75.32 111.34 -179.996 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 36' ' ' GLN . . . . . 0.485 ' HB2' HD21 ' A' ' 21' ' ' LEU . 87.1 mm-40 -81.42 -15.35 55.4 Favored 'General case' 0 N--CA 1.487 1.423 0 C-N-CA 122.791 0.436 . . . . 63.14 111.634 -178.282 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . 0.464 ' HG3' ' HB3' ' A' ' 89' ' ' LEU . 24.1 tt0 -45.81 -65.97 0.47 Allowed 'General case' 0 N--CA 1.48 1.048 0 C-N-CA 124.849 1.259 . . . . 72.25 113.282 -176.559 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 48.9 t -61.62 -35.44 67.22 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.087 0 C-N-CA 123.682 0.793 . . . . 54.13 111.104 -170.472 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 49.1 m -65.57 -49.29 69.38 Favored 'General case' 0 CA--C 1.54 0.563 0 C-N-CA 123.788 0.835 . . . . 74.23 110.729 176.573 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 38.0 t80 -60.99 -40.51 93.74 Favored 'General case' 0 N--CA 1.48 1.032 0 C-N-CA 124.203 1.001 . . . . 74.14 110.982 -178.862 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . 0.672 ' HB3' HD21 ' A' ' 92' ' ' LEU . 69.7 mt -70.14 -48.31 57.96 Favored 'General case' 0 C--O 1.252 1.185 0 O-C-N 124.613 1.195 . . . . 75.4 111.761 -175.292 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 46.6 tt0 -63.27 -39.48 94.7 Favored 'General case' 0 CA--C 1.551 1.015 0 CA-C-N 115.592 -0.731 . . . . 72.45 109.831 177.644 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . 0.561 ' O ' HG23 ' A' ' 47' ' ' VAL . 67.2 m -61.96 -56.39 19.61 Favored 'General case' 0 C--N 1.356 0.862 0 C-N-CA 123.28 0.632 . . . . 51.54 111.022 178.27 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 44' ' ' ILE . . . . . 0.441 HG13 HD13 ' A' ' 14' ' ' ILE . 11.5 tt -58.04 -42.16 82.18 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.36 0 C-N-CA 123.729 0.812 . . . . 52.04 110.977 -173.756 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 72.1 mm-40 -60.81 -48.45 81.75 Favored 'General case' 0 C--N 1.362 1.151 0 O-C-N 123.492 0.495 . . . . 54.33 111.272 175.174 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 66.9 m -57.06 -39.12 74.29 Favored 'General case' 0 N--CA 1.489 1.515 0 C-N-CA 122.991 0.516 . . . . 75.34 111.895 178.971 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 47' ' ' VAL . . . . . 0.587 HG22 ' HB3' ' A' ' 10' ' ' ARG . 43.3 t -65.98 -44.75 92.16 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.173 0 C-N-CA 123.302 0.641 . . . . 45.54 110.377 -178.479 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 48' ' ' MET . . . . . 0.562 ' SD ' ' HB2' ' A' ' 101' ' ' SER . 75.2 mtm -69.75 -27.23 64.77 Favored 'General case' 0 N--CA 1.485 1.276 0 CA-C-N 116.093 -0.503 . . . . 70.1 111.8 179.221 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 38.5 mt-10 -71.22 -24.47 62.21 Favored 'General case' 0 N--CA 1.481 1.107 0 C-N-CA 123.037 0.535 . . . . 74.2 111.319 173.868 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -87.04 142.5 27.89 Favored 'General case' 0 N--CA 1.478 0.974 0 C-N-CA 123.203 0.601 . . . . 73.43 110.28 -178.944 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 8.8 tt0 -85.56 158.52 20.11 Favored 'General case' 0 N--CA 1.474 0.755 0 C-N-CA 123.761 0.824 . . . . 72.12 110.017 -178.921 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 52' ' ' THR . . . . . 0.451 ' OG1' ' HB3' ' A' ' 114' ' ' LEU . 22.0 m -78.36 129.87 73.52 Favored Pre-proline 0 CA--C 1.546 0.823 0 C-N-CA 123.119 0.567 . . . . 72.13 110.263 175.514 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 53' ' ' PRO . . . . . 0.51 ' HG3' ' HA ' ' A' ' 4' ' ' THR . 56.8 Cg_endo -67.01 157.88 59.56 Favored 'Trans proline' 0 C--N 1.376 2.022 0 C-N-CA 123.2 2.6 . . . . 54.31 112.652 177.754 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 38.8 Cg_endo -65.49 -45.54 6.83 Favored 'Trans proline' 0 C--N 1.375 1.948 0 C-N-CA 122.843 2.362 . . . . 72.2 112.75 176.397 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . -69.2 78.8 0.3 Allowed Glycine 0 C--N 1.359 1.843 0 O-C-N 123.765 0.666 . . . . 63.51 114.054 -175.488 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 23.8 mm -117.91 136.39 55.26 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.575 0 C-N-CA 124.752 1.221 . . . . 71.44 108.337 178.444 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 72.2 p -106.66 179.12 4.36 Favored 'General case' 0 N--CA 1.473 0.717 0 N-CA-C 108.537 -0.912 . . . . 50.21 108.537 168.121 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 29.8 tpt180 -65.96 -43.36 88.16 Favored 'General case' 0 CA--C 1.54 0.588 0 N-CA-C 109.819 -0.437 . . . . 72.24 109.819 174.549 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 71.4 p -62.64 -42.45 99.61 Favored 'General case' 0 CA--C 1.545 0.762 0 C-N-CA 123.5 0.72 . . . . 71.4 110.934 -179.544 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 60' ' ' ILE . . . . . 0.515 HD13 HG21 ' A' ' 4' ' ' THR . 93.9 mt -59.81 -45.65 94.56 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.019 0 C-N-CA 123.806 0.842 . . . . 61.1 110.513 173.762 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 64.5 tt0 -59.91 -37.39 79.28 Favored 'General case' 0 N--CA 1.478 0.932 0 C-N-CA 123.875 0.87 . . . . 74.24 111.104 179.657 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 70.5 m-20 -71.21 -39.44 71.74 Favored 'General case' 0 N--CA 1.481 1.112 0 C-N-CA 123.383 0.673 . . . . 61.11 111.02 179.085 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 63' ' ' MET . . . . . . . . . . . . . 71.0 mtm -71.31 -41.58 69.72 Favored 'General case' 0 N--CA 1.481 1.099 0 C-N-CA 122.923 0.489 . . . . 54.44 111.649 -178.997 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 64' ' ' VAL . . . . . 0.456 ' O ' HG13 ' A' ' 68' ' ' ILE . 85.8 t -67.9 -55.69 15.8 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.755 0 N-CA-C 109.531 -0.544 . . . . 54.01 109.531 179.497 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . 0.594 ' HB2' HD23 ' A' ' 109' ' ' LEU . . . -63.07 -28.38 70.04 Favored 'General case' 0 N--CA 1.488 1.472 0 O-C-N 123.351 0.407 . . . . 54.01 110.849 178.594 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -67.02 -40.79 93.32 Favored Glycine 0 C--N 1.35 1.345 0 O-C-N 123.562 0.539 . . . . 53.22 112.519 175.531 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 16.6 m-30 -72.54 -38.82 67.91 Favored 'General case' 0 N--CA 1.48 1.074 0 C-N-CA 123.328 0.651 . . . . 65.53 110.988 178.189 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 68' ' ' ILE . . . . . 0.558 ' O ' ' HG ' ' A' ' 72' ' ' LEU . 78.3 mt -57.96 -50.43 77.93 Favored 'Isoleucine or valine' 0 C--N 1.353 0.736 0 O-C-N 124.575 1.172 . . . . 41.31 108.361 173.783 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 69' ' ' LYS . . . . . 0.597 ' HB2' ' HE2' ' A' ' 106' ' ' TYR . 0.7 OUTLIER -57.83 -49.07 77.92 Favored 'General case' 0 C--N 1.353 0.757 0 C-N-CA 123.886 0.874 . . . . 73.14 110.673 -178.847 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 70' ' ' GLN . . . . . 0.502 ' NE2' HE21 ' A' ' 19' ' ' GLN . 58.9 tt0 -58.25 -44.88 88.53 Favored 'General case' 0 N--CA 1.471 0.593 0 O-C-N 124.705 1.253 . . . . 75.51 110.784 -176.984 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 71' ' ' THR . . . . . 0.569 ' HB ' ' HA ' ' A' ' 15' ' ' ALA . 12.8 t -76.93 -22.43 53.31 Favored 'General case' 0 C--O 1.21 -0.999 0 CA-C-O 118.846 -0.597 . . . . 73.31 110.344 -177.965 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 72' ' ' LEU . . . . . 0.731 HD21 ' HB3' ' A' ' 102' ' ' LEU . 40.5 mt -72.23 -32.98 67.21 Favored 'General case' 0 N--CA 1.49 1.57 0 CA-C-N 118.136 0.426 . . . . 75.5 110.789 173.5 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 38.8 m-20 -64.13 -49.87 70.47 Favored 'General case' 0 N--CA 1.477 0.91 0 N-CA-C 108.542 -0.91 . . . . 61.31 108.542 172.071 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 70.5 m-20 -62.28 -37.08 84.12 Favored 'General case' 0 N--CA 1.478 0.964 0 CA-C-N 115.037 -0.983 . . . . 71.3 111.566 179.96 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . 0.435 ' HG2' ' O ' ' A' ' 71' ' ' THR . 17.2 mm-40 -66.47 -51.62 54.89 Favored 'General case' 0 N--CA 1.481 1.094 0 C-N-CA 123.316 0.646 . . . . 54.35 110.275 178.667 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 9.1 tt0 -58.09 -48.85 78.9 Favored 'General case' 0 N--CA 1.475 0.818 0 O-C-N 123.492 0.495 . . . . 75.3 110.807 -177.778 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 96.8 mt -63.63 -57.13 11.03 Favored 'General case' 0 N--CA 1.471 0.625 0 O-C-N 123.975 0.797 . . . . 73.52 111.043 -176.959 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . 0.721 HD21 ' HA ' ' A' ' 22' ' ' LEU . 82.4 mt -63.54 -66.47 0.54 Allowed 'General case' 0 N--CA 1.481 1.107 0 O-C-N 123.553 0.533 . . . . 73.41 111.785 -178.514 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 33.0 mmtp -59.54 -35.15 73.66 Favored 'General case' 0 N--CA 1.475 0.793 0 O-C-N 124.219 0.95 . . . . 71.22 110.928 -173.808 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -66.69 -40.26 93.91 Favored Glycine 0 C--N 1.355 1.606 0 O-C-N 123.526 0.516 . . . . 71.41 113.019 175.069 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 8.2 tt -66.21 -36.96 84.42 Favored 'General case' 0 N--CA 1.485 1.322 0 C-N-CA 123.465 0.706 . . . . 75.24 109.737 177.092 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 95.1 mt -77.73 -36.76 50.53 Favored 'General case' 0 N--CA 1.473 0.71 0 C-N-CA 123.955 0.902 . . . . 73.31 111.328 -175.516 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 8.1 tt0 -168.98 -74.34 0.02 OUTLIER 'General case' 0 N--CA 1.477 0.901 0 C-N-CA 123.657 0.783 . . . . 75.23 109.714 177.796 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 73.9 mm-40 -157.17 168.0 28.73 Favored 'General case' 0 N--CA 1.489 1.475 0 C-N-CA 125.709 1.603 . . . . 74.52 108.309 -178.457 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 85' ' ' ARG . . . . . . . . . . . . . 81.4 mtm-85 -65.1 82.91 0.04 OUTLIER 'General case' 0 N--CA 1.486 1.338 0 C-N-CA 123.248 0.619 . . . . 74.31 111.042 -178.846 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 86' ' ' LEU . . . . . 0.699 HD21 ' HA ' ' A' ' 96' ' ' SER . 9.4 mt -174.58 151.85 1.57 Allowed 'General case' 0 N--CA 1.476 0.861 0 C-N-CA 126.24 1.816 . . . . 70.42 107.678 -179.951 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 87' ' ' ASP . . . . . 0.503 ' HB2' ' NH1' ' A' ' 98' ' ' ARG . 2.6 m-20 -76.58 84.58 3.25 Favored 'General case' 0 C--O 1.242 0.677 0 N-CA-C 108.707 -0.849 . . . . 63.23 108.707 177.169 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -74.03 -16.66 61.04 Favored 'General case' 0 CA--C 1.547 0.827 0 CA-C-N 114.76 -1.109 . . . . 75.3 109.702 169.158 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . 0.464 ' HB3' ' HG3' ' A' ' 37' ' ' GLU . 88.4 mt -49.54 -49.51 45.8 Favored 'General case' 0 C--N 1.358 0.96 0 C-N-CA 124.42 1.088 . . . . 73.3 110.234 168.154 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 90' ' ' SER . . . . . 0.415 ' HB3' ' CD1' ' A' ' 41' ' ' LEU . 31.3 t -169.64 129.36 1.0 Allowed 'General case' 0 CA--C 1.542 0.648 0 CA-C-N 114.651 -1.159 . . . . 43.1 108.242 172.682 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 19.8 m -69.6 111.44 5.41 Favored 'General case' 0 CA--C 1.539 0.552 0 C-N-CA 123.702 0.801 . . . . 73.05 109.83 -177.0 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 92' ' ' LEU . . . . . 0.672 HD21 ' HB3' ' A' ' 41' ' ' LEU . 94.7 mt -67.81 -75.43 0.1 Allowed 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 124.238 1.015 . . . . 63.44 110.607 -179.447 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 42.6 mt -124.46 65.87 0.3 Allowed 'Isoleucine or valine' 0 CA--C 1.546 0.811 0 N-CA-C 107.537 -1.282 . . . . 71.24 107.537 172.621 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 48.39 -87.53 0.01 OUTLIER Glycine 0 C--N 1.363 2.081 0 CA-C-N 114.219 -1.355 . . . . 65.24 115.157 172.322 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 5.8 pm0 -66.49 -173.52 0.22 Allowed 'General case' 0 N--CA 1.477 0.878 0 C-N-CA 124.564 1.145 . . . . 74.1 111.461 178.628 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 96' ' ' SER . . . . . 0.699 ' HA ' HD21 ' A' ' 86' ' ' LEU . 44.5 m -80.42 38.57 0.43 Allowed 'General case' 0 CA--C 1.545 0.78 0 N-CA-C 113.289 0.848 . . . . 60.31 113.289 -173.037 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 39.1 m -49.48 -61.12 2.28 Favored 'General case' 0 N--CA 1.48 1.026 0 C-N-CA 124.014 0.926 . . . . 64.42 110.828 173.028 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 98' ' ' ARG . . . . . 0.642 ' HD2' ' HB2' ' A' ' 92' ' ' LEU . 0.0 OUTLIER -47.62 -56.07 7.99 Favored 'General case' 0 CA--C 1.552 1.036 0 C-N-CA 125.955 1.702 . . . . 74.42 113.533 178.306 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 31.0 mm-40 -66.28 -43.65 85.78 Favored 'General case' 0 N--CA 1.482 1.157 0 C-N-CA 122.968 0.507 . . . . 74.52 111.068 -175.375 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 13.8 tmtt? -63.36 -38.13 89.97 Favored 'General case' 0 C--O 1.217 -0.629 0 CA-C-N 114.897 -1.047 . . . . 74.02 110.638 178.579 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 101' ' ' SER . . . . . 0.562 ' HB2' ' SD ' ' A' ' 48' ' ' MET . 73.1 m -78.33 -32.15 49.06 Favored 'General case' 0 N--CA 1.479 0.981 0 C-N-CA 123.08 0.552 . . . . 74.11 112.076 -172.9 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 102' ' ' LEU . . . . . 0.731 ' HB3' HD21 ' A' ' 72' ' ' LEU . 10.0 mp -71.29 -43.3 67.41 Favored 'General case' 0 N--CA 1.483 1.184 0 N-CA-C 110.074 -0.343 . . . . 62.11 110.074 172.561 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 8.9 t30 -64.08 -41.01 97.47 Favored 'General case' 0 N--CA 1.481 1.079 0 CA-C-O 121.159 0.504 . . . . 75.23 110.507 176.625 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 7.2 t30 -64.05 -39.3 93.77 Favored 'General case' 0 N--CA 1.478 0.958 0 C-N-CA 124.397 1.079 . . . . 75.22 109.469 176.54 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -59.41 -48.39 81.82 Favored 'General case' 0 C--N 1.347 0.467 0 O-C-N 124.049 0.843 . . . . 74.32 110.444 178.598 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 106' ' ' TYR . . . . . 0.597 ' HE2' ' HB2' ' A' ' 69' ' ' LYS . 20.0 t80 -59.47 -56.32 23.44 Favored 'General case' 0 CA--C 1.55 0.957 0 O-C-N 123.867 0.73 . . . . 73.1 111.074 179.8 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -69.0 -41.01 83.62 Favored Glycine 0 C--N 1.347 1.194 0 O-C-N 123.989 0.805 . . . . 70.34 113.302 -171.272 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 5.5 mmp_? -68.91 -33.91 74.53 Favored 'General case' 0 C--N 1.349 0.578 0 CA-C-O 119.258 -0.401 . . . . 65.2 110.455 177.42 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 109' ' ' LEU . . . . . 0.594 HD23 ' HB2' ' A' ' 65' ' ' ALA . 47.3 tp -61.56 -44.8 96.37 Favored 'General case' 0 N--CA 1.482 1.162 0 CA-C-O 120.888 0.375 . . . . 61.0 110.301 175.388 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 10.9 t -69.58 -34.28 73.91 Favored 'General case' 0 CA--C 1.554 1.127 0 CA-C-N 114.749 -1.114 . . . . 51.2 110.938 -179.043 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . -91.2 -63.27 1.19 Allowed Glycine 0 C--N 1.357 1.735 0 N-CA-C 114.454 0.542 . . . . 63.24 114.454 -177.649 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 112' ' ' MET . . . . . . . . . . . . . 3.8 mmm -93.13 -68.92 0.77 Allowed 'General case' 0 N--CA 1.489 1.481 0 CA-C-N 117.454 0.627 . . . . 72.31 112.021 -178.578 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 113' ' ' LEU . . . . . 0.525 HD22 ' H ' ' A' ' 120' ' ' GLY . 23.8 tp 174.01 13.41 0.0 OUTLIER 'General case' 0 N--CA 1.492 1.635 0 C-N-CA 125.172 1.389 . . . . 61.32 110.018 178.28 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 114' ' ' LEU . . . . . 0.451 ' HB3' ' OG1' ' A' ' 52' ' ' THR . 2.5 tt 83.0 -24.54 0.17 Allowed 'General case' 0 N--CA 1.5 2.063 0 C-N-CA 126.683 1.993 . . . . 52.15 109.842 -170.321 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 115' ' ' VAL . . . . . . . . . . . . . 7.2 p -113.17 135.96 21.77 Favored Pre-proline 0 CA--C 1.548 0.884 0 N-CA-C 107.097 -1.446 . . . . 73.42 107.097 176.167 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 97.5 Cg_endo -78.2 30.25 0.45 Allowed 'Trans proline' 0 C--N 1.376 1.985 0 C-N-CA 122.623 2.215 . . . . 71.51 113.218 178.21 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 26.8 t70 -85.72 -82.27 0.19 Allowed 'General case' 0 CA--C 1.549 0.934 0 C-N-CA 123.643 0.777 . . . . 73.12 110.747 -175.884 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -155.73 128.79 4.31 Favored Pre-proline 0 CA--C 1.546 0.794 0 C-N-CA 123.555 0.742 . . . . 62.15 109.037 -177.527 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 119' ' ' PRO . . . . . . . . . . . . . 48.5 Cg_endo -68.31 101.71 0.75 Allowed 'Trans proline' 0 C--N 1.377 2.045 0 C-N-CA 122.417 2.078 . . . . 62.43 111.587 179.46 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 120' ' ' GLY . . . . . 0.525 ' H ' HD22 ' A' ' 113' ' ' LEU . . . -113.99 18.42 19.05 Favored Glycine 0 C--N 1.347 1.15 0 CA-C-N 115.803 -0.635 . . . . 75.24 113.128 -178.77 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . -71.6 105.49 3.68 Favored 'General case' 0 CA--C 1.546 0.807 0 N-CA-C 109.877 -0.416 . . . . 53.53 109.877 177.827 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 122' ' ' SER . . . . . . . . . . . . . 48.8 m . . . . . 0 C--O 1.249 1.05 0 N-CA-C 109.253 -0.647 . . . . 51.14 109.253 177.431 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . 0.45 ' HG3' HG23 ' A' ' 5' ' ' VAL . 16.7 ptt? . . . . . 0 N--CA 1.486 1.329 0 CA-C-O 120.683 0.278 . . . . 72.1 110.65 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 9.2 t -54.6 -40.32 68.74 Favored 'General case' 0 N--CA 1.483 1.216 0 C-N-CA 123.353 0.661 . . . . 74.22 112.725 -172.766 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 17.2 m -72.46 -32.42 66.23 Favored 'General case' 0 N--CA 1.479 1.019 0 C-N-CA 123.247 0.619 . . . . 73.03 111.4 -178.758 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 52.5 m -74.57 -39.11 62.45 Favored 'General case' 0 C--O 1.217 -0.64 0 C-N-CA 123.07 0.548 . . . . 53.41 110.295 178.233 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . 0.45 HG23 ' HG3' ' A' ' 1' ' ' MET . 90.2 t -63.77 -40.48 89.2 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.905 0 C-N-CA 123.309 0.644 . . . . 64.04 109.297 176.581 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 33.9 mm-40 -57.1 -51.98 67.11 Favored 'General case' 0 N--CA 1.473 0.685 0 O-C-N 123.939 0.774 . . . . 63.34 110.625 171.228 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 42.6 t80 -61.88 -43.86 97.99 Favored 'General case' 0 CA--C 1.552 1.027 0 C-N-CA 124.106 0.962 . . . . 74.22 111.337 -173.464 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . 0.445 HD11 HG23 ' A' ' 60' ' ' ILE . 77.5 mt -63.84 -45.19 97.76 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.873 0 C-N-CA 123.772 0.829 . . . . 64.01 109.357 176.473 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 28.5 t-20 -67.09 -27.41 67.33 Favored 'General case' 0 N--CA 1.479 0.991 0 C-N-CA 123.834 0.854 . . . . 75.35 111.54 -177.25 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . 0.536 ' HB3' HG22 ' A' ' 47' ' ' VAL . 50.8 mtt180 -81.46 -28.02 34.34 Favored 'General case' 0 CA--C 1.543 0.684 0 C-N-CA 123.394 0.678 . . . . 74.24 110.191 176.477 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' TRP . . . . . . . . . . . . . 61.2 m95 -74.53 -28.21 60.87 Favored 'General case' 0 N--CA 1.474 0.774 0 CA-C-O 119.313 -0.375 . . . . 73.25 110.828 167.663 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . 0.49 ' HG2' ' CE2' ' A' ' 67' ' ' TYR . 41.1 mt-30 -67.52 -38.79 84.76 Favored 'General case' 0 C--N 1.358 0.956 0 N-CA-C 108.064 -1.087 . . . . 62.31 108.064 170.165 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 32.2 tpt180 -57.1 -55.54 33.38 Favored 'General case' 0 CA--C 1.542 0.643 0 CA-C-N 115.328 -0.851 . . . . 73.43 109.984 179.753 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' ILE . . . . . 0.431 HG22 ' OG1' ' A' ' 71' ' ' THR . 19.1 mt -64.81 -45.97 93.41 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.357 0 O-C-N 122.938 0.148 . . . . 73.25 111.001 179.806 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . 0.601 ' HA ' ' HB ' ' A' ' 71' ' ' THR . . . -58.05 -48.52 79.84 Favored 'General case' 0 N--CA 1.487 1.399 0 C-N-CA 124.406 1.082 . . . . 64.31 112.154 -176.426 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 87.0 mt -78.64 -37.44 42.09 Favored 'General case' 0 N--CA 1.48 1.051 0 CA-C-N 114.902 -1.045 . . . . 73.53 110.903 -173.085 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.508 ' O ' ' HG ' ' A' ' 21' ' ' LEU . 59.0 mt -62.46 -48.1 81.12 Favored 'General case' 0 N--CA 1.479 0.976 0 O-C-N 123.344 0.403 . . . . 70.34 110.461 176.816 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 78.5 p -64.63 -38.34 90.68 Favored 'General case' 0 N--CA 1.475 0.808 0 C-N-CA 123.01 0.524 . . . . 62.55 111.125 -179.804 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 7.0 tp-100 -60.83 -42.33 97.52 Favored 'General case' 0 C--N 1.354 0.782 0 O-C-N 123.704 0.628 . . . . 64.14 110.625 175.207 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 48.6 m -60.89 -48.77 80.31 Favored 'General case' 0 C--N 1.346 0.441 0 O-C-N 123.391 0.432 . . . . 65.33 110.071 175.611 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . 0.549 HD22 ' HA ' ' A' ' 33' ' ' LEU . 59.2 mt -64.8 -26.91 68.55 Favored 'General case' 0 N--CA 1.471 0.624 0 C-N-CA 123.62 0.768 . . . . 71.41 110.836 -178.114 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.636 ' HA ' HD21 ' A' ' 78' ' ' LEU . 46.0 tp -68.07 -58.35 4.64 Favored 'General case' 0 C--N 1.35 0.599 0 C-N-CA 123.376 0.67 . . . . 71.43 109.564 176.767 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 41.0 mt-10 -53.91 -46.03 71.34 Favored 'General case' 0 N--CA 1.48 1.031 0 C-N-CA 124.147 0.979 . . . . 75.24 111.073 -179.955 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.5 ' HB3' ' HB2' ' A' ' 29' ' ' GLU . 96.0 mt -67.08 -46.89 72.9 Favored 'General case' 0 CA--C 1.538 0.511 0 CA-C-N 114.661 -1.154 . . . . 43.53 111.455 -176.623 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . 0.435 ' HB2' HD21 ' A' ' 33' ' ' LEU . . . -64.16 -34.25 77.65 Favored 'General case' 0 N--CA 1.484 1.25 0 CA-C-N 117.971 0.351 . . . . 63.11 111.501 -179.555 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 98.0 mt-30 -63.65 -38.43 91.09 Favored 'General case' 0 N--CA 1.482 1.143 0 C-N-CA 123.333 0.653 . . . . 64.5 110.61 173.681 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 97.2 mtt180 -75.78 -17.39 59.89 Favored 'General case' 0 N--CA 1.483 1.197 0 C-N-CA 123.161 0.584 . . . . 70.21 111.868 174.775 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 92.3 20.79 34.31 Favored Glycine 0 C--N 1.346 1.127 0 N-CA-C 112.727 -0.149 . . . . 10.3 112.727 179.078 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . 0.5 ' HB2' ' HB3' ' A' ' 24' ' ' LEU . 49.3 mm-40 -84.54 68.77 10.44 Favored 'General case' 0 C--O 1.238 0.452 0 C-N-CA 124.312 1.045 . . . . 74.42 110.871 -179.775 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 30' ' ' TRP . . . . . . . . . . . . . 24.8 m95 -63.68 -42.18 98.07 Favored 'General case' 0 N--CA 1.475 0.788 0 CA-C-N 115.114 -0.948 . . . . 74.21 111.097 -176.134 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 9.8 m-20 -60.62 -41.68 95.33 Favored 'General case' 0 N--CA 1.478 0.971 0 C-N-CA 123.48 0.712 . . . . 74.22 110.893 -178.813 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.503 HD23 ' NE2' ' A' ' 35' ' ' GLN . 72.6 mt -64.47 -37.03 86.11 Favored 'General case' 0 N--CA 1.478 0.941 0 O-C-N 123.61 0.569 . . . . 62.34 111.211 -178.907 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . 0.549 ' HA ' HD22 ' A' ' 21' ' ' LEU . 10.7 mp -61.74 -46.92 87.54 Favored 'General case' 0 N--CA 1.486 1.325 0 CA-C-O 120.719 0.295 . . . . 74.12 110.24 172.365 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 91.2 mt -67.66 -26.97 66.47 Favored 'General case' 0 CA--C 1.549 0.915 0 C-N-CA 123.482 0.713 . . . . 64.4 112.18 -177.227 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 35' ' ' GLN . . . . . 0.503 ' NE2' HD23 ' A' ' 32' ' ' LEU . 48.5 mt-30 -77.96 -36.78 48.72 Favored 'General case' 0 N--CA 1.48 1.035 0 C-N-CA 123.304 0.642 . . . . 74.13 110.619 176.705 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 30.9 mm-40 -82.79 -15.24 52.47 Favored 'General case' 0 N--CA 1.483 1.188 0 C-N-CA 123.09 0.556 . . . . 70.21 111.532 177.931 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . 0.428 ' O ' ' HG ' ' A' ' 41' ' ' LEU . 31.8 tt0 -45.49 -57.47 4.1 Favored 'General case' 0 N--CA 1.481 1.086 0 C-N-CA 124.681 1.192 . . . . 73.51 112.972 -174.823 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 46.1 t -58.04 -39.88 74.31 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.143 0 C-N-CA 123.344 0.658 . . . . 74.55 111.378 -175.514 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 74.3 m -68.38 -43.7 76.78 Favored 'General case' 0 N--CA 1.474 0.739 0 C-N-CA 123.097 0.559 . . . . 72.13 111.272 179.189 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 40' ' ' TYR . . . . . 0.408 ' O ' HG22 ' A' ' 44' ' ' ILE . 34.9 t80 -64.96 -47.51 77.36 Favored 'General case' 0 N--CA 1.471 0.61 0 O-C-N 123.824 0.703 . . . . 71.1 110.059 -177.128 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . 0.428 ' HG ' ' O ' ' A' ' 37' ' ' GLU . 57.8 mt -59.81 -50.53 73.46 Favored 'General case' 0 C--N 1.351 0.667 0 O-C-N 124.636 1.21 . . . . 73.24 110.082 178.952 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 53.4 tt0 -60.22 -41.72 93.69 Favored 'General case' 0 N--CA 1.476 0.87 0 O-C-N 123.637 0.585 . . . . 72.34 111.497 -178.442 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . 0.487 ' O ' HG23 ' A' ' 47' ' ' VAL . 70.2 m -60.85 -60.38 3.88 Favored 'General case' 0 N--CA 1.471 0.591 0 C-N-CA 123.169 0.588 . . . . 75.31 110.641 -179.102 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 44' ' ' ILE . . . . . 0.458 HG12 ' HE2' ' A' ' 48' ' ' MET . 16.3 tt -63.37 -30.33 49.5 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.977 0 O-C-N 123.808 0.692 . . . . 72.42 111.321 -175.57 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 9.6 mm-40 -59.38 -55.12 38.7 Favored 'General case' 0 N--CA 1.481 1.103 0 C-N-CA 123.301 0.64 . . . . 65.41 110.796 171.226 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 46' ' ' THR . . . . . 0.411 ' O ' ' HB2' ' A' ' 50' ' ' LYS . 19.9 m -67.18 -23.8 65.8 Favored 'General case' 0 CA--C 1.55 0.967 0 CA-C-N 115.656 -0.702 . . . . 71.11 111.652 -174.369 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 47' ' ' VAL . . . . . 0.536 HG22 ' HB3' ' A' ' 10' ' ' ARG . 40.4 t -83.28 -35.82 12.2 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.086 0 C-N-CA 122.618 0.367 . . . . 72.33 111.143 176.532 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 48' ' ' MET . . . . . 0.458 ' HE2' HG12 ' A' ' 44' ' ' ILE . 74.6 mtm -70.13 -34.93 73.69 Favored 'General case' 0 N--CA 1.49 1.567 0 C-N-CA 122.504 0.321 . . . . 54.52 111.476 179.398 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 10.9 pt-20 -78.01 -22.53 49.16 Favored 'General case' 0 N--CA 1.478 0.964 0 C-N-CA 122.347 0.259 . . . . 74.22 110.443 175.776 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . 0.411 ' HB2' ' O ' ' A' ' 46' ' ' THR . 15.0 tppt? -69.21 133.77 48.39 Favored 'General case' 0 N--CA 1.473 0.686 0 C-N-CA 123.61 0.764 . . . . 74.04 111.117 -174.207 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 8.3 tt0 -83.72 128.41 34.51 Favored 'General case' 0 C--O 1.239 0.535 0 N-CA-C 108.886 -0.783 . . . . 71.14 108.886 174.757 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 17.1 m -70.36 134.29 86.95 Favored Pre-proline 0 CA--C 1.551 0.99 0 C-N-CA 124.058 0.943 . . . . 62.45 110.658 178.995 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 24.2 Cg_exo -66.5 152.52 80.65 Favored 'Trans proline' 0 C--N 1.378 2.089 0 C-N-CA 121.908 1.739 . . . . 74.55 111.961 171.954 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 21.3 Cg_exo -67.36 -46.78 2.61 Favored 'Trans proline' 0 C--N 1.372 1.809 0 C-N-CA 122.998 2.465 . . . . 64.11 111.685 173.354 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . -66.22 81.28 0.1 Allowed Glycine 0 C--N 1.351 1.396 0 O-C-N 124.112 0.882 . . . . 61.01 113.455 -178.651 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 56' ' ' ILE . . . . . 0.553 ' HB ' HD11 ' A' ' 113' ' ' LEU . 6.9 mt -137.87 117.6 15.37 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.515 0 C-N-CA 125.54 1.536 . . . . 75.12 107.702 178.325 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 57' ' ' THR . . . . . 0.499 ' H ' HD12 ' A' ' 60' ' ' ILE . 47.4 p -78.01 -178.26 5.44 Favored 'General case' 0 N--CA 1.473 0.682 0 C-N-CA 123.863 0.865 . . . . 71.45 110.482 -179.271 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 28.4 tpt180 -65.19 -45.17 85.88 Favored 'General case' 0 CA--C 1.542 0.644 0 CA-C-N 116.248 -0.433 . . . . 71.44 110.019 174.881 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 40.3 m -58.53 -42.46 87.82 Favored 'General case' 0 N--CA 1.485 1.276 0 CA-C-O 121.405 0.621 . . . . 71.52 111.096 179.732 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 60' ' ' ILE . . . . . 0.499 HD12 ' H ' ' A' ' 57' ' ' THR . 83.7 mt -66.68 -41.19 87.73 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.522 0 CA-C-N 115.073 -0.967 . . . . 62.04 110.104 178.25 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 58.9 tt0 -62.17 -36.22 81.19 Favored 'General case' 0 CA--C 1.547 0.844 0 C-N-CA 123.393 0.677 . . . . 73.44 110.43 177.332 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 65.9 m-20 -66.05 -46.55 77.39 Favored 'General case' 0 N--CA 1.48 1.057 0 C-N-CA 123.288 0.635 . . . . 65.41 110.764 178.518 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 63' ' ' MET . . . . . . . . . . . . . 71.1 mtm -65.74 -51.9 55.5 Favored 'General case' 0 N--CA 1.482 1.175 0 O-C-N 123.557 0.536 . . . . 43.41 111.16 -179.007 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 64' ' ' VAL . . . . . 0.516 ' O ' HG13 ' A' ' 68' ' ' ILE . 77.1 t -57.98 -56.17 17.41 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.725 0 C-N-CA 123.955 0.902 . . . . 64.32 110.809 179.997 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . 0.482 ' HB2' HD23 ' A' ' 109' ' ' LEU . . . -59.14 -42.2 90.13 Favored 'General case' 0 N--CA 1.487 1.41 0 C-N-CA 123.05 0.54 . . . . 33.52 110.767 179.837 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -56.34 -42.69 89.36 Favored Glycine 0 C--N 1.344 1.026 0 O-C-N 124.153 0.908 . . . . 34.02 112.12 176.814 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 67' ' ' TYR . . . . . 0.49 ' CE2' ' HG2' ' A' ' 12' ' ' GLN . 16.7 m-30 -70.7 -37.79 73.6 Favored 'General case' 0 N--CA 1.478 0.945 0 C-N-CA 123.847 0.859 . . . . 75.03 111.946 179.09 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 68' ' ' ILE . . . . . 0.516 HG13 ' O ' ' A' ' 64' ' ' VAL . 64.7 mt -58.44 -58.88 4.69 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.027 0 O-C-N 124.169 0.918 . . . . 75.34 108.851 179.185 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 69' ' ' LYS . . . . . 0.482 ' HB2' ' HE2' ' A' ' 106' ' ' TYR . 20.1 ttpp -60.63 -41.12 94.23 Favored 'General case' 0 C--N 1.347 0.462 0 O-C-N 124.151 0.907 . . . . 61.42 110.243 -179.143 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 62.3 tt0 -57.02 -47.98 79.59 Favored 'General case' 0 N--CA 1.478 0.95 0 C-N-CA 123.538 0.735 . . . . 71.21 111.406 -178.788 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 71' ' ' THR . . . . . 0.601 ' HB ' ' HA ' ' A' ' 15' ' ' ALA . 9.1 t -77.64 -25.47 49.7 Favored 'General case' 0 C--N 1.351 0.647 0 N-CA-C 110.07 -0.345 . . . . 73.53 110.07 -175.469 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 72' ' ' LEU . . . . . 0.475 ' HG ' ' O ' ' A' ' 68' ' ' ILE . 37.5 mt -67.75 -38.8 83.95 Favored 'General case' 0 C--O 1.209 -1.07 0 O-C-N 123.507 0.504 . . . . 74.21 110.107 171.026 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 75.2 m-20 -73.62 -41.22 63.08 Favored 'General case' 0 N--CA 1.484 1.234 0 C-N-CA 123.53 0.732 . . . . 65.22 110.995 -178.544 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 74' ' ' ASN . . . . . 0.437 ' HA ' HD22 ' A' ' 22' ' ' LEU . 86.4 m-20 -61.79 -52.11 65.55 Favored 'General case' 0 N--CA 1.475 0.804 0 O-C-N 123.911 0.757 . . . . 63.33 109.558 178.491 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . 0.421 ' O ' ' HG2' ' A' ' 79' ' ' LYS . 17.3 tt0 -76.58 -19.22 58.11 Favored 'General case' 0 CA--C 1.552 1.042 0 CA-C-N 115.642 -0.708 . . . . 73.22 111.688 -178.101 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 9.8 tt0 -68.65 -46.74 68.37 Favored 'General case' 0 N--CA 1.488 1.448 0 N-CA-C 109.547 -0.538 . . . . 75.05 109.547 173.6 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 92.3 mt -61.26 -38.87 88.26 Favored 'General case' 0 C--N 1.346 0.449 0 CA-C-N 115.661 -0.699 . . . . 60.2 109.623 174.449 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . 0.636 HD21 ' HA ' ' A' ' 22' ' ' LEU . 50.3 mt -59.07 -42.64 90.87 Favored 'General case' 0 C--N 1.358 0.962 0 O-C-N 123.92 0.762 . . . . 75.12 111.833 172.805 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 79' ' ' LYS . . . . . 0.432 ' HD2' HD23 ' A' ' 86' ' ' LEU . 28.9 mmtm -57.08 -47.15 81.71 Favored 'General case' 0 N--CA 1.482 1.135 0 N-CA-C 109.735 -0.469 . . . . 74.02 109.735 176.608 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 80' ' ' GLY . . . . . 0.707 ' HA2' ' HA ' ' A' ' 84' ' ' GLN . . . -67.6 -28.75 73.56 Favored Glycine 0 C--N 1.344 0.998 0 O-C-N 124.518 1.136 . . . . 40.35 114.17 178.754 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 5.8 tt -85.43 -39.56 17.4 Favored 'General case' 0 N--CA 1.478 0.925 0 C-N-CA 124.309 1.044 . . . . 72.51 110.528 -173.279 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 67.5 mt -84.23 -43.39 14.94 Favored 'General case' 0 CA--C 1.548 0.885 0 C-N-CA 123.704 0.801 . . . . 72.24 111.265 -169.847 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 21.8 tp60 -151.48 1.29 0.38 Allowed 'General case' 0 N--CA 1.493 1.69 0 N-CA-C 112.192 0.441 . . . . 71.12 112.192 -177.801 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 84' ' ' GLN . . . . . 0.707 ' HA ' ' HA2' ' A' ' 80' ' ' GLY . 23.4 mt-30 62.65 19.25 11.21 Favored 'General case' 0 N--CA 1.491 1.584 0 C-N-CA 124.188 0.995 . . . . 70.51 111.267 -169.929 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 85' ' ' ARG . . . . . . . . . . . . . 34.2 ttt180 -165.17 172.72 12.17 Favored 'General case' 0 CA--C 1.55 0.966 0 C-N-CA 123.456 0.702 . . . . 74.52 109.658 -168.143 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 86' ' ' LEU . . . . . 0.432 HD23 ' HD2' ' A' ' 79' ' ' LYS . 89.9 mt -57.94 97.88 0.03 OUTLIER 'General case' 0 C--N 1.356 0.875 0 C-N-CA 124.578 1.151 . . . . 65.12 112.01 178.093 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 5.9 p-10 -86.44 -161.15 0.62 Allowed 'General case' 0 CA--C 1.553 1.072 0 C-N-CA 123.843 0.857 . . . . 71.23 109.945 175.778 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 9.5 tp10 -60.33 -24.88 65.37 Favored 'General case' 0 N--CA 1.483 1.209 0 C-N-CA 123.786 0.835 . . . . 73.22 113.066 -175.515 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 96.1 mt -65.83 -10.41 37.63 Favored 'General case' 0 N--CA 1.486 1.347 0 N-CA-C 113.299 0.852 . . . . 61.34 113.299 -177.299 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 94.7 p -82.58 -5.04 58.55 Favored 'General case' 0 N--CA 1.482 1.148 0 C-N-CA 122.957 0.503 . . . . 55.0 111.496 175.723 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 45.7 t -70.53 84.99 0.61 Allowed 'General case' 0 N--CA 1.481 1.103 0 C-N-CA 124.149 0.98 . . . . 61.02 110.497 178.426 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 92' ' ' LEU . . . . . 0.473 HD12 ' HG2' ' A' ' 98' ' ' ARG . 80.7 mt -141.31 -139.19 0.12 Allowed 'General case' 0 N--CA 1.476 0.861 0 C-N-CA 124.402 1.081 . . . . 52.4 108.492 -175.865 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 28.3 mt -45.84 -43.83 4.55 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.819 0 C-N-CA 123.87 0.868 . . . . 73.54 110.535 171.629 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -171.09 158.96 30.74 Favored Glycine 0 C--O 1.252 1.225 0 CA-C-N 114.227 -1.352 . . . . 72.12 111.167 175.162 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 4.9 pm0 -55.56 127.34 29.3 Favored 'General case' 0 CA--C 1.552 1.056 0 C-N-CA 124.248 1.019 . . . . 71.34 110.126 172.224 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 20.1 t 76.52 -46.29 0.52 Allowed 'General case' 0 N--CA 1.487 1.397 0 C-N-CA 125.618 1.567 . . . . 73.43 113.824 178.126 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 6.5 t -52.4 -32.32 38.4 Favored 'General case' 0 N--CA 1.491 1.583 0 C-N-CA 123.947 0.899 . . . . 71.2 112.624 -169.163 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 98' ' ' ARG . . . . . 0.473 ' HG2' HD12 ' A' ' 92' ' ' LEU . 0.0 OUTLIER -68.12 -33.84 75.26 Favored 'General case' 0 CA--C 1.55 0.961 0 O-C-N 123.875 0.734 . . . . 75.2 112.852 -175.076 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 27.4 mt-30 -66.51 -39.65 88.79 Favored 'General case' 0 N--CA 1.481 1.118 0 N-CA-C 109.176 -0.675 . . . . 71.43 109.176 175.649 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.29 -35.69 81.04 Favored 'General case' 0 C--O 1.214 -0.779 0 CA-C-N 115.153 -0.93 . . . . 73.11 110.497 172.697 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 62.4 m -63.53 -45.12 92.06 Favored 'General case' 0 N--CA 1.479 0.987 0 C-N-CA 123.152 0.581 . . . . 71.2 111.292 -177.226 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 9.1 mp -76.17 -38.79 56.18 Favored 'General case' 0 N--CA 1.485 1.323 0 O-C-N 123.186 0.304 . . . . 75.14 111.494 179.103 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 4.4 t-20 -63.52 -40.32 96.72 Favored 'General case' 0 N--CA 1.486 1.342 0 CA-C-O 121.244 0.545 . . . . 50.52 110.684 177.374 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 26.1 t-20 -72.27 -38.77 68.76 Favored 'General case' 0 N--CA 1.471 0.584 0 CA-C-N 115.271 -0.877 . . . . 72.52 109.492 178.876 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -62.59 -31.36 72.18 Favored 'General case' 0 N--CA 1.476 0.848 0 C-N-CA 123.408 0.683 . . . . 64.31 111.079 175.863 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 106' ' ' TYR . . . . . 0.482 ' HE2' ' HB2' ' A' ' 69' ' ' LYS . 2.9 t80 -67.71 -50.56 56.85 Favored 'General case' 0 C--N 1.35 0.628 0 N-CA-C 108.921 -0.77 . . . . 72.32 108.921 175.808 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -62.86 -30.3 76.75 Favored Glycine 0 C--N 1.351 1.381 0 O-C-N 123.608 0.568 . . . . 74.51 113.107 177.377 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 1.2 mpt_? -77.14 -29.43 54.65 Favored 'General case' 0 N--CA 1.468 0.461 0 C-N-CA 123.985 0.914 . . . . 72.03 110.185 176.67 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 109' ' ' LEU . . . . . 0.492 HD13 ' HB2' ' A' ' 114' ' ' LEU . 34.6 tp -71.7 -34.92 70.03 Favored 'General case' 0 N--CA 1.479 1.018 0 N-CA-C 109.393 -0.595 . . . . 74.54 109.393 175.08 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 47.9 t -66.04 -42.93 88.93 Favored 'General case' 0 CA--C 1.54 0.578 0 CA-C-N 114.912 -1.04 . . . . 53.25 109.819 173.52 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . -90.27 -68.07 1.21 Allowed Glycine 0 C--N 1.364 2.138 0 CA-C-O 119.027 -0.874 . . . . 61.24 114.8 -175.816 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 112' ' ' MET . . . . . 0.637 ' HG3' ' HA ' ' A' ' 117' ' ' ASP . 2.8 tmm? -97.85 -66.33 0.91 Allowed 'General case' 0 N--CA 1.488 1.447 0 CA-C-N 118.647 1.224 . . . . 72.53 113.049 -174.078 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 113' ' ' LEU . . . . . 0.553 HD11 ' HB ' ' A' ' 56' ' ' ILE . 0.2 OUTLIER 171.39 50.29 0.0 OUTLIER 'General case' 0 N--CA 1.495 1.786 0 C-N-CA 124.324 1.049 . . . . 70.12 109.866 178.164 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 114' ' ' LEU . . . . . 0.492 ' HB2' HD13 ' A' ' 109' ' ' LEU . 6.0 tt 77.69 -27.23 0.17 Allowed 'General case' 0 N--CA 1.501 2.088 0 C-N-CA 126.136 1.774 . . . . 33.43 112.17 175.608 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 115' ' ' VAL . . . . . 0.435 ' HA ' ' HD3' ' A' ' 116' ' ' PRO . 2.9 m -92.35 141.58 25.07 Favored Pre-proline 0 CA--C 1.546 0.8 0 C-N-CA 123.966 0.906 . . . . 63.33 109.135 178.427 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 116' ' ' PRO . . . . . 0.435 ' HD3' ' HA ' ' A' ' 115' ' ' VAL . 21.6 Cg_exo -66.09 78.92 0.3 Allowed 'Trans proline' 0 C--N 1.377 2.031 0 C-N-CA 123.728 2.952 . . . . 60.25 113.685 -175.56 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 117' ' ' ASP . . . . . 0.637 ' HA ' ' HG3' ' A' ' 112' ' ' MET . 62.8 m-20 63.55 5.57 2.2 Favored 'General case' 0 N--CA 1.482 1.147 0 C-N-CA 125.722 1.609 . . . . 72.12 114.404 172.645 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -97.27 139.18 21.31 Favored Pre-proline 0 N--CA 1.479 1.0 0 C-N-CA 123.369 0.667 . . . . 54.54 110.004 -179.447 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 119' ' ' PRO . . . . . . . . . . . . . 34.7 Cg_endo -63.68 124.36 13.54 Favored 'Trans proline' 0 C--N 1.375 1.969 0 C-N-CA 122.45 2.1 . . . . 71.11 111.883 -179.985 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . -68.98 178.49 25.73 Favored Glycine 0 C--N 1.346 1.119 0 N-CA-C 114.611 0.604 . . . . 73.24 114.611 -175.127 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . -144.96 135.42 24.28 Favored 'General case' 0 N--CA 1.475 0.801 0 C-N-CA 123.362 0.665 . . . . 71.05 110.154 -178.583 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 122' ' ' SER . . . . . . . . . . . . . 20.3 m . . . . . 0 CA--C 1.553 1.089 0 C-N-CA 123.535 0.734 . . . . 74.55 109.401 176.438 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . 0.443 ' HG2' HG23 ' A' ' 5' ' ' VAL . 25.1 ttt . . . . . 0 CA--C 1.554 1.106 0 CA-C-O 119.738 -0.173 . . . . 62.21 110.938 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 39.8 p -51.29 -40.39 58.87 Favored 'General case' 0 N--CA 1.486 1.357 0 C-N-CA 123.802 0.841 . . . . 71.32 112.638 -174.643 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 79.6 p -64.88 -41.98 95.19 Favored 'General case' 0 C--N 1.357 0.895 0 O-C-N 123.456 0.472 . . . . 73.24 110.436 -178.268 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . 0.476 ' HA ' ' HG2' ' A' ' 53' ' ' PRO . 33.5 m -67.57 -47.08 70.83 Favored 'General case' 0 C--N 1.356 0.878 0 O-C-N 123.632 0.582 . . . . 70.44 111.278 178.968 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . 0.443 HG23 ' HG2' ' A' ' 1' ' ' MET . 64.1 t -60.39 -43.27 93.55 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.411 0 C-N-CA 123.546 0.738 . . . . 71.2 110.708 -178.606 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . 0.464 ' O ' ' HG3' ' A' ' 10' ' ' ARG . 3.2 tm-20 -71.87 -34.2 69.02 Favored 'General case' 0 CA--C 1.54 0.594 0 CA-C-N 114.727 -1.124 . . . . 75.1 109.822 -178.014 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 59.4 t80 -67.72 -39.22 84.31 Favored 'General case' 0 CA--C 1.553 1.064 0 C-N-CA 123.578 0.751 . . . . 74.33 110.807 176.545 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . 0.41 HG13 ' O ' ' A' ' 4' ' ' THR . 87.8 mt -64.07 -39.94 87.28 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.965 0 N-CA-C 109.058 -0.719 . . . . 74.13 109.058 174.054 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 3.8 t-20 -66.63 -30.74 71.08 Favored 'General case' 0 C--N 1.354 0.779 0 O-C-N 123.919 0.762 . . . . 53.53 110.57 179.434 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . 0.464 ' HG3' ' O ' ' A' ' 6' ' ' GLU . 85.4 mtt180 -64.58 -46.08 84.27 Favored 'General case' 0 N--CA 1.477 0.91 0 C-N-CA 123.211 0.605 . . . . 62.31 109.745 173.349 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' TRP . . . . . 0.453 ' CD1' HG13 ' A' ' 64' ' ' VAL . 81.5 m95 -65.65 -31.73 72.92 Favored 'General case' 0 N--CA 1.48 1.033 0 O-C-N 123.618 0.574 . . . . 73.01 111.962 176.629 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . 0.429 ' HG2' ' CE2' ' A' ' 67' ' ' TYR . 55.3 mt-30 -61.6 -45.86 92.3 Favored 'General case' 0 C--N 1.354 0.776 0 N-CA-C 108.685 -0.857 . . . . 73.44 108.685 172.718 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . 0.438 ' NH2' ' HB3' ' A' ' 39' ' ' SER . 14.0 tpt180 -61.41 -49.41 76.97 Favored 'General case' 0 CA--C 1.545 0.788 0 O-C-N 123.832 0.708 . . . . 73.14 110.907 -178.221 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' ILE . . . . . 0.471 HD11 HG21 ' A' ' 47' ' ' VAL . 54.3 mt -62.75 -47.99 90.25 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.409 0 C-N-CA 122.658 0.383 . . . . 71.42 110.57 -178.785 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . 0.551 ' HA ' ' HB ' ' A' ' 71' ' ' THR . . . -59.07 -45.72 90.11 Favored 'General case' 0 N--CA 1.477 0.924 0 C-N-CA 124.148 0.979 . . . . 73.44 111.388 -178.249 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 94.5 mt -76.34 -34.13 58.98 Favored 'General case' 0 N--CA 1.482 1.17 0 O-C-N 124.344 1.028 . . . . 72.44 111.499 -175.885 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.474 ' O ' ' HG ' ' A' ' 21' ' ' LEU . 34.2 mt -64.09 -56.83 12.13 Favored 'General case' 0 N--CA 1.476 0.864 0 N-CA-C 109.242 -0.651 . . . . 72.04 109.242 176.868 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 69.0 p -63.03 -32.01 73.28 Favored 'General case' 0 N--CA 1.475 0.777 0 O-C-N 124.223 0.952 . . . . 54.5 111.582 -178.78 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 19' ' ' GLN . . . . . 0.408 HE21 ' NE2' ' A' ' 70' ' ' GLN . 6.7 tp-100 -59.63 -51.95 67.62 Favored 'General case' 0 N--CA 1.478 0.971 0 C-N-CA 123.662 0.785 . . . . 75.32 109.861 172.716 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 51.3 m -60.15 -41.97 93.88 Favored 'General case' 0 C--O 1.215 -0.759 0 O-C-N 124.163 0.914 . . . . 74.43 110.314 177.045 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . 0.572 HD22 ' HA ' ' A' ' 33' ' ' LEU . 35.2 mt -67.65 -33.34 74.76 Favored 'General case' 0 C--N 1.348 0.527 0 C-N-CA 123.035 0.534 . . . . 75.23 110.849 -176.459 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.556 ' HA ' HD21 ' A' ' 78' ' ' LEU . 47.8 tp -69.83 -49.95 47.54 Favored 'General case' 0 C--O 1.244 0.771 0 O-C-N 123.74 0.65 . . . . 74.22 109.939 179.041 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . 0.565 ' HB3' ' HE ' ' A' ' 27' ' ' ARG . 42.5 mt-10 -55.21 -60.48 3.33 Favored 'General case' 0 C--N 1.352 0.678 0 O-C-N 124.219 0.949 . . . . 71.12 110.37 176.941 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.486 HD23 ' HD2' ' A' ' 27' ' ' ARG . 79.1 mt -61.36 -32.19 72.09 Favored 'General case' 0 CA--C 1.542 0.639 0 C-N-CA 124.652 1.181 . . . . 74.24 111.847 -176.543 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . 0.469 ' HB2' HD21 ' A' ' 33' ' ' LEU . . . -61.22 -49.07 78.62 Favored 'General case' 0 N--CA 1.482 1.131 0 CA-C-O 120.873 0.368 . . . . 70.43 110.191 174.912 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 95.2 mt-30 -72.11 -22.99 61.25 Favored 'General case' 0 CA--C 1.549 0.924 0 CA-C-N 115.017 -0.992 . . . . 54.11 111.759 -179.216 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . 0.565 ' HE ' ' HB3' ' A' ' 23' ' ' GLU . 47.2 mtt-85 -80.52 -10.03 59.75 Favored 'General case' 0 N--CA 1.485 1.324 0 C-N-CA 123.638 0.775 . . . . 63.54 110.95 174.179 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 83.39 9.0 84.28 Favored Glycine 0 C--N 1.348 1.228 0 C-N-CA 122.673 0.178 . . . . 72.11 113.316 -178.8 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 20.9 mm-40 -86.56 55.08 3.4 Favored 'General case' 0 CA--C 1.547 0.846 0 C-N-CA 125.306 1.442 . . . . 51.22 110.777 178.836 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 30' ' ' TRP . . . . . 0.439 ' O ' ' HG ' ' A' ' 34' ' ' LEU . 86.4 m95 -63.13 -29.03 70.47 Favored 'General case' 0 N--CA 1.481 1.089 0 C-N-CA 123.681 0.792 . . . . 54.53 111.313 -177.654 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 20.1 m-20 -53.6 -48.93 68.8 Favored 'General case' 0 N--CA 1.48 1.069 0 C-N-CA 123.608 0.763 . . . . 72.1 110.131 175.43 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.466 HD12 HD22 ' A' ' 24' ' ' LEU . 34.7 mt -63.97 -30.67 71.73 Favored 'General case' 0 CA--C 1.542 0.654 0 CA-C-N 115.094 -0.957 . . . . 64.2 111.063 -176.242 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . 0.572 ' HA ' HD22 ' A' ' 21' ' ' LEU . 9.8 mp -63.96 -46.3 85.26 Favored 'General case' 0 N--CA 1.477 0.91 0 O-C-N 123.585 0.553 . . . . 75.03 110.159 171.327 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.439 ' HG ' ' O ' ' A' ' 30' ' ' TRP . 64.6 mt -63.37 -30.78 71.86 Favored 'General case' 0 N--CA 1.484 1.269 0 C-N-CA 123.367 0.667 . . . . 72.04 112.21 -177.862 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 1.3 mp0 -74.24 -49.06 24.87 Favored 'General case' 0 N--CA 1.485 1.284 0 C-N-CA 122.526 0.33 . . . . 73.11 111.009 173.798 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 36' ' ' GLN . . . . . 0.505 ' HB2' HD21 ' A' ' 21' ' ' LEU . 84.5 mm-40 -69.42 -14.44 62.9 Favored 'General case' 0 N--CA 1.48 1.034 0 C-N-CA 123.41 0.684 . . . . 74.23 111.966 179.617 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . 0.478 ' O ' ' HG ' ' A' ' 41' ' ' LEU . 28.2 tt0 -48.04 -54.62 12.43 Favored 'General case' 0 N--CA 1.481 1.086 0 C-N-CA 124.903 1.281 . . . . 65.33 111.876 178.536 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 59.6 t -57.4 -45.38 85.5 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.998 0 C-N-CA 123.973 0.909 . . . . 74.03 110.726 -176.494 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . 0.438 ' HB3' ' NH2' ' A' ' 13' ' ' ARG . 41.5 m -67.08 -36.88 82.95 Favored 'General case' 0 CA--C 1.542 0.643 0 CA-C-N 114.792 -1.095 . . . . 65.21 111.401 179.056 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 76.5 t80 -69.2 -46.94 66.22 Favored 'General case' 0 N--CA 1.477 0.896 0 C-N-CA 123.745 0.818 . . . . 72.51 110.291 -176.255 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . 0.478 ' HG ' ' O ' ' A' ' 37' ' ' GLU . 73.9 mt -58.31 -52.18 66.69 Favored 'General case' 0 C--N 1.355 0.807 0 O-C-N 124.672 1.233 . . . . 53.14 109.13 176.773 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 50.3 tt0 -54.76 -48.22 72.92 Favored 'General case' 0 C--N 1.354 0.779 0 O-C-N 124.003 0.814 . . . . 75.11 111.498 -178.232 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . 0.472 ' O ' HG23 ' A' ' 47' ' ' VAL . 68.1 m -61.41 -59.7 4.85 Favored 'General case' 0 CA--C 1.545 0.767 0 C-N-CA 123.069 0.548 . . . . 44.22 111.259 -178.263 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 12.6 tt -59.95 -39.37 79.96 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.145 0 O-C-N 123.821 0.701 . . . . 74.35 111.319 -172.914 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 18.3 mm-40 -65.25 -54.34 30.82 Favored 'General case' 0 N--CA 1.475 0.796 0 C-N-CA 123.554 0.741 . . . . 73.12 110.892 177.673 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 46' ' ' THR . . . . . 0.446 ' O ' ' HD3' ' A' ' 50' ' ' LYS . 87.9 m -56.47 -31.46 64.04 Favored 'General case' 0 N--CA 1.489 1.502 0 C-N-CA 123.469 0.708 . . . . 43.21 111.925 -177.831 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 47' ' ' VAL . . . . . 0.472 HG23 ' O ' ' A' ' 43' ' ' SER . 60.9 t -76.21 -46.33 33.63 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.821 0 CA-C-N 116.848 -0.16 . . . . 74.35 111.212 177.332 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 48' ' ' MET . . . . . . . . . . . . . 70.6 mtm -74.6 -21.07 59.66 Favored 'General case' 0 N--CA 1.487 1.392 0 N-CA-C 112.811 0.671 . . . . 75.24 112.811 -175.842 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 50.7 mt-10 -83.14 -37.3 23.9 Favored 'General case' 0 N--CA 1.488 1.455 0 C-N-CA 122.699 0.4 . . . . 75.23 111.07 177.681 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . 0.446 ' HD3' ' O ' ' A' ' 46' ' ' THR . 13.6 mptt -91.45 147.02 23.33 Favored 'General case' 0 N--CA 1.475 0.8 0 CA-C-N 115.67 -0.696 . . . . 64.52 110.036 -170.485 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 7.6 tt0 -71.83 136.52 47.04 Favored 'General case' 0 CA--C 1.539 0.539 0 CA-C-N 115.013 -0.994 . . . . 73.4 110.757 -173.655 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 52' ' ' THR . . . . . 0.77 HG21 ' HB3' ' A' ' 114' ' ' LEU . 59.9 m -70.44 133.16 87.22 Favored Pre-proline 0 CA--C 1.555 1.168 0 CA-C-N 115.263 -0.88 . . . . 74.14 110.109 173.313 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 53' ' ' PRO . . . . . 0.476 ' HG2' ' HA ' ' A' ' 4' ' ' THR . 45.4 Cg_exo -58.62 151.98 59.08 Favored 'Trans proline' 0 C--N 1.383 2.356 0 C-N-CA 122.379 2.053 . . . . 73.12 113.162 177.63 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 54' ' ' PRO . . . . . 0.427 ' HD3' ' HA ' ' A' ' 53' ' ' PRO . 18.5 Cg_exo -68.68 -46.96 1.52 Allowed 'Trans proline' 0 C--N 1.375 1.972 0 C-N-CA 122.963 2.442 . . . . 71.24 110.994 172.827 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . -68.99 87.18 0.22 Allowed Glycine 0 C--N 1.349 1.268 0 CA-C-N 114.928 -1.033 . . . . 70.32 113.134 -179.164 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 80.3 mt -128.15 123.99 61.54 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.639 0 C-N-CA 124.574 1.15 . . . . 53.21 108.005 173.891 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 57' ' ' THR . . . . . 0.462 ' H ' HD12 ' A' ' 60' ' ' ILE . 31.9 p -85.2 179.23 7.27 Favored 'General case' 0 N--CA 1.473 0.703 0 N-CA-C 109.31 -0.626 . . . . 61.44 109.31 176.249 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 39.1 tpt85 -64.43 -47.04 80.63 Favored 'General case' 0 CA--C 1.541 0.606 0 C-N-CA 122.917 0.487 . . . . 73.44 109.772 176.176 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 17.7 m -60.84 -41.61 96.17 Favored 'General case' 0 N--CA 1.475 0.811 0 C-N-CA 123.683 0.793 . . . . 52.05 111.35 179.517 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 60' ' ' ILE . . . . . 0.462 HD12 ' H ' ' A' ' 57' ' ' THR . 98.1 mt -64.28 -42.04 94.22 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.95 0 C-N-CA 123.242 0.617 . . . . 72.21 110.43 177.826 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 49.0 tt0 -58.08 -42.23 85.11 Favored 'General case' 0 CA--C 1.544 0.72 0 O-C-N 123.801 0.688 . . . . 74.14 110.548 176.359 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 35.4 m-20 -68.82 -39.31 80.08 Favored 'General case' 0 N--CA 1.48 1.026 0 C-N-CA 123.214 0.606 . . . . 72.4 112.078 -179.608 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 63' ' ' MET . . . . . . . . . . . . . 71.6 mtm -68.68 -46.17 69.77 Favored 'General case' 0 N--CA 1.482 1.175 0 O-C-N 123.322 0.389 . . . . 63.45 110.691 -179.821 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 64' ' ' VAL . . . . . 0.529 ' O ' HG13 ' A' ' 68' ' ' ILE . 70.6 t -63.91 -60.05 3.34 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.558 0 CA-C-N 115.175 -0.92 . . . . 54.1 109.916 178.827 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . 0.57 ' HB2' HD23 ' A' ' 109' ' ' LEU . . . -60.92 -29.55 69.67 Favored 'General case' 0 N--CA 1.493 1.689 0 C-N-CA 123.298 0.639 . . . . 53.24 112.018 -179.054 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -67.0 -42.1 92.78 Favored Glycine 0 C--N 1.345 1.073 0 O-C-N 123.66 0.6 . . . . 65.42 111.928 176.018 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 67' ' ' TYR . . . . . 0.429 ' CE2' ' HG2' ' A' ' 12' ' ' GLN . 9.8 m-30 -75.89 -29.34 58.42 Favored 'General case' 0 N--CA 1.473 0.701 0 C-N-CA 123.046 0.539 . . . . 74.22 112.276 177.289 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 68' ' ' ILE . . . . . 0.539 ' O ' ' HG ' ' A' ' 72' ' ' LEU . 47.3 mt -64.03 -50.01 79.04 Favored 'Isoleucine or valine' 0 C--N 1.355 0.845 0 N-CA-C 107.251 -1.388 . . . . 73.35 107.251 172.306 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 69' ' ' LYS . . . . . 0.565 ' HB2' ' HE2' ' A' ' 106' ' ' TYR . 48.0 tttp -52.11 -48.46 64.77 Favored 'General case' 0 N--CA 1.481 1.098 0 C-N-CA 123.967 0.907 . . . . 55.11 111.149 176.432 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 70' ' ' GLN . . . . . 0.408 ' NE2' HE21 ' A' ' 19' ' ' GLN . 60.7 tt0 -59.53 -46.38 89.04 Favored 'General case' 0 C--N 1.348 0.505 0 O-C-N 124.534 1.146 . . . . 72.55 110.41 -176.398 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 71' ' ' THR . . . . . 0.551 ' HB ' ' HA ' ' A' ' 15' ' ' ALA . 12.3 t -78.8 -18.74 53.63 Favored 'General case' 0 C--O 1.215 -0.752 0 CA-C-O 118.525 -0.75 . . . . 74.34 110.906 -177.91 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 72' ' ' LEU . . . . . 0.539 ' HG ' ' O ' ' A' ' 68' ' ' ILE . 37.6 mt -76.63 -33.42 58.35 Favored 'General case' 0 N--CA 1.491 1.611 0 CA-C-N 118.447 0.567 . . . . 64.44 110.791 173.596 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 50.8 m-20 -69.71 -49.01 57.43 Favored 'General case' 0 N--CA 1.476 0.855 0 N-CA-C 109.114 -0.698 . . . . 64.12 109.114 175.025 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 78.6 m-20 -57.86 -41.72 82.99 Favored 'General case' 0 N--CA 1.48 1.031 0 O-C-N 124.12 0.888 . . . . 73.13 110.714 175.522 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . 0.458 ' O ' ' HG2' ' A' ' 79' ' ' LYS . 11.2 tp10 -53.91 -61.64 2.17 Favored 'General case' 0 N--CA 1.485 1.284 0 C-N-CA 125.389 1.476 . . . . 54.42 110.697 176.234 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 9.1 tt0 -58.13 -46.77 85.03 Favored 'General case' 0 CA--C 1.543 0.702 0 O-C-N 124.056 0.848 . . . . 73.23 111.107 -174.094 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 95.2 mt -67.18 -40.25 86.55 Favored 'General case' 0 CA--C 1.545 0.751 0 CA-C-N 115.535 -0.757 . . . . 60.03 111.607 -176.538 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . 0.556 HD21 ' HA ' ' A' ' 22' ' ' LEU . 15.9 mt -65.79 -46.23 79.47 Favored 'General case' 0 N--CA 1.478 0.944 0 O-C-N 123.442 0.464 . . . . 75.21 111.807 -179.031 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 79' ' ' LYS . . . . . 0.458 ' HG2' ' O ' ' A' ' 75' ' ' GLU . 22.8 mmtp -70.57 -32.92 70.51 Favored 'General case' 0 N--CA 1.481 1.1 0 CA-C-O 121.002 0.429 . . . . 75.4 109.947 -178.438 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -64.67 -28.8 73.77 Favored Glycine 0 C--N 1.345 1.076 0 CA-C-N 114.594 -1.185 . . . . 75.11 112.983 172.354 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -83.79 -38.99 20.57 Favored 'General case' 0 CA--C 1.558 1.256 0 C-N-CA 123.46 0.704 . . . . 72.21 110.527 176.813 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 78.9 mt -72.29 -63.88 1.06 Allowed 'General case' 0 N--CA 1.483 1.21 0 C-N-CA 123.546 0.738 . . . . 71.31 111.634 -172.624 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 18.1 tp60 -135.29 21.85 3.44 Favored 'General case' 0 CA--C 1.547 0.852 0 C-N-CA 123.032 0.533 . . . . 60.31 109.746 -173.778 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 8.9 tt0 73.39 -17.01 0.45 Allowed 'General case' 0 N--CA 1.49 1.574 0 C-N-CA 125.299 1.44 . . . . 74.41 112.657 175.368 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 85' ' ' ARG . . . . . . . . . . . . . 81.3 mtt85 -145.02 171.99 13.69 Favored 'General case' 0 N--CA 1.469 0.519 0 C-N-CA 124.828 1.251 . . . . 71.52 109.21 -173.402 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 82.5 mt -53.89 96.78 0.02 OUTLIER 'General case' 0 N--CA 1.481 1.11 0 C-N-CA 124.147 0.979 . . . . 74.4 111.734 -175.746 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 27.0 t70 -166.79 112.21 0.78 Allowed 'General case' 0 CA--C 1.536 0.409 0 N-CA-C 107.612 -1.255 . . . . 71.21 107.612 -179.276 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -100.68 -174.84 2.74 Favored 'General case' 0 N--CA 1.481 1.123 0 C-N-CA 123.375 0.67 . . . . 71.43 111.166 -175.342 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 39.9 mt -54.14 -40.63 67.56 Favored 'General case' 0 CA--C 1.548 0.887 0 CA-C-N 114.282 -1.326 . . . . 61.24 111.825 179.765 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 90' ' ' SER . . . . . 0.475 ' HB3' HD11 ' A' ' 41' ' ' LEU . 47.0 t -152.8 143.95 23.13 Favored 'General case' 0 N--CA 1.47 0.572 0 C-N-CA 123.641 0.777 . . . . 75.4 109.874 179.941 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 56.8 p -64.57 143.23 58.07 Favored 'General case' 0 CA--C 1.55 0.944 0 C-N-CA 123.843 0.857 . . . . 73.33 111.701 -177.578 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 92' ' ' LEU . . . . . 0.49 ' HB2' ' HA ' ' A' ' 96' ' ' SER . 90.8 mt -79.95 -84.21 0.09 Allowed 'General case' 0 CA--C 1.549 0.908 0 C-N-CA 123.725 0.81 . . . . 55.03 111.248 -175.253 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 5.9 mt -99.34 35.06 0.22 Allowed 'Isoleucine or valine' 0 N--CA 1.484 1.247 0 N-CA-C 108.34 -0.985 . . . . 64.43 108.34 -179.69 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 74.21 -70.87 1.53 Allowed Glycine 0 C--N 1.349 1.298 0 N-CA-C 109.255 -1.538 . . . . 74.31 109.255 -163.928 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 50.5 mt-30 -69.76 97.13 1.04 Allowed 'General case' 0 C--N 1.349 0.587 0 N-CA-C 108.038 -1.097 . . . . 74.12 108.038 161.782 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 96' ' ' SER . . . . . 0.49 ' HA ' ' HB2' ' A' ' 92' ' ' LEU . 17.3 m -71.69 90.29 1.05 Allowed 'General case' 0 CA--C 1.535 0.376 0 N-CA-C 109.176 -0.676 . . . . 75.23 109.176 178.707 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 11.3 t -85.96 44.34 1.12 Allowed 'General case' 0 CA--C 1.557 1.25 0 C-N-CA 123.825 0.85 . . . . 74.34 110.111 -179.182 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 98' ' ' ARG . . . . . 0.452 ' HD2' ' H ' ' A' ' 98' ' ' ARG . 0.2 OUTLIER -58.98 -53.35 59.37 Favored 'General case' 0 CA--C 1.548 0.891 0 C-N-CA 123.974 0.91 . . . . 74.12 110.86 -174.161 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 33.9 tt0 -72.61 -50.15 27.26 Favored 'General case' 0 C--N 1.346 0.441 0 C-N-CA 123.836 0.854 . . . . 65.22 109.508 -175.399 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 71.0 mmtt -60.44 -55.47 33.14 Favored 'General case' 0 N--CA 1.472 0.674 0 O-C-N 123.971 0.795 . . . . 71.14 110.501 -173.245 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 39.0 t -72.28 -44.25 63.05 Favored 'General case' 0 CA--C 1.546 0.825 0 O-C-N 124.062 0.851 . . . . 63.14 112.344 -174.526 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 6.4 tp -72.38 -38.24 68.53 Favored 'General case' 0 N--CA 1.49 1.563 0 CA-C-N 118.532 0.605 . . . . 72.23 110.617 -174.505 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 66.5 t30 -77.59 -24.89 49.61 Favored 'General case' 0 N--CA 1.478 0.949 0 CA-C-N 116.435 -0.348 . . . . 64.31 110.682 177.237 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 47.9 t30 -66.74 -38.29 86.36 Favored 'General case' 0 N--CA 1.488 1.445 0 C-N-CA 122.864 0.465 . . . . 71.14 109.818 171.201 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -61.34 -47.81 84.18 Favored 'General case' 0 C--N 1.352 0.7 0 O-C-N 123.896 0.748 . . . . 73.54 109.96 174.621 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 106' ' ' TYR . . . . . 0.565 ' HE2' ' HB2' ' A' ' 69' ' ' LYS . 4.6 t80 -55.93 -53.42 57.09 Favored 'General case' 0 CA--C 1.55 0.956 0 O-C-N 124.248 0.968 . . . . 73.5 111.06 176.354 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -68.5 -37.97 86.05 Favored Glycine 0 C--N 1.349 1.266 0 O-C-N 123.781 0.676 . . . . 63.45 113.268 -172.043 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 38.3 ttp-105 -71.01 -32.59 69.43 Favored 'General case' 0 CA--C 1.543 0.707 0 C-N-CA 123.665 0.786 . . . . 62.35 109.779 177.395 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 109' ' ' LEU . . . . . 0.57 HD23 ' HB2' ' A' ' 65' ' ' ALA . 47.9 tp -66.99 -46.14 75.5 Favored 'General case' 0 N--CA 1.481 1.103 0 C-N-CA 123.297 0.639 . . . . 73.11 110.778 175.129 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 23.0 t -67.83 -35.43 78.58 Favored 'General case' 0 CA--C 1.543 0.681 0 O-C-N 124.147 0.904 . . . . 51.5 110.229 -178.643 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . -84.26 -63.93 1.62 Allowed Glycine 0 C--N 1.36 1.874 0 CA-C-O 119.274 -0.737 . . . . 65.13 113.28 -176.363 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 112' ' ' MET . . . . . 0.452 ' O ' ' HB2' ' A' ' 113' ' ' LEU . 2.0 tmm? -95.24 -66.24 0.92 Allowed 'General case' 0 N--CA 1.487 1.393 0 CA-C-N 118.496 1.148 . . . . 70.02 110.351 179.586 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 113' ' ' LEU . . . . . 0.452 ' HB2' ' O ' ' A' ' 112' ' ' MET . 14.8 tp 164.4 28.17 0.0 OUTLIER 'General case' 0 N--CA 1.505 2.309 0 C-N-CA 125.445 1.498 . . . . 72.11 110.472 179.269 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 114' ' ' LEU . . . . . 0.77 ' HB3' HG21 ' A' ' 52' ' ' THR . 0.5 OUTLIER 75.26 -6.04 2.05 Favored 'General case' 0 N--CA 1.501 2.12 0 C-N-CA 125.553 1.541 . . . . 71.23 111.215 -178.569 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 115' ' ' VAL . . . . . . . . . . . . . 22.7 t -107.97 123.94 36.25 Favored Pre-proline 0 CA--C 1.541 0.616 0 N-CA-C 107.167 -1.42 . . . . 71.44 107.167 178.467 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 60.7 Cg_endo -74.39 102.92 1.61 Allowed 'Trans proline' 0 CA--C 1.554 1.495 0 C-N-CA 121.652 1.568 . . . . 70.15 111.885 176.562 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 30.2 m-20 -141.35 55.57 1.53 Allowed 'General case' 0 N--CA 1.488 1.456 0 C-N-CA 124.103 0.961 . . . . 75.21 110.364 177.669 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . 68.9 139.65 0.06 OUTLIER Pre-proline 0 CA--C 1.558 1.256 0 C-N-CA 124.939 1.296 . . . . 42.52 112.438 179.141 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 119' ' ' PRO . . . . . . . . . . . . . 85.4 Cg_endo -80.26 -171.16 1.17 Allowed 'Trans proline' 0 C--N 1.373 1.819 0 C-N-CA 122.427 2.085 . . . . 71.43 110.542 167.453 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . -138.75 171.98 23.29 Favored Glycine 0 N--CA 1.467 0.742 0 N-CA-C 111.716 -0.554 . . . . 74.32 111.716 -178.568 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . -63.26 -34.62 78.07 Favored 'General case' 0 N--CA 1.477 0.912 0 C-N-CA 123.852 0.861 . . . . 74.22 111.195 177.686 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 122' ' ' SER . . . . . . . . . . . . . 56.2 m . . . . . 0 CA--C 1.554 1.113 0 C-N-CA 124.473 1.109 . . . . 73.22 108.67 175.651 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 12.4 tpt . . . . . 0 N--CA 1.478 0.971 0 CA-C-O 119.045 -0.502 . . . . 62.31 111.548 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 46.7 p -55.46 -41.35 72.8 Favored 'General case' 0 N--CA 1.484 1.228 0 C-N-CA 122.754 0.422 . . . . 74.44 112.075 -175.94 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 14.7 m -58.35 -42.32 86.66 Favored 'General case' 0 N--CA 1.48 1.03 0 C-N-CA 123.299 0.64 . . . . 73.24 111.121 177.629 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 56.9 m -68.77 -40.62 79.6 Favored 'General case' 0 CA--C 1.544 0.744 0 C-N-CA 123.552 0.741 . . . . 65.35 111.38 177.908 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 88.4 t -63.46 -40.78 90.31 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.021 0 C-N-CA 123.06 0.544 . . . . 53.24 110.127 179.943 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . 0.428 ' O ' ' HG3' ' A' ' 10' ' ' ARG . 50.3 mm-40 -71.68 -35.07 70.18 Favored 'General case' 0 N--CA 1.469 0.502 0 O-C-N 123.718 0.636 . . . . 70.33 111.031 178.599 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 55.4 t80 -67.62 -45.06 76.49 Favored 'General case' 0 CA--C 1.551 1.0 0 C-N-CA 123.031 0.533 . . . . 74.43 110.529 179.62 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . 0.521 HD11 HG23 ' A' ' 60' ' ' ILE . 90.2 mt -62.97 -40.24 88.25 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.811 0 C-N-CA 123.621 0.768 . . . . 73.4 109.381 173.677 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 20.9 t-20 -61.79 -33.35 73.95 Favored 'General case' 0 N--CA 1.481 1.117 0 C-N-CA 124.063 0.945 . . . . 73.13 111.239 177.227 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . 0.654 ' HB3' HG22 ' A' ' 47' ' ' VAL . 64.0 mtt85 -68.59 -40.48 80.48 Favored 'General case' 0 CA--C 1.536 0.442 0 C-N-CA 123.124 0.569 . . . . 73.33 110.377 175.565 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' TRP . . . . . 0.427 ' CD1' HG13 ' A' ' 64' ' ' VAL . 74.8 m95 -69.84 -32.12 70.35 Favored 'General case' 0 N--CA 1.479 1.011 0 N-CA-C 112.14 0.422 . . . . 75.21 112.14 174.931 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . 0.411 ' HG3' ' O ' ' A' ' 8' ' ' ILE . 52.9 mt-30 -63.23 -42.02 99.18 Favored 'General case' 0 N--CA 1.472 0.637 0 N-CA-C 108.701 -0.851 . . . . 73.33 108.701 172.302 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 15.5 tpt180 -63.31 -50.69 69.05 Favored 'General case' 0 CA--C 1.541 0.605 0 CA-C-N 115.174 -0.921 . . . . 63.14 110.587 -177.091 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' ILE . . . . . 0.517 HD11 HG21 ' A' ' 47' ' ' VAL . 70.2 mt -63.11 -44.06 99.27 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.062 0 C-N-CA 123.456 0.702 . . . . 71.43 110.653 -179.041 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . 0.587 ' HA ' ' HB ' ' A' ' 71' ' ' THR . . . -61.21 -50.79 71.69 Favored 'General case' 0 N--CA 1.479 0.991 0 C-N-CA 124.073 0.949 . . . . 73.41 111.964 -179.672 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 97.9 mt -76.61 -35.17 58.25 Favored 'General case' 0 N--CA 1.48 1.057 0 CA-C-N 114.795 -1.093 . . . . 63.5 111.516 -172.655 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.498 ' O ' ' HG ' ' A' ' 21' ' ' LEU . 45.7 mt -66.43 -47.8 72.06 Favored 'General case' 0 N--CA 1.473 0.707 0 CA-C-O 118.971 -0.537 . . . . 75.01 109.947 175.9 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 98.2 p -65.67 -30.73 71.47 Favored 'General case' 0 N--CA 1.487 1.421 0 C-N-CA 122.611 0.364 . . . . 75.12 111.246 179.151 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 19' ' ' GLN . . . . . 0.663 ' HA ' HD22 ' A' ' 74' ' ' ASN . 6.3 tp-100 -59.31 -49.63 77.08 Favored 'General case' 0 C--N 1.354 0.799 0 O-C-N 123.737 0.648 . . . . 74.41 109.303 171.134 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 44.6 m -62.65 -41.73 99.21 Favored 'General case' 0 CA--C 1.542 0.644 0 CA-C-N 115.233 -0.894 . . . . 75.05 111.163 178.179 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . 0.498 ' HG ' ' O ' ' A' ' 17' ' ' LEU . 80.2 mt -63.26 -39.83 95.72 Favored 'General case' 0 N--CA 1.478 0.967 0 C-N-CA 123.64 0.776 . . . . 72.42 110.087 -177.421 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.566 ' HA ' HD21 ' A' ' 78' ' ' LEU . 55.6 tp -64.29 -54.77 28.01 Favored 'General case' 0 CA--C 1.539 0.546 0 CA-C-N 115.628 -0.715 . . . . 71.43 110.224 178.058 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 47.3 mt-10 -54.17 -50.82 66.12 Favored 'General case' 0 N--CA 1.483 1.186 0 C-N-CA 123.862 0.865 . . . . 74.41 111.279 -178.954 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.441 ' HB3' ' HB2' ' A' ' 29' ' ' GLU . 91.7 mt -63.47 -40.28 96.69 Favored 'General case' 0 N--CA 1.47 0.554 0 CA-C-N 115.012 -0.995 . . . . 65.23 111.067 -177.363 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . 0.424 ' HB2' HD21 ' A' ' 33' ' ' LEU . . . -59.91 -40.6 89.37 Favored 'General case' 0 N--CA 1.482 1.161 0 C-N-CA 123.137 0.575 . . . . 70.01 111.352 176.813 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 86.7 mt-30 -64.42 -35.8 82.08 Favored 'General case' 0 N--CA 1.48 1.067 0 C-N-CA 123.899 0.88 . . . . 73.2 110.975 175.776 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 57.7 mtt180 -82.35 -6.79 59.49 Favored 'General case' 0 N--CA 1.482 1.134 0 C-N-CA 123.914 0.886 . . . . 74.11 112.021 179.36 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 84.09 9.77 81.73 Favored Glycine 0 C--N 1.352 1.441 0 N-CA-C 113.587 0.195 . . . . 65.13 113.587 -179.916 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . 0.441 ' HB2' ' HB3' ' A' ' 24' ' ' LEU . 40.4 mm-40 -85.5 54.28 3.06 Favored 'General case' 0 CA--C 1.546 0.793 0 C-N-CA 124.626 1.17 . . . . 64.13 111.168 179.629 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 30' ' ' TRP . . . . . 0.492 ' O ' ' HG ' ' A' ' 34' ' ' LEU . 96.0 m95 -64.79 -28.8 69.82 Favored 'General case' 0 N--CA 1.475 0.781 0 C-N-CA 123.402 0.681 . . . . 74.32 111.797 -176.869 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 11.1 m-20 -59.54 -39.46 84.04 Favored 'General case' 0 N--CA 1.486 1.352 0 C-N-CA 123.23 0.612 . . . . 74.44 110.439 178.456 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 88.0 mt -67.82 -31.45 71.3 Favored 'General case' 0 CA--C 1.543 0.679 0 CA-C-N 115.255 -0.884 . . . . 74.11 110.963 179.135 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . 0.447 HD13 ' HA ' ' A' ' 30' ' ' TRP . 9.2 mp -65.44 -43.7 89.62 Favored 'General case' 0 N--CA 1.488 1.45 0 N-CA-C 110.051 -0.351 . . . . 72.54 110.051 171.627 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.492 ' HG ' ' O ' ' A' ' 30' ' ' TRP . 49.0 mt -66.3 -33.19 75.19 Favored 'General case' 0 N--CA 1.477 0.914 0 O-C-N 123.989 0.806 . . . . 70.21 111.442 -176.844 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 98.1 mt-30 -74.07 -53.88 9.02 Favored 'General case' 0 N--CA 1.477 0.903 0 C-N-CA 123.414 0.686 . . . . 54.25 110.294 177.04 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 83.5 mm-40 -63.86 -18.1 63.82 Favored 'General case' 0 N--CA 1.484 1.225 0 O-C-N 123.773 0.67 . . . . 73.23 111.637 178.848 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . 0.561 ' O ' ' HG ' ' A' ' 41' ' ' LEU . 30.3 tt0 -48.97 -60.97 2.32 Favored 'General case' 0 C--N 1.361 1.094 0 C-N-CA 124.523 1.129 . . . . 72.35 111.523 178.995 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 58.1 t -60.76 -40.59 85.48 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.291 0 O-C-N 123.787 0.679 . . . . 70.23 111.45 -173.973 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 50.8 m -62.22 -39.75 93.82 Favored 'General case' 0 CA--C 1.545 0.784 0 C-N-CA 123.382 0.673 . . . . 63.43 110.794 175.478 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 37.9 t80 -70.94 -40.15 72.22 Favored 'General case' 0 C--N 1.35 0.598 0 C-N-CA 124.274 1.029 . . . . 71.12 110.357 -176.976 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . 0.561 ' HG ' ' O ' ' A' ' 37' ' ' GLU . 67.3 mt -61.11 -51.07 70.68 Favored 'General case' 0 C--N 1.355 0.845 0 O-C-N 124.291 0.995 . . . . 73.12 108.623 178.773 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 50.8 tt0 -56.51 -42.03 77.69 Favored 'General case' 0 CA--C 1.544 0.735 0 CA-C-N 114.659 -1.155 . . . . 74.22 110.65 178.303 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . 0.558 ' O ' HG23 ' A' ' 47' ' ' VAL . 68.8 m -61.54 -62.82 1.55 Allowed 'General case' 0 C--N 1.357 0.898 0 C-N-CA 122.959 0.504 . . . . 72.53 110.968 179.345 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 13.7 tt -64.02 -35.35 73.26 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.914 0 C-N-CA 123.836 0.854 . . . . 64.21 111.477 -169.882 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 10.7 mm-40 -65.86 -49.25 68.82 Favored 'General case' 0 C--N 1.348 0.528 0 CA-C-N 115.873 -0.603 . . . . 74.35 110.317 175.332 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 60.9 m -53.64 -39.94 65.43 Favored 'General case' 0 N--CA 1.484 1.239 0 O-C-N 123.864 0.727 . . . . 50.15 111.163 177.784 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 47' ' ' VAL . . . . . 0.654 HG22 ' HB3' ' A' ' 10' ' ' ARG . 20.9 t -68.56 -49.09 68.4 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.004 0 C-N-CA 123.104 0.562 . . . . 71.42 111.575 -178.228 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 48' ' ' MET . . . . . . . . . . . . . 70.3 mtm -75.62 -14.38 60.37 Favored 'General case' 0 N--CA 1.483 1.187 0 C-N-CA 122.507 0.323 . . . . 62.13 111.761 -177.784 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 47.0 mt-10 -95.98 -11.98 25.71 Favored 'General case' 0 N--CA 1.481 1.089 0 C-N-CA 123.724 0.81 . . . . 75.13 110.555 171.82 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 14.9 tppt? -87.2 132.94 33.72 Favored 'General case' 0 N--CA 1.472 0.628 0 N-CA-C 108.883 -0.784 . . . . 74.41 108.883 177.331 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 3.4 tt0 -66.83 131.22 45.45 Favored 'General case' 0 C--O 1.242 0.683 0 N-CA-C 108.961 -0.755 . . . . 74.15 108.961 174.634 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 22.1 m -69.25 127.09 93.08 Favored Pre-proline 0 CA--C 1.551 0.995 0 O-C-N 123.579 0.55 . . . . 72.1 109.555 175.905 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_endo -66.32 155.02 71.98 Favored 'Trans proline' 0 C--N 1.377 2.079 0 C-N-CA 122.258 1.972 . . . . 71.13 112.031 178.97 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 17.4 Cg_exo -67.85 -47.74 1.75 Allowed 'Trans proline' 0 C--N 1.372 1.798 0 C-N-CA 122.941 2.427 . . . . 75.1 111.653 177.406 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . -63.2 85.0 0.05 OUTLIER Glycine 0 C--N 1.353 1.48 0 O-C-N 124.411 1.07 . . . . 62.35 113.593 -177.413 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 59.2 mt -133.69 102.12 4.4 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.683 0 C-N-CA 124.764 1.226 . . . . 75.42 108.399 178.081 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 57' ' ' THR . . . . . 0.425 ' H ' HD12 ' A' ' 60' ' ' ILE . 40.8 p -82.42 -173.62 4.69 Favored 'General case' 0 N--CA 1.471 0.601 0 C-N-CA 123.652 0.781 . . . . 64.1 110.31 175.192 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 22.0 tpt180 -63.01 -48.82 77.14 Favored 'General case' 0 CA--C 1.54 0.596 0 C-N-CA 123.608 0.763 . . . . 72.25 110.665 179.711 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 20.3 m -56.89 -43.98 81.86 Favored 'General case' 0 N--CA 1.479 1.017 0 C-N-CA 123.43 0.692 . . . . 65.42 111.375 179.389 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 60' ' ' ILE . . . . . 0.521 HG23 HD11 ' A' ' 8' ' ' ILE . 69.6 mt -64.08 -42.27 95.09 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.808 0 CA-C-N 115.114 -0.948 . . . . 74.11 110.328 178.728 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 60.4 tt0 -61.23 -41.27 96.58 Favored 'General case' 0 CA--C 1.546 0.79 0 C-N-CA 124.09 0.956 . . . . 71.4 111.087 179.729 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 14.1 m-20 -68.27 -43.3 78.11 Favored 'General case' 0 N--CA 1.479 0.986 0 C-N-CA 123.235 0.614 . . . . 73.55 111.632 179.503 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 63' ' ' MET . . . . . . . . . . . . . 73.3 mtm -65.88 -51.3 59.92 Favored 'General case' 0 N--CA 1.482 1.129 0 O-C-N 123.206 0.316 . . . . 54.41 111.109 179.864 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 64' ' ' VAL . . . . . 0.498 ' O ' HG13 ' A' ' 68' ' ' ILE . 53.1 t -59.98 -61.12 1.63 Allowed 'Isoleucine or valine' 0 CA--C 1.543 0.703 0 C-N-CA 123.707 0.803 . . . . 73.21 110.692 -179.522 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -64.67 -32.33 73.94 Favored 'General case' 0 N--CA 1.483 1.181 0 C-N-CA 122.697 0.399 . . . . 55.24 111.706 -176.708 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -65.94 -38.78 94.51 Favored Glycine 0 C--N 1.349 1.271 0 O-C-N 123.412 0.445 . . . . 30.25 112.049 177.798 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 67' ' ' TYR . . . . . 0.439 ' O ' HG22 ' A' ' 71' ' ' THR . 8.1 m-85 -74.9 -34.39 62.16 Favored 'General case' 0 N--CA 1.469 0.524 0 C-N-CA 123.439 0.696 . . . . 75.42 111.971 177.973 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 68' ' ' ILE . . . . . 0.549 ' O ' ' HG ' ' A' ' 72' ' ' LEU . 48.1 mt -61.93 -52.69 57.54 Favored 'Isoleucine or valine' 0 C--N 1.36 1.061 0 N-CA-C 108.353 -0.98 . . . . 61.43 108.353 174.369 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 69' ' ' LYS . . . . . 0.575 ' HB2' ' HE2' ' A' ' 106' ' ' TYR . 12.1 tmtt? -53.83 -47.76 70.58 Favored 'General case' 0 N--CA 1.479 1.017 0 C-N-CA 124.542 1.137 . . . . 75.13 109.772 -179.408 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 58.0 tt0 -55.49 -54.39 44.43 Favored 'General case' 0 C--N 1.347 0.485 0 CA-C-N 114.951 -1.022 . . . . 62.34 111.974 179.626 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 71' ' ' THR . . . . . 0.587 ' HB ' ' HA ' ' A' ' 15' ' ' ALA . 10.1 t -71.48 -27.09 62.99 Favored 'General case' 0 C--O 1.251 1.169 0 CA-C-N 116.22 -0.445 . . . . 74.21 110.891 -171.816 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 72' ' ' LEU . . . . . 0.549 ' HG ' ' O ' ' A' ' 68' ' ' ILE . 43.0 mt -62.07 -55.66 26.75 Favored 'General case' 0 C--N 1.358 0.955 0 O-C-N 123.789 0.681 . . . . 71.31 109.876 173.622 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -56.29 -52.56 64.06 Favored 'General case' 0 N--CA 1.489 1.487 0 O-C-N 124.253 0.971 . . . . 74.32 111.982 -179.787 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 74' ' ' ASN . . . . . 0.663 HD22 ' HA ' ' A' ' 19' ' ' GLN . 2.7 m-20 -58.74 -55.23 37.72 Favored 'General case' 0 C--O 1.248 0.992 0 O-C-N 124.036 0.835 . . . . 74.22 111.528 -174.786 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . 0.554 ' O ' ' HG2' ' A' ' 79' ' ' LYS . 14.5 tt0 -76.85 -15.4 59.72 Favored 'General case' 0 CA--C 1.545 0.763 0 CA-C-O 118.778 -0.63 . . . . 64.32 111.047 -177.107 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 76' ' ' GLN . . . . . 0.41 ' HA ' ' HG2' ' A' ' 79' ' ' LYS . 9.9 tt0 -69.46 -38.57 77.83 Favored 'General case' 0 N--CA 1.487 1.424 0 CA-C-N 118.464 0.575 . . . . 45.34 110.243 171.43 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 96.4 mt -60.62 -40.57 92.39 Favored 'General case' 0 N--CA 1.472 0.67 0 CA-C-N 115.592 -0.731 . . . . 63.34 109.087 171.031 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . 0.566 HD21 ' HA ' ' A' ' 22' ' ' LEU . 88.3 mt -63.76 -36.03 82.55 Favored 'General case' 0 CA--C 1.55 0.95 0 CA-C-O 118.44 -0.79 . . . . 71.12 112.262 171.634 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 79' ' ' LYS . . . . . 0.642 ' HE2' ' HB2' ' A' ' 99' ' ' GLN . 48.5 mmtm -59.34 -42.01 90.52 Favored 'General case' 0 N--CA 1.5 2.029 0 CA-C-N 119.032 0.833 . . . . 74.21 110.093 178.191 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -69.0 -43.08 74.84 Favored Glycine 0 C--N 1.349 1.297 0 CA-C-N 114.596 -1.184 . . . . 52.21 112.995 177.566 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -72.29 -33.04 67.12 Favored 'General case' 0 CA--C 1.555 1.169 0 C-N-CA 123.345 0.658 . . . . 73.51 110.436 -174.927 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 80.3 mt -73.71 -38.1 64.94 Favored 'General case' 0 N--CA 1.477 0.894 0 C-N-CA 123.35 0.66 . . . . 53.12 111.053 -178.516 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -159.93 -75.27 0.07 Allowed 'General case' 0 CA--C 1.544 0.741 0 O-C-N 123.367 0.417 . . . . 72.42 110.092 -178.811 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 9.4 tt0 -151.2 -70.0 0.17 Allowed 'General case' 0 N--CA 1.48 1.042 0 N-CA-C 110.327 -0.249 . . . . 64.23 110.327 -171.327 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 85' ' ' ARG . . . . . . . . . . . . . 9.6 ttm180 -167.38 146.85 5.14 Favored 'General case' 0 N--CA 1.479 0.996 0 N-CA-C 109.442 -0.577 . . . . 72.31 109.442 -178.447 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 86' ' ' LEU . . . . . 0.457 ' HB3' ' HB3' ' A' ' 96' ' ' SER . 91.8 mt 63.27 4.91 1.79 Allowed 'General case' 0 N--CA 1.488 1.463 0 C-N-CA 124.492 1.117 . . . . 71.13 112.247 -174.358 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 37.1 t70 -87.47 92.1 8.97 Favored 'General case' 0 C--N 1.353 0.744 0 CA-C-O 121.643 0.735 . . . . 73.35 109.985 -175.998 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 88' ' ' GLU . . . . . 0.562 ' HB3' ' HE3' ' A' ' 79' ' ' LYS . 4.3 pt-20 -89.19 156.63 18.66 Favored 'General case' 0 N--CA 1.482 1.162 0 C-N-CA 125.385 1.474 . . . . 73.13 110.798 -176.047 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 95.0 mt -50.66 -40.87 54.67 Favored 'General case' 0 N--CA 1.486 1.344 0 O-C-N 124.071 0.857 . . . . 70.24 111.372 -178.85 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 45.2 t -147.48 130.96 16.71 Favored 'General case' 0 C--O 1.241 0.627 0 CA-C-N 115.488 -0.778 . . . . 51.21 109.165 173.078 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 19.9 m -66.3 112.78 4.16 Favored 'General case' 0 C--O 1.24 0.592 0 O-C-N 124.269 0.981 . . . . 70.41 109.595 176.321 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 92' ' ' LEU . . . . . 0.496 ' HB2' ' HB ' ' A' ' 97' ' ' THR . 92.5 mt -60.43 -64.14 1.06 Allowed 'General case' 0 CA--C 1.543 0.697 0 O-C-N 123.686 0.616 . . . . 71.31 111.294 -175.654 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 39.0 mt -117.4 76.67 0.49 Allowed 'Isoleucine or valine' 0 CA--C 1.547 0.848 0 N-CA-C 109.042 -0.725 . . . . 71.2 109.042 -178.07 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 76.5 -77.03 1.45 Allowed Glycine 0 C--N 1.35 1.359 0 CA-C-N 115.388 -0.824 . . . . 71.31 113.604 174.272 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 2.9 mp0 -89.7 -173.13 3.82 Favored 'General case' 0 N--CA 1.478 0.952 0 C-N-CA 124.186 0.994 . . . . 75.04 110.364 178.71 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 96' ' ' SER . . . . . 0.457 ' HB3' ' HB3' ' A' ' 86' ' ' LEU . 58.8 m -63.27 95.8 0.1 Allowed 'General case' 0 CA--C 1.544 0.714 0 CA-C-N 115.063 -0.971 . . . . 61.13 110.367 174.618 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 97' ' ' THR . . . . . 0.496 ' HB ' ' HB2' ' A' ' 92' ' ' LEU . 87.3 m -100.37 -45.12 5.69 Favored 'General case' 0 C--O 1.215 -0.736 0 CA-C-N 114.796 -1.093 . . . . 73.24 111.272 -173.282 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 2.4 tmt_? -48.78 -58.24 5.11 Favored 'General case' 0 N--CA 1.482 1.165 0 C-N-CA 124.651 1.18 . . . . 71.3 112.077 -167.703 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 99' ' ' GLN . . . . . 0.642 ' HB2' ' HE2' ' A' ' 79' ' ' LYS . 48.3 tt0 -71.97 -43.81 64.57 Favored 'General case' 0 N--CA 1.472 0.659 0 N-CA-C 110.063 -0.347 . . . . 73.14 110.063 -169.729 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 29.4 ttpp -68.14 -47.38 68.25 Favored 'General case' 0 CA--C 1.546 0.802 0 C-N-CA 124.314 1.046 . . . . 64.15 111.192 -175.075 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 38.6 t -68.06 -42.6 80.22 Favored 'General case' 0 N--CA 1.472 0.671 0 C-N-CA 124.186 0.994 . . . . 62.34 110.729 -177.538 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 7.1 tp -74.56 -31.45 62.09 Favored 'General case' 0 CA--C 1.549 0.922 0 O-C-N 123.329 0.393 . . . . 71.21 111.187 -176.718 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 9.8 t30 -66.93 -41.89 86.25 Favored 'General case' 0 N--CA 1.48 1.059 0 C-N-CA 123.55 0.74 . . . . 44.43 109.696 173.938 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 27.7 t-20 -71.58 -28.88 64.13 Favored 'General case' 0 CA--C 1.54 0.568 0 CA-C-N 115.374 -0.83 . . . . 72.15 110.434 177.353 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -67.25 -38.79 85.74 Favored 'General case' 0 N--CA 1.48 1.037 0 C-N-CA 123.233 0.613 . . . . 74.54 110.454 176.627 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 106' ' ' TYR . . . . . 0.575 ' HE2' ' HB2' ' A' ' 69' ' ' LYS . 1.0 OUTLIER -61.21 -47.49 85.88 Favored 'General case' 0 C--N 1.355 0.814 0 N-CA-C 108.816 -0.809 . . . . 74.41 108.816 171.216 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -57.87 -40.69 93.47 Favored Glycine 0 C--N 1.351 1.386 0 O-C-N 123.732 0.645 . . . . 63.52 112.781 179.446 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 2.5 mmp_? -68.14 -34.17 75.84 Favored 'General case' 0 C--N 1.345 0.377 0 C-N-CA 123.508 0.723 . . . . 73.31 110.036 177.063 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 109' ' ' LEU . . . . . 0.445 ' HA ' ' N ' ' A' ' 114' ' ' LEU . 53.1 tp -68.37 -32.64 72.87 Favored 'General case' 0 N--CA 1.482 1.167 0 C-N-CA 123.174 0.589 . . . . 70.12 111.114 177.659 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 33.5 t -72.45 -42.49 64.95 Favored 'General case' 0 CA--C 1.541 0.598 0 CA-C-N 115.66 -0.7 . . . . 32.52 109.803 177.747 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . -88.71 -61.73 1.42 Allowed Glycine 0 C--N 1.355 1.611 0 C-N-CA 121.144 -0.551 . . . . 42.13 114.127 -175.773 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 112' ' ' MET . . . . . . . . . . . . . 2.2 mmm -93.72 -66.65 0.91 Allowed 'General case' 0 N--CA 1.486 1.338 0 CA-C-N 117.927 0.863 . . . . 71.34 112.904 -176.245 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 113' ' ' LEU . . . . . 0.424 ' HA ' HD23 ' A' ' 113' ' ' LEU . 6.6 mt 157.27 44.77 0.0 OUTLIER 'General case' 0 N--CA 1.503 2.183 0 C-N-CA 126.364 1.866 . . . . 64.23 108.6 -174.191 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 114' ' ' LEU . . . . . 0.445 ' N ' ' HA ' ' A' ' 109' ' ' LEU . 1.0 OUTLIER 76.03 -13.96 0.84 Allowed 'General case' 0 N--CA 1.503 2.194 0 C-N-CA 125.387 1.475 . . . . 74.1 111.788 174.703 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 115' ' ' VAL . . . . . 0.683 HG11 ' HA ' ' A' ' 119' ' ' PRO . 19.9 m -88.39 157.27 50.43 Favored Pre-proline 0 CA--C 1.548 0.9 0 C-N-CA 124.39 1.076 . . . . 75.42 110.266 -178.395 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 76.7 Cg_exo -53.02 -42.28 65.69 Favored 'Trans proline' 0 C--N 1.378 2.083 0 C-N-CA 123.242 2.628 . . . . 75.45 113.221 178.374 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 12.7 p-10 -166.46 -35.85 0.03 OUTLIER 'General case' 0 N--CA 1.484 1.268 0 C-N-CA 123.035 0.534 . . . . 72.34 111.218 -176.915 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -123.02 135.66 26.1 Favored Pre-proline 0 N--CA 1.477 0.918 0 C-N-CA 123.331 0.652 . . . . 73.14 109.856 -178.349 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 119' ' ' PRO . . . . . 0.683 ' HA ' HG11 ' A' ' 115' ' ' VAL . 91.9 Cg_endo -81.67 55.34 5.48 Favored 'Trans proline' 0 C--N 1.379 2.152 0 C-N-CA 123.43 2.753 . . . . 75.24 111.324 176.815 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . 101.1 -133.64 11.4 Favored Glycine 0 C--N 1.343 0.924 0 CA-C-N 114.024 -1.444 . . . . 73.52 111.263 -172.577 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . 62.81 13.75 6.77 Favored 'General case' 0 N--CA 1.488 1.472 0 C-N-CA 124.681 1.192 . . . . 55.11 112.434 -179.988 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 122' ' ' SER . . . . . . . . . . . . . 20.3 m . . . . . 0 C--O 1.252 1.207 0 C-N-CA 124.269 1.028 . . . . 73.22 108.961 -175.862 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . 0.516 ' HG3' HG23 ' A' ' 5' ' ' VAL . 21.0 ptt? . . . . . 0 N--CA 1.486 1.339 0 CA-C-O 120.963 0.411 . . . . 44.23 110.5 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 43.8 m -54.98 -61.32 2.39 Favored 'General case' 0 N--CA 1.482 1.141 0 C-N-CA 123.571 0.748 . . . . 53.04 112.344 -172.107 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 17.0 m -63.78 -28.66 70.02 Favored 'General case' 0 N--CA 1.478 0.962 0 C-N-CA 123.529 0.732 . . . . 74.04 112.341 -174.726 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 23.6 m -77.96 -36.56 48.98 Favored 'General case' 0 CA--C 1.549 0.934 0 C-N-CA 123.421 0.688 . . . . 51.23 111.569 -179.665 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . 0.516 HG23 ' HG3' ' A' ' 1' ' ' MET . 51.5 t -71.08 -38.62 72.22 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.107 0 C-N-CA 122.851 0.46 . . . . 73.44 110.143 175.76 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . 0.54 ' HB3' ' NH1' ' A' ' 10' ' ' ARG . 45.6 mm-40 -60.83 -45.38 94.68 Favored 'General case' 0 N--CA 1.478 0.931 0 O-C-N 123.639 0.587 . . . . 74.4 110.128 173.48 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 81.8 t80 -53.09 -58.75 5.94 Favored 'General case' 0 CA--C 1.549 0.934 0 C-N-CA 125.242 1.417 . . . . 73.2 111.534 176.646 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . 0.454 ' O ' ' HG3' ' A' ' 12' ' ' GLN . 70.6 mt -61.1 -45.78 97.91 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.015 0 O-C-N 123.766 0.666 . . . . 74.14 110.559 -178.78 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 4.3 t-20 -64.89 -29.54 70.5 Favored 'General case' 0 N--CA 1.482 1.132 0 C-N-CA 123.539 0.736 . . . . 65.55 111.379 -175.814 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . 0.593 ' HB3' HG22 ' A' ' 47' ' ' VAL . 68.3 mtt85 -78.55 -32.17 47.74 Favored 'General case' 0 CA--C 1.541 0.627 0 C-N-CA 122.986 0.514 . . . . 70.4 111.214 176.571 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' TRP . . . . . . . . . . . . . 85.5 m95 -71.01 -29.92 66.0 Favored 'General case' 0 N--CA 1.487 1.399 0 CA-C-N 117.53 0.15 . . . . 75.3 111.007 169.987 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . 0.578 ' HG2' ' CE2' ' A' ' 67' ' ' TYR . 42.9 mt-30 -63.61 -46.81 84.05 Favored 'General case' 0 C--N 1.357 0.928 0 N-CA-C 108.329 -0.989 . . . . 65.14 108.329 170.78 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 11.9 tpt180 -55.77 -49.45 73.12 Favored 'General case' 0 CA--C 1.544 0.73 0 O-C-N 124.375 1.047 . . . . 74.41 111.513 -179.118 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 54.1 mt -63.69 -45.07 98.41 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.292 0 O-C-N 123.271 0.357 . . . . 65.4 110.301 179.25 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . 0.594 ' HA ' ' HB ' ' A' ' 71' ' ' THR . . . -56.46 -45.45 80.87 Favored 'General case' 0 N--CA 1.485 1.321 0 C-N-CA 123.959 0.904 . . . . 43.54 111.664 178.572 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.404 ' HG ' ' O ' ' A' ' 12' ' ' GLN . 95.9 mt -79.38 -35.75 40.28 Favored 'General case' 0 N--CA 1.478 0.933 0 CA-C-N 114.562 -1.199 . . . . 72.13 111.233 -172.352 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.472 ' O ' ' HG ' ' A' ' 21' ' ' LEU . 45.6 mt -66.21 -51.84 53.74 Favored 'General case' 0 N--CA 1.476 0.849 0 O-C-N 123.655 0.597 . . . . 74.44 109.774 178.518 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 88.4 p -62.21 -38.47 89.3 Favored 'General case' 0 N--CA 1.479 0.981 0 C-N-CA 123.229 0.612 . . . . 72.12 111.031 179.457 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 19' ' ' GLN . . . . . 0.4 HE21 ' NE2' ' A' ' 70' ' ' GLN . 6.7 tp-100 -58.61 -48.97 79.2 Favored 'General case' 0 C--N 1.356 0.867 0 O-C-N 123.873 0.733 . . . . 74.42 110.858 174.311 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . 0.412 ' O ' ' HG ' ' A' ' 24' ' ' LEU . 69.2 m -61.09 -46.6 89.98 Favored 'General case' 0 C--O 1.213 -0.851 0 O-C-N 124.053 0.846 . . . . 61.44 110.159 178.609 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . 0.472 ' HG ' ' O ' ' A' ' 17' ' ' LEU . 68.5 mt -68.44 -27.53 66.26 Favored 'General case' 0 CA--C 1.537 0.471 0 C-N-CA 123.328 0.651 . . . . 73.04 111.125 -175.469 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.686 ' HA ' HD21 ' A' ' 78' ' ' LEU . 46.4 tp -71.67 -48.36 48.07 Favored 'General case' 0 N--CA 1.477 0.875 0 N-CA-C 109.372 -0.603 . . . . 32.44 109.372 176.639 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . 0.432 ' HB3' ' NH1' ' A' ' 27' ' ' ARG . 45.1 mt-10 -54.51 -55.14 32.19 Favored 'General case' 0 N--CA 1.479 0.984 0 O-C-N 124.3 1.0 . . . . 62.53 110.365 175.656 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.412 ' HG ' ' O ' ' A' ' 20' ' ' SER . 92.5 mt -61.13 -45.7 93.58 Favored 'General case' 0 CA--C 1.541 0.632 0 CA-C-N 114.683 -1.144 . . . . 62.55 111.356 -176.445 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . 0.515 ' HB2' HD21 ' A' ' 33' ' ' LEU . . . -59.62 -46.65 88.36 Favored 'General case' 0 N--CA 1.482 1.142 0 C-N-CA 122.969 0.507 . . . . 51.5 111.609 -178.94 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 95.1 mt-30 -72.4 -23.04 61.04 Favored 'General case' 0 CA--C 1.549 0.905 0 CA-C-N 115.589 -0.732 . . . . 65.44 111.551 -179.174 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . 0.432 ' NH1' ' HB3' ' A' ' 23' ' ' GLU . 88.9 mtt180 -88.63 4.85 45.59 Favored 'General case' 0 N--CA 1.487 1.387 0 C-N-CA 123.537 0.735 . . . . 74.21 111.776 174.304 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 77.76 9.18 87.07 Favored Glycine 0 C--N 1.352 1.466 0 N-CA-C 114.122 0.409 . . . . 62.43 114.122 177.117 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . 0.46 ' HB3' HD12 ' A' ' 32' ' ' LEU . 18.1 mm-40 -86.04 49.65 1.82 Allowed 'General case' 0 CA--C 1.556 1.18 0 C-N-CA 124.296 1.038 . . . . 64.2 110.259 178.287 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 30' ' ' TRP . . . . . 0.485 ' HA ' HD13 ' A' ' 33' ' ' LEU . 74.8 m95 -62.5 -30.47 71.3 Favored 'General case' 0 N--CA 1.485 1.297 0 C-N-CA 123.376 0.67 . . . . 73.34 111.027 -176.406 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 17.2 m-20 -56.27 -44.72 80.01 Favored 'General case' 0 N--CA 1.472 0.657 0 C-N-CA 123.781 0.833 . . . . 52.25 111.019 176.225 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.46 HD12 ' HB3' ' A' ' 29' ' ' GLU . 96.2 mt -64.21 -30.1 71.17 Favored 'General case' 0 CA--C 1.552 1.033 0 CA-C-N 115.755 -0.657 . . . . 72.11 110.927 -179.912 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . 0.515 HD21 ' HB2' ' A' ' 25' ' ' ALA . 8.4 mp -66.75 -41.93 86.99 Favored 'General case' 0 N--CA 1.491 1.584 0 C-N-CA 122.536 0.335 . . . . 70.1 110.574 171.389 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 71.8 mt -59.61 -45.43 91.97 Favored 'General case' 0 N--CA 1.484 1.241 0 C-N-CA 123.106 0.563 . . . . 74.4 111.456 -179.217 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 10.4 mp0 -71.22 -28.16 64.0 Favored 'General case' 0 N--CA 1.483 1.213 0 C-N-CA 123.188 0.595 . . . . 71.33 111.875 177.466 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 86.3 mm-40 -88.88 -11.72 43.81 Favored 'General case' 0 N--CA 1.485 1.311 0 N-CA-C 112.907 0.706 . . . . 64.52 112.907 179.027 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . 0.451 ' O ' ' HG ' ' A' ' 41' ' ' LEU . 38.5 tt0 -47.52 -59.66 3.08 Favored 'General case' 0 N--CA 1.481 1.118 0 C-N-CA 124.109 0.964 . . . . 72.44 112.394 -178.696 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 73.9 t -57.52 -41.06 78.1 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.28 0 C-N-CA 123.255 0.622 . . . . 72.22 111.375 -179.365 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 42.9 m -61.98 -43.74 98.19 Favored 'General case' 0 CA--C 1.543 0.71 0 C-N-CA 123.36 0.664 . . . . 62.11 111.431 179.351 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 47.6 t80 -69.34 -48.5 61.2 Favored 'General case' 0 N--CA 1.468 0.469 0 CA-C-N 115.567 -0.742 . . . . 72.13 110.471 -176.476 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . 0.472 HD22 HD21 ' A' ' 92' ' ' LEU . 46.5 mt -66.08 -44.51 84.25 Favored 'General case' 0 CA--C 1.538 0.502 0 O-C-N 124.485 1.116 . . . . 65.01 110.408 -176.371 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 48.3 tt0 -58.95 -49.95 75.89 Favored 'General case' 0 N--CA 1.473 0.681 0 O-C-N 123.695 0.622 . . . . 73.14 110.132 178.576 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . 0.563 ' O ' HG23 ' A' ' 47' ' ' VAL . 69.5 m -58.93 -55.29 37.02 Favored 'General case' 0 C--N 1.354 0.761 0 O-C-N 123.803 0.689 . . . . 64.31 111.808 -178.989 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 10.1 tt -60.38 -42.44 90.9 Favored 'Isoleucine or valine' 0 CA--C 1.557 1.236 0 C-N-CA 122.854 0.461 . . . . 73.3 111.395 -173.994 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . 0.434 ' O ' ' HG3' ' A' ' 49' ' ' GLU . 8.6 mm-40 -61.57 -49.25 77.42 Favored 'General case' 0 N--CA 1.48 1.066 0 C-N-CA 123.056 0.542 . . . . 72.21 111.035 176.224 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 46' ' ' THR . . . . . 0.542 ' O ' ' HD3' ' A' ' 50' ' ' LYS . 95.9 m -57.53 -43.12 84.08 Favored 'General case' 0 N--CA 1.479 1.003 0 C-N-CA 123.802 0.841 . . . . 63.55 111.825 -177.141 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 47' ' ' VAL . . . . . 0.593 HG22 ' HB3' ' A' ' 10' ' ' ARG . 30.5 t -67.82 -42.56 86.07 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.717 0 C-N-CA 122.868 0.467 . . . . 73.34 110.163 -179.543 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 48' ' ' MET . . . . . . . . . . . . . 79.1 mtm -70.58 -15.57 62.77 Favored 'General case' 0 N--CA 1.48 1.074 0 N-CA-C 112.286 0.476 . . . . 75.14 112.286 177.809 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . 0.434 ' HG3' ' O ' ' A' ' 45' ' ' GLU . 62.5 mt-10 -73.29 -35.99 66.22 Favored 'General case' 0 N--CA 1.488 1.463 0 CA-C-N 118.152 0.433 . . . . 61.44 111.436 171.664 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . 0.542 ' HD3' ' O ' ' A' ' 46' ' ' THR . 10.8 mptt -78.32 135.86 37.59 Favored 'General case' 0 N--CA 1.483 1.2 0 C-N-CA 123.162 0.585 . . . . 74.31 111.192 -170.552 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 8.0 tt0 -69.15 148.29 50.13 Favored 'General case' 0 N--CA 1.474 0.747 0 C-N-CA 124.276 1.03 . . . . 71.51 110.791 177.632 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 25.1 m -65.7 127.03 92.75 Favored Pre-proline 0 CA--C 1.555 1.137 0 C-N-CA 123.893 0.877 . . . . 61.44 110.643 178.296 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 15.3 Cg_exo -69.84 151.32 68.56 Favored 'Trans proline' 0 C--N 1.38 2.235 0 C-N-CA 121.912 1.741 . . . . 64.43 111.372 173.01 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 41.7 Cg_endo -67.81 -44.12 4.5 Favored 'Trans proline' 0 C--N 1.372 1.774 0 C-N-CA 122.999 2.466 . . . . 74.5 112.035 173.832 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . -76.68 66.86 2.68 Favored Glycine 0 C--N 1.352 1.427 0 CA-C-N 116.029 -0.532 . . . . 50.02 113.645 -178.349 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 56' ' ' ILE . . . . . 0.426 HG23 HG22 ' A' ' 60' ' ' ILE . 58.2 mt -110.0 106.45 20.75 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.653 0 N-CA-C 107.41 -1.329 . . . . 73.22 107.41 170.107 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 57' ' ' THR . . . . . 0.434 ' H ' HD12 ' A' ' 60' ' ' ILE . 31.2 p -75.08 178.8 5.41 Favored 'General case' 0 N--CA 1.473 0.723 0 C-N-CA 122.911 0.484 . . . . 73.35 110.244 -179.314 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 40.8 tpt85 -64.08 -46.53 83.88 Favored 'General case' 0 N--CA 1.471 0.606 0 C-N-CA 123.273 0.629 . . . . 70.05 109.961 -179.964 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 31.8 m -63.01 -40.57 98.17 Favored 'General case' 0 CA--C 1.547 0.827 0 CA-C-N 115.596 -0.729 . . . . 70.22 111.34 178.264 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 60' ' ' ILE . . . . . 0.434 HD12 ' H ' ' A' ' 57' ' ' THR . 74.8 mt -63.16 -41.41 92.72 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.163 0 C-N-CA 122.962 0.505 . . . . 60.44 110.608 176.064 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 61.1 tt0 -59.82 -42.65 93.99 Favored 'General case' 0 N--CA 1.476 0.859 0 C-N-CA 123.641 0.776 . . . . 73.3 110.429 179.493 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 50.0 m-20 -68.23 -45.65 72.7 Favored 'General case' 0 N--CA 1.48 1.025 0 O-C-N 123.563 0.54 . . . . 75.02 112.227 178.374 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 63' ' ' MET . . . . . . . . . . . . . 65.4 mtm -64.24 -49.93 69.99 Favored 'General case' 0 N--CA 1.486 1.337 0 C-N-CA 122.331 0.253 . . . . 72.31 110.876 -177.281 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 64' ' ' VAL . . . . . 0.503 ' O ' HG13 ' A' ' 68' ' ' ILE . 82.1 t -60.46 -54.99 27.5 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.815 0 O-C-N 124.171 0.919 . . . . 64.14 110.945 178.238 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -65.99 -28.8 69.15 Favored 'General case' 0 N--CA 1.494 1.765 0 CA-C-N 118.492 0.587 . . . . 74.5 112.083 -178.817 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -69.23 -38.86 82.63 Favored Glycine 0 C--N 1.343 0.966 0 N-CA-C 111.386 -0.685 . . . . 71.31 111.386 176.407 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 67' ' ' TYR . . . . . 0.578 ' CE2' ' HG2' ' A' ' 12' ' ' GLN . 10.8 m-85 -71.0 -36.01 72.29 Favored 'General case' 0 N--CA 1.467 0.413 0 C-N-CA 123.605 0.762 . . . . 64.11 111.134 175.059 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 68' ' ' ILE . . . . . 0.562 ' O ' ' HG ' ' A' ' 72' ' ' LEU . 60.8 mt -63.18 -48.54 87.14 Favored 'Isoleucine or valine' 0 C--N 1.36 1.042 0 N-CA-C 108.649 -0.871 . . . . 73.2 108.649 176.22 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 69' ' ' LYS . . . . . 0.616 ' HB2' ' HE2' ' A' ' 106' ' ' TYR . 0.7 OUTLIER -57.67 -48.22 80.12 Favored 'General case' 0 C--N 1.356 0.861 0 C-N-CA 123.58 0.752 . . . . 72.3 110.297 -179.06 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 70' ' ' GLN . . . . . 0.4 ' NE2' HE21 ' A' ' 19' ' ' GLN . 59.7 tt0 -60.22 -45.7 92.32 Favored 'General case' 0 C--N 1.347 0.489 0 O-C-N 124.491 1.119 . . . . 65.52 110.979 -179.026 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 71' ' ' THR . . . . . 0.594 ' HB ' ' HA ' ' A' ' 15' ' ' ALA . 15.1 t -77.9 -22.97 48.87 Favored 'General case' 0 C--N 1.354 0.779 0 CA-C-O 119.329 -0.367 . . . . 74.12 110.257 -175.554 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 72' ' ' LEU . . . . . 0.562 ' HG ' ' O ' ' A' ' 68' ' ' ILE . 28.6 mt -63.81 -50.94 66.97 Favored 'General case' 0 C--N 1.359 0.986 0 N-CA-C 108.524 -0.917 . . . . 74.13 108.524 171.831 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 73' ' ' ASP . . . . . 0.477 ' O ' ' HG ' ' A' ' 77' ' ' LEU . 60.6 m-20 -62.4 -53.75 50.42 Favored 'General case' 0 N--CA 1.476 0.842 0 O-C-N 124.363 1.039 . . . . 72.32 111.264 -178.349 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 74' ' ' ASN . . . . . 0.469 ' HA ' HD22 ' A' ' 22' ' ' LEU . 74.7 m-20 -54.32 -53.93 47.25 Favored 'General case' 0 N--CA 1.487 1.403 0 C-N-CA 123.647 0.779 . . . . 61.43 110.825 -178.904 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 43.1 tt0 -66.47 -31.03 71.51 Favored 'General case' 0 CA--C 1.549 0.942 0 C-N-CA 123.802 0.841 . . . . 70.15 111.548 -178.46 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 76' ' ' GLN . . . . . 0.495 ' HB2' ' O ' ' A' ' 72' ' ' LEU . 8.1 tt0 -74.86 -36.36 62.32 Favored 'General case' 0 N--CA 1.482 1.155 0 N-CA-C 109.906 -0.405 . . . . 52.3 109.906 -178.597 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . 0.477 ' HG ' ' O ' ' A' ' 73' ' ' ASP . 89.5 mt -67.38 -40.7 85.7 Favored 'General case' 0 C--N 1.351 0.654 0 O-C-N 123.84 0.712 . . . . 64.25 109.347 176.602 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . 0.686 HD21 ' HA ' ' A' ' 22' ' ' LEU . 73.0 mt -63.82 -62.85 1.38 Allowed 'General case' 0 N--CA 1.482 1.131 0 C-N-CA 123.915 0.886 . . . . 44.33 112.242 177.739 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 79' ' ' LYS . . . . . 0.47 ' HE2' ' HG ' ' A' ' 89' ' ' LEU . 1.0 OUTLIER -66.43 -32.89 74.54 Favored 'General case' 0 N--CA 1.476 0.873 0 C-N-CA 123.558 0.743 . . . . 72.2 110.479 -174.442 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -65.85 -40.68 95.65 Favored Glycine 0 C--N 1.349 1.262 0 CA-C-N 115.832 -0.622 . . . . 62.31 112.353 173.843 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . 0.433 ' HB2' ' O ' ' A' ' 77' ' ' LEU . 6.0 tt -62.13 -40.22 95.18 Favored 'General case' 0 N--CA 1.487 1.377 0 C-N-CA 124.217 1.007 . . . . 72.13 109.612 175.743 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 82' ' ' LEU . . . . . 0.443 HD12 ' HA ' ' A' ' 79' ' ' LYS . 99.1 mt -58.1 -52.8 64.03 Favored 'General case' 0 C--N 1.358 0.96 0 O-C-N 124.07 0.856 . . . . 72.42 110.11 -179.391 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 21.5 tp60 -169.67 -45.76 0.02 OUTLIER 'General case' 0 N--CA 1.48 1.045 0 O-C-N 123.844 0.715 . . . . 73.32 112.08 176.275 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -148.37 147.73 29.56 Favored 'General case' 0 N--CA 1.486 1.345 0 N-CA-C 109.403 -0.592 . . . . 55.24 109.403 -170.007 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 85' ' ' ARG . . . . . . . . . . . . . 19.6 ttm-85 -48.93 -51.82 28.07 Favored 'General case' 0 N--CA 1.485 1.314 0 C-N-CA 124.282 1.033 . . . . 73.21 111.969 179.335 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 86' ' ' LEU . . . . . 0.437 ' HB3' ' HA ' ' A' ' 96' ' ' SER . 75.0 mt -83.46 -0.31 49.52 Favored 'General case' 0 CA--C 1.552 1.031 0 CA-C-N 114.927 -1.033 . . . . 74.01 112.548 -172.248 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 26.6 t70 -67.21 172.69 4.46 Favored 'General case' 0 N--CA 1.49 1.563 0 C-N-CA 124.385 1.074 . . . . 52.3 110.603 177.302 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 88' ' ' GLU . . . . . 0.407 ' CD ' ' HZ3' ' A' ' 79' ' ' LYS . 13.7 tp10 -153.13 157.1 39.85 Favored 'General case' 0 CA--C 1.549 0.906 0 C-N-CA 122.989 0.516 . . . . 62.14 110.6 -174.888 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . 0.47 ' HG ' ' HE2' ' A' ' 79' ' ' LYS . 92.7 mt -61.27 -51.2 69.92 Favored 'General case' 0 N--CA 1.476 0.858 0 C-N-CA 124.849 1.26 . . . . 74.11 111.318 175.194 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 18.4 t -154.84 -164.83 1.89 Allowed 'General case' 0 CA--C 1.558 1.283 0 C-N-CA 122.871 0.468 . . . . 71.32 110.217 -178.284 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 14.5 p -75.6 107.06 7.5 Favored 'General case' 0 CA--C 1.557 1.229 0 N-CA-C 114.14 1.163 . . . . 62.3 114.14 -167.929 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 92' ' ' LEU . . . . . 0.472 HD21 HD22 ' A' ' 41' ' ' LEU . 59.5 mt -89.62 -154.73 0.33 Allowed 'General case' 0 N--CA 1.484 1.254 0 C-N-CA 124.346 1.058 . . . . 60.23 108.317 162.789 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 93' ' ' ILE . . . . . 0.539 ' HB ' HG21 ' A' ' 97' ' ' THR . 68.7 mt -51.26 -40.88 23.66 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.61 0 CA-C-O 121.364 0.602 . . . . 55.31 110.401 167.072 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 179.07 -174.69 46.7 Favored Glycine 0 C--O 1.242 0.63 0 CA-C-N 114.724 -1.125 . . . . 25.24 110.711 175.211 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 18.3 mm100 -75.82 149.53 37.87 Favored 'General case' 0 CA--C 1.541 0.631 0 N-CA-C 110.172 -0.307 . . . . 60.53 110.172 174.722 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 96' ' ' SER . . . . . 0.437 ' HA ' ' HB3' ' A' ' 86' ' ' LEU . 29.9 t 75.77 -16.6 0.58 Allowed 'General case' 0 N--CA 1.484 1.247 0 C-N-CA 125.865 1.666 . . . . 44.02 113.119 -174.554 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 97' ' ' THR . . . . . 0.539 HG21 ' HB ' ' A' ' 93' ' ' ILE . 86.7 m -59.52 -36.86 76.93 Favored 'General case' 0 N--CA 1.477 0.89 0 C-N-CA 123.4 0.68 . . . . 70.24 112.186 -176.109 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 98' ' ' ARG . . . . . 0.547 ' HG3' ' H ' ' A' ' 99' ' ' GLN . 0.0 OUTLIER -56.42 -57.28 12.98 Favored 'General case' 0 CA--C 1.554 1.119 0 O-C-N 123.434 0.459 . . . . 74.32 111.665 -178.936 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 99' ' ' GLN . . . . . 0.547 ' H ' ' HG3' ' A' ' 98' ' ' ARG . 23.1 tm0? -78.64 -42.48 28.65 Favored 'General case' 0 C--N 1.349 0.558 0 N-CA-C 109.28 -0.637 . . . . 73.12 109.28 -170.643 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 4.5 tppp? -62.53 -52.36 63.77 Favored 'General case' 0 CA--C 1.539 0.525 0 O-C-N 123.707 0.629 . . . . 74.55 110.992 -176.592 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 33.3 t -72.89 -36.87 67.41 Favored 'General case' 0 CA--C 1.543 0.692 0 O-C-N 123.61 0.569 . . . . 74.51 111.449 -174.973 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 5.0 tp -75.98 -32.81 59.65 Favored 'General case' 0 N--CA 1.487 1.403 0 CA-C-N 118.21 0.459 . . . . 63.21 111.4 -177.743 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 25.9 t-20 -78.91 -31.03 45.14 Favored 'General case' 0 N--CA 1.489 1.517 0 C-N-CA 123.326 0.65 . . . . 62.55 110.35 176.87 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 53.1 t30 -66.03 -38.75 89.21 Favored 'General case' 0 N--CA 1.487 1.393 0 C-N-CA 123.604 0.761 . . . . 75.45 109.384 171.859 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -60.49 -48.57 81.18 Favored 'General case' 0 CA--C 1.54 0.586 0 CA-C-N 115.002 -0.999 . . . . 73.52 110.522 175.459 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 106' ' ' TYR . . . . . 0.616 ' HE2' ' HB2' ' A' ' 69' ' ' LYS . 6.3 t80 -56.28 -45.07 80.29 Favored 'General case' 0 C--N 1.355 0.84 0 O-C-N 123.62 0.575 . . . . 72.42 110.18 174.702 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -58.32 -43.56 95.55 Favored Glycine 0 C--N 1.354 1.568 0 O-C-N 123.842 0.714 . . . . 71.33 112.882 -177.285 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 99.7 mtt180 -68.47 -37.93 80.6 Favored 'General case' 0 CA--C 1.544 0.715 0 C-N-CA 123.196 0.598 . . . . 73.52 111.116 177.615 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 109' ' ' LEU . . . . . 0.492 ' HA ' ' N ' ' A' ' 114' ' ' LEU . 35.8 tp -72.84 -31.15 64.57 Favored 'General case' 0 N--CA 1.488 1.449 0 C-N-CA 123.06 0.544 . . . . 65.42 111.554 -178.383 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 33.3 t -79.87 -32.55 40.43 Favored 'General case' 0 CA--C 1.537 0.48 0 C-N-CA 123.789 0.836 . . . . 65.05 109.337 178.148 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . -87.9 -64.35 1.36 Allowed Glycine 0 C--N 1.36 1.904 0 CA-C-O 119.164 -0.798 . . . . 62.21 113.606 -178.439 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 112' ' ' MET . . . . . . . . . . . . . 21.7 mmm -96.98 -69.0 0.77 Allowed 'General case' 0 N--CA 1.489 1.518 0 CA-C-N 118.34 1.07 . . . . 74.04 113.194 178.058 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 13.6 tp 172.03 25.7 0.0 OUTLIER 'General case' 0 N--CA 1.495 1.786 0 O-C-N 123.77 0.669 . . . . 74.24 110.888 -173.3 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 114' ' ' LEU . . . . . 0.492 ' N ' ' HA ' ' A' ' 109' ' ' LEU . 41.5 tp 84.2 -12.33 0.79 Allowed 'General case' 0 N--CA 1.501 2.092 0 C-N-CA 126.571 1.948 . . . . 71.14 111.9 -177.443 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 115' ' ' VAL . . . . . . . . . . . . . 35.9 m -66.77 143.94 98.32 Favored Pre-proline 0 CA--C 1.553 1.083 0 C-N-CA 122.502 0.321 . . . . 74.31 110.169 173.233 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 21.5 Cg_exo -65.74 163.69 29.57 Favored 'Trans proline' 0 C--N 1.375 1.963 0 C-N-CA 122.475 2.117 . . . . 73.22 112.281 176.611 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 17.4 m-20 59.79 79.88 0.22 Allowed 'General case' 0 N--CA 1.474 0.726 0 C-N-CA 125.018 1.327 . . . . 73.31 110.379 -176.558 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -110.22 91.67 11.92 Favored Pre-proline 0 CA--C 1.549 0.936 0 C-N-CA 123.715 0.806 . . . . 71.23 110.437 -179.293 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 119' ' ' PRO . . . . . . . . . . . . . 91.4 Cg_endo -76.12 -11.27 19.51 Favored 'Trans proline' 0 C--N 1.378 2.083 0 C-N-CA 122.95 2.433 . . . . 75.44 112.398 175.5 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . 130.28 137.38 4.16 Favored Glycine 0 C--N 1.347 1.151 0 N-CA-C 111.24 -0.744 . . . . 43.35 111.24 -178.97 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . -151.88 156.47 40.19 Favored 'General case' 0 N--CA 1.475 0.793 0 C-N-CA 123.575 0.75 . . . . 64.15 110.762 177.317 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 122' ' ' SER . . . . . . . . . . . . . 29.7 t . . . . . 0 CA--C 1.558 1.263 0 C-N-CA 123.964 0.906 . . . . 62.22 108.743 -179.196 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . 0.605 ' HG2' ' HB ' ' A' ' 4' ' ' THR . 0.0 OUTLIER . . . . . 0 CA--C 1.55 0.96 0 N-CA-C 109.362 -0.607 . . . . 74.14 109.362 . . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 42.2 p -57.81 -48.05 80.85 Favored 'General case' 0 N--CA 1.479 1.011 0 C-N-CA 124.411 1.084 . . . . 62.24 113.555 -166.531 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 36.2 m -66.08 -38.52 88.49 Favored 'General case' 0 N--CA 1.476 0.873 0 O-C-N 123.522 0.514 . . . . 70.54 111.543 -176.078 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . 0.618 ' HA ' ' HG3' ' A' ' 53' ' ' PRO . 15.0 m -76.24 -38.65 56.07 Favored 'General case' 0 N--CA 1.475 0.822 0 O-C-N 123.576 0.547 . . . . 62.25 112.155 -176.575 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 85.5 t -67.86 -40.52 83.7 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.87 0 N-CA-C 109.612 -0.514 . . . . 74.33 109.612 177.109 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . 0.505 ' O ' ' HG3' ' A' ' 10' ' ' ARG . 2.6 tm-20 -64.67 -36.83 85.53 Favored 'General case' 0 CA--C 1.549 0.922 0 C-N-CA 123.666 0.786 . . . . 73.34 109.854 175.694 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' PHE . . . . . 0.44 ' HZ ' HD13 ' A' ' 114' ' ' LEU . 81.3 t80 -64.26 -47.21 80.49 Favored 'General case' 0 N--CA 1.481 1.083 0 C-N-CA 124.764 1.225 . . . . 75.35 111.851 177.342 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . 0.436 ' O ' ' HG3' ' A' ' 12' ' ' GLN . 79.1 mt -62.99 -39.71 86.23 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.91 0 N-CA-C 109.042 -0.725 . . . . 41.42 109.042 175.588 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 2.4 t-20 -61.06 -35.54 77.21 Favored 'General case' 0 N--CA 1.484 1.231 0 C-N-CA 124.695 1.198 . . . . 61.21 111.151 178.146 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . 0.505 ' HG3' ' O ' ' A' ' 6' ' ' GLU . 42.1 mtt180 -59.15 -56.7 18.86 Favored 'General case' 0 N--CA 1.474 0.757 0 C-N-CA 123.473 0.709 . . . . 65.01 109.269 172.416 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' TRP . . . . . 0.424 ' CD1' HG13 ' A' ' 64' ' ' VAL . 93.8 m95 -69.68 -23.47 63.46 Favored 'General case' 0 N--CA 1.468 0.468 0 CA-C-N 114.966 -1.015 . . . . 74.52 112.758 -175.704 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . 0.436 ' HG3' ' O ' ' A' ' 8' ' ' ILE . 59.3 mt-30 -66.84 -50.37 62.77 Favored 'General case' 0 N--CA 1.473 0.724 0 N-CA-C 108.141 -1.059 . . . . 71.12 108.141 172.436 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . 0.575 ' HE ' HD11 ' A' ' 17' ' ' LEU . 13.2 tpt180 -57.25 -47.9 80.21 Favored 'General case' 0 CA--C 1.549 0.922 0 O-C-N 124.249 0.968 . . . . 71.45 111.221 -177.758 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 14' ' ' ILE . . . . . 0.661 HD11 HG21 ' A' ' 47' ' ' VAL . 49.0 mt -67.95 -46.17 82.45 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.063 0 CA-C-N 115.744 -0.662 . . . . 72.03 110.247 -177.309 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . 0.431 ' HB1' ' OE1' ' A' ' 70' ' ' GLN . . . -61.55 -44.79 96.4 Favored 'General case' 0 N--CA 1.484 1.265 0 C-N-CA 123.614 0.766 . . . . 64.11 112.038 -178.449 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 85.4 mt -71.18 -44.68 64.98 Favored 'General case' 0 N--CA 1.477 0.897 0 CA-C-N 114.838 -1.073 . . . . 64.24 110.843 -175.541 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.575 HD11 ' HE ' ' A' ' 13' ' ' ARG . 43.0 mt -72.24 -31.94 66.25 Favored 'General case' 0 N--CA 1.477 0.912 0 CA-C-O 118.874 -0.584 . . . . 71.01 112.025 -178.094 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 83.0 p -70.71 -39.45 73.41 Favored 'General case' 0 N--CA 1.486 1.34 0 CA-C-N 118.406 0.548 . . . . 73.1 110.284 175.944 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 19' ' ' GLN . . . . . 0.435 HE21 HE21 ' A' ' 70' ' ' GLN . 5.9 tp-100 -57.89 -43.6 86.22 Favored 'General case' 0 C--O 1.25 1.083 0 CA-C-N 115.344 -0.844 . . . . 75.35 110.079 172.183 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 49.8 m -60.01 -57.88 10.94 Favored 'General case' 0 C--N 1.353 0.753 0 CA-C-N 114.832 -1.076 . . . . 73.01 109.98 176.772 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . 0.539 HD22 ' HG ' ' A' ' 33' ' ' LEU . 65.1 mt -57.64 -33.77 68.64 Favored 'General case' 0 N--CA 1.479 0.989 0 C-N-CA 123.607 0.763 . . . . 63.15 111.241 -175.421 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.65 ' HA ' HD21 ' A' ' 78' ' ' LEU . 64.4 tp -63.34 -61.55 2.27 Favored 'General case' 0 C--O 1.251 1.149 0 O-C-N 123.791 0.682 . . . . 72.31 110.315 177.375 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . 0.468 ' O ' ' HG3' ' A' ' 27' ' ' ARG . 94.6 mt-10 -57.81 -48.0 80.99 Favored 'General case' 0 C--N 1.356 0.88 0 O-C-N 124.178 0.924 . . . . 74.52 110.58 -177.392 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 95.7 mt -62.02 -39.44 92.27 Favored 'General case' 0 N--CA 1.476 0.861 0 C-N-CA 124.558 1.143 . . . . 71.55 111.757 -176.605 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . 0.433 ' HB2' HD21 ' A' ' 33' ' ' LEU . . . -61.11 -44.36 97.47 Favored 'General case' 0 N--CA 1.484 1.228 0 CA-C-O 121.138 0.494 . . . . 53.23 110.904 175.958 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 81.5 mt-30 -68.03 -32.24 72.47 Favored 'General case' 0 CA--C 1.551 0.997 0 CA-C-N 114.937 -1.029 . . . . 70.24 111.471 177.3 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . 0.468 ' HG3' ' O ' ' A' ' 23' ' ' GLU . 89.3 mtt-85 -74.67 -20.06 60.02 Favored 'General case' 0 N--CA 1.486 1.366 0 C-N-CA 123.74 0.816 . . . . 74.11 111.226 178.811 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 94.44 5.68 61.66 Favored Glycine 0 C--N 1.351 1.385 0 O-C-N 123.272 0.358 . . . . 71.22 112.72 -176.237 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . 0.419 ' HG2' ' HB2' ' A' ' 27' ' ' ARG . 7.6 mm-40 -83.07 52.79 2.26 Favored 'General case' 0 CA--C 1.549 0.94 0 C-N-CA 124.058 0.943 . . . . 71.03 110.541 178.989 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 30' ' ' TRP . . . . . 0.468 ' O ' ' HG ' ' A' ' 34' ' ' LEU . 94.6 m95 -66.87 -23.81 66.06 Favored 'General case' 0 N--CA 1.473 0.695 0 C-N-CA 123.56 0.744 . . . . 71.43 111.454 -178.936 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 15.2 m-20 -54.22 -46.67 72.57 Favored 'General case' 0 N--CA 1.478 0.928 0 C-N-CA 123.754 0.821 . . . . 74.22 110.078 172.098 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 93.5 mt -63.26 -33.83 76.35 Favored 'General case' 0 C--O 1.215 -0.725 0 CA-C-N 114.905 -1.043 . . . . 75.05 110.81 178.069 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . 0.539 ' HG ' HD22 ' A' ' 21' ' ' LEU . 8.1 mp -68.36 -39.89 81.66 Favored 'General case' 0 N--CA 1.488 1.457 0 CA-C-N 118.053 0.388 . . . . 73.31 111.202 174.138 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.468 ' HG ' ' O ' ' A' ' 30' ' ' TRP . 93.8 mt -65.03 -38.37 90.67 Favored 'General case' 0 N--CA 1.487 1.386 0 C-N-CA 123.555 0.742 . . . . 62.51 111.542 -177.681 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 1.7 mp0 -77.22 -56.86 4.2 Favored 'General case' 0 N--CA 1.475 0.809 0 CA-C-N 116.068 -0.514 . . . . 64.53 110.643 176.986 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 82.3 mm-40 -66.81 -14.56 62.8 Favored 'General case' 0 N--CA 1.484 1.227 0 CA-C-O 118.726 -0.654 . . . . 50.15 112.6 -174.956 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 42.9 tt0 -52.79 -57.8 8.99 Favored 'General case' 0 N--CA 1.481 1.115 0 C-N-CA 123.666 0.786 . . . . 74.55 111.308 175.577 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 61.5 t -56.97 -43.88 81.61 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.163 0 C-N-CA 123.515 0.726 . . . . 70.22 111.318 -175.078 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 18.5 p -74.88 -45.49 42.59 Favored 'General case' 0 N--CA 1.477 0.91 0 C-N-CA 123.643 0.777 . . . . 63.14 112.343 -175.255 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 27.0 t80 -62.9 -42.78 99.9 Favored 'General case' 0 N--CA 1.482 1.155 0 C-N-CA 124.02 0.928 . . . . 73.54 110.821 179.963 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . 0.682 ' HA ' HG22 ' A' ' 44' ' ' ILE . 88.5 mt -78.47 -31.43 47.88 Favored 'General case' 0 C--O 1.222 -0.378 0 CA-C-N 115.556 -0.747 . . . . 64.33 111.175 -176.444 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 23.4 tm0? -59.59 -43.6 93.63 Favored 'General case' 0 N--CA 1.476 0.864 0 N-CA-C 108.831 -0.803 . . . . 71.15 108.831 170.005 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . 0.565 ' O ' HG23 ' A' ' 47' ' ' VAL . 61.6 m -60.59 -55.08 37.68 Favored 'General case' 0 C--N 1.353 0.728 0 O-C-N 123.946 0.779 . . . . 72.33 111.106 178.478 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 44' ' ' ILE . . . . . 0.682 HG22 ' HA ' ' A' ' 41' ' ' LEU . 17.2 tt -65.42 -34.51 70.92 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.329 0 C-N-CA 123.019 0.528 . . . . 74.0 111.697 -172.961 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 21.6 mm-40 -61.27 -50.35 73.38 Favored 'General case' 0 C--N 1.356 0.882 0 C-N-CA 123.494 0.718 . . . . 63.35 109.836 172.078 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 46' ' ' THR . . . . . 0.422 ' O ' ' HB2' ' A' ' 50' ' ' LYS . 97.5 m -54.12 -39.02 66.04 Favored 'General case' 0 N--CA 1.481 1.105 0 C-N-CA 124.352 1.061 . . . . 72.31 111.534 177.419 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 47' ' ' VAL . . . . . 0.661 HG21 HD11 ' A' ' 14' ' ' ILE . 84.5 t -68.57 -45.0 82.41 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.969 0 C-N-CA 124.005 0.922 . . . . 75.4 111.447 -178.317 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 48' ' ' MET . . . . . . . . . . . . . 77.5 mtm -67.34 -31.49 71.79 Favored 'General case' 0 N--CA 1.482 1.149 0 O-C-N 123.491 0.494 . . . . 73.55 111.29 178.214 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 48.2 mt-10 -72.2 -31.2 65.67 Favored 'General case' 0 N--CA 1.481 1.086 0 C-N-CA 123.652 0.781 . . . . 60.32 110.975 174.576 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . 0.422 ' HB2' ' O ' ' A' ' 46' ' ' THR . 4.6 tppt? -79.5 160.44 26.53 Favored 'General case' 0 N--CA 1.474 0.755 0 C-N-CA 123.151 0.58 . . . . 44.01 111.858 -168.871 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 8.7 tt0 -81.95 124.87 30.13 Favored 'General case' 0 C--O 1.241 0.642 0 CA-C-N 115.165 -0.925 . . . . 64.3 110.814 -176.968 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 52' ' ' THR . . . . . 0.791 HG21 ' HB3' ' A' ' 114' ' ' LEU . 96.7 m -69.93 122.85 87.35 Favored Pre-proline 0 CA--C 1.551 0.984 0 N-CA-C 109.162 -0.681 . . . . 74.03 109.162 166.765 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 53' ' ' PRO . . . . . 0.618 ' HG3' ' HA ' ' A' ' 4' ' ' THR . 72.0 Cg_endo -69.28 156.91 63.23 Favored 'Trans proline' 0 C--N 1.369 1.645 0 C-N-CA 123.002 2.468 . . . . 62.24 112.573 178.458 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 56.7 Cg_endo -70.7 -44.61 1.36 Allowed 'Trans proline' 0 C--N 1.371 1.723 0 C-N-CA 122.526 2.151 . . . . 74.43 111.471 172.194 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . -75.04 68.93 1.94 Allowed Glycine 0 C--N 1.352 1.419 0 N-CA-C 115.048 0.779 . . . . 41.01 115.048 -172.087 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 56' ' ' ILE . . . . . 0.527 HG23 HG22 ' A' ' 60' ' ' ILE . 84.5 mt -110.24 108.46 25.48 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.656 0 N-CA-C 107.579 -1.267 . . . . 72.34 107.579 176.53 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 42.8 p -82.27 -172.45 3.99 Favored 'General case' 0 N--CA 1.483 1.176 0 C-N-CA 123.016 0.526 . . . . 71.33 110.552 -177.625 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 29.8 tpt85 -63.06 -60.33 3.59 Favored 'General case' 0 N--CA 1.475 0.794 0 C-N-CA 123.275 0.63 . . . . 64.14 110.639 -178.771 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 21.0 m -62.4 -33.6 75.09 Favored 'General case' 0 N--CA 1.475 0.798 0 C-N-CA 123.595 0.758 . . . . 51.34 111.731 -178.101 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 60' ' ' ILE . . . . . 0.527 HG22 HG23 ' A' ' 56' ' ' ILE . 74.4 mt -65.07 -43.68 95.85 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.81 0 C-N-CA 122.921 0.488 . . . . 55.42 110.125 175.087 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 60.3 tt0 -64.55 -36.64 84.89 Favored 'General case' 0 N--CA 1.48 1.072 0 C-N-CA 123.322 0.649 . . . . 73.12 111.036 179.196 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 26.5 m-20 -65.64 -46.66 78.36 Favored 'General case' 0 N--CA 1.474 0.731 0 C-N-CA 123.001 0.52 . . . . 75.32 110.853 176.976 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 63' ' ' MET . . . . . . . . . . . . . 73.3 mtm -65.96 -46.67 77.27 Favored 'General case' 0 N--CA 1.476 0.867 0 O-C-N 123.307 0.38 . . . . 72.15 111.014 -179.692 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 64' ' ' VAL . . . . . 0.494 ' O ' HG13 ' A' ' 68' ' ' ILE . 52.0 t -63.78 -60.55 2.58 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.566 0 C-N-CA 123.474 0.709 . . . . 74.41 110.615 -178.535 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . 0.571 ' HB2' HD23 ' A' ' 109' ' ' LEU . . . -60.59 -33.11 72.25 Favored 'General case' 0 N--CA 1.487 1.397 0 O-C-N 123.403 0.44 . . . . 62.53 111.519 -179.896 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -65.03 -38.04 94.95 Favored Glycine 0 C--N 1.347 1.146 0 CA-C-N 116.3 -0.409 . . . . 63.44 112.316 175.743 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 67' ' ' TYR . . . . . 0.5 ' O ' HG22 ' A' ' 71' ' ' THR . 17.4 m-30 -74.72 -33.55 62.4 Favored 'General case' 0 N--CA 1.473 0.679 0 C-N-CA 123.218 0.607 . . . . 53.4 111.238 177.563 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 68' ' ' ILE . . . . . 0.494 HG13 ' O ' ' A' ' 64' ' ' VAL . 59.8 mt -63.68 -49.06 83.83 Favored 'Isoleucine or valine' 0 C--N 1.36 1.052 0 N-CA-C 108.663 -0.866 . . . . 71.41 108.663 175.63 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 69' ' ' LYS . . . . . 0.51 ' HB2' ' HE2' ' A' ' 106' ' ' TYR . 44.0 tptt -56.33 -44.65 80.21 Favored 'General case' 0 C--N 1.349 0.555 0 C-N-CA 123.572 0.749 . . . . 74.11 110.901 174.64 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 70' ' ' GLN . . . . . 0.435 HE21 HE21 ' A' ' 19' ' ' GLN . 63.4 tt0 -61.47 -45.72 93.06 Favored 'General case' 0 C--N 1.349 0.549 0 O-C-N 123.679 0.612 . . . . 71.02 111.077 -177.49 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 71' ' ' THR . . . . . 0.5 HG22 ' O ' ' A' ' 67' ' ' TYR . 3.0 t -74.7 -39.73 61.78 Favored 'General case' 0 C--N 1.355 0.824 0 CA-C-O 119.646 -0.216 . . . . 75.52 111.12 -175.185 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 72' ' ' LEU . . . . . 0.487 HD21 ' HB2' ' A' ' 102' ' ' LEU . 44.2 mt -64.85 -39.0 92.85 Favored 'General case' 0 N--CA 1.472 0.67 0 C-N-CA 122.11 0.164 . . . . 75.31 111.069 178.578 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 73' ' ' ASP . . . . . 0.444 ' O ' ' HG ' ' A' ' 77' ' ' LEU . 14.2 t70 -65.71 -59.63 3.72 Favored 'General case' 0 CA--C 1.543 0.686 0 O-C-N 123.994 0.809 . . . . 70.42 109.677 -178.702 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 84.1 m-20 -59.52 -45.22 92.38 Favored 'General case' 0 N--CA 1.485 1.317 0 C-N-CA 124.036 0.934 . . . . 55.11 111.778 -176.2 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 3.3 tm-20 -75.05 -29.86 60.85 Favored 'General case' 0 CA--C 1.555 1.166 0 CA-C-N 115.661 -0.7 . . . . 73.24 110.413 -174.477 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 9.4 tt0 -75.27 -29.62 60.21 Favored 'General case' 0 N--CA 1.488 1.458 0 O-C-N 122.056 -0.403 . . . . 75.33 110.746 175.076 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . 0.444 ' HG ' ' O ' ' A' ' 73' ' ' ASP . 93.2 mt -65.43 -39.99 92.77 Favored 'General case' 0 N--CA 1.48 1.07 0 N-CA-C 109.428 -0.582 . . . . 61.01 109.428 172.475 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . 0.65 HD21 ' HA ' ' A' ' 22' ' ' LEU . 72.7 mt -58.23 -47.67 82.81 Favored 'General case' 0 N--CA 1.477 0.889 0 CA-C-N 115.378 -0.828 . . . . 74.32 111.246 170.476 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 79' ' ' LYS . . . . . 0.477 ' HB3' ' HA ' ' A' ' 85' ' ' ARG . 25.9 mmtp -66.92 -28.56 68.4 Favored 'General case' 0 N--CA 1.475 0.81 0 C-N-CA 123.161 0.584 . . . . 62.24 112.463 -177.991 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -72.26 -33.99 61.38 Favored Glycine 0 C--N 1.347 1.175 0 N-CA-C 111.572 -0.611 . . . . 54.02 111.572 171.259 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 7.1 tt -73.61 -36.11 65.45 Favored 'General case' 0 CA--C 1.554 1.125 0 C-N-CA 124.224 1.009 . . . . 41.3 110.266 177.762 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 82' ' ' LEU . . . . . 0.411 ' HG ' ' O ' ' A' ' 78' ' ' LEU . 95.1 mt -77.84 -69.54 0.54 Allowed 'General case' 0 C--N 1.357 0.929 0 C-N-CA 123.078 0.551 . . . . 73.32 111.258 -171.973 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 78.6 mm-40 -159.92 -55.55 0.06 Allowed 'General case' 0 N--CA 1.487 1.404 0 C-N-CA 123.328 0.651 . . . . 64.44 110.05 -173.388 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 6.2 tp-100 -155.75 150.6 26.35 Favored 'General case' 0 N--CA 1.484 1.259 0 C-N-CA 122.913 0.485 . . . . 74.13 110.283 -171.432 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 85' ' ' ARG . . . . . 0.477 ' HA ' ' HB3' ' A' ' 79' ' ' LYS . 38.7 mtp180 -70.17 -49.67 48.06 Favored 'General case' 0 N--CA 1.487 1.392 0 C-N-CA 124.742 1.217 . . . . 62.52 112.786 -169.615 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 76.7 mt -88.76 -2.15 58.44 Favored 'General case' 0 N--CA 1.482 1.16 0 C-N-CA 123.194 0.597 . . . . 75.24 112.041 178.533 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 24.2 t70 -80.66 88.39 5.74 Favored 'General case' 0 N--CA 1.476 0.839 0 N-CA-C 108.427 -0.953 . . . . 65.21 108.427 172.964 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 88' ' ' GLU . . . . . 0.448 ' HB3' HD12 ' A' ' 92' ' ' LEU . 29.6 mm-40 -75.91 168.81 19.35 Favored 'General case' 0 CA--C 1.546 0.809 0 CA-C-N 114.968 -1.014 . . . . 73.02 112.143 -170.529 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . 0.446 ' HB2' HD11 ' A' ' 41' ' ' LEU . 95.4 mt -72.76 -176.0 1.87 Allowed 'General case' 0 CA--C 1.557 1.227 0 C-N-CA 123.91 0.884 . . . . 51.32 111.597 179.883 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 7.9 m -69.53 143.28 53.46 Favored 'General case' 0 N--CA 1.479 1.004 0 C-N-CA 123.771 0.828 . . . . 74.25 111.872 -175.162 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 11.2 t 68.38 30.98 5.21 Favored 'General case' 0 CA--C 1.559 1.31 0 C-N-CA 124.331 1.053 . . . . 71.51 111.609 173.24 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 92' ' ' LEU . . . . . 0.491 HD11 HD22 ' A' ' 41' ' ' LEU . 64.4 mt -108.22 165.68 11.31 Favored 'General case' 0 N--CA 1.49 1.536 0 C-N-CA 123.618 0.767 . . . . 73.12 110.324 171.763 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 59.0 mt -62.03 92.16 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.482 1.14 0 C-N-CA 124.365 1.066 . . . . 63.21 111.877 -172.954 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 60.78 30.57 73.05 Favored Glycine 0 C--N 1.353 1.499 0 CA-C-N 115.769 -0.651 . . . . 63.24 113.506 178.83 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 21.0 pt20 42.18 36.39 0.7 Allowed 'General case' 0 N--CA 1.497 1.918 0 C-N-CA 126.297 1.839 . . . . 73.14 112.849 -172.392 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 72.7 m -155.0 -168.48 2.89 Favored 'General case' 0 N--CA 1.48 1.051 0 C-N-CA 125.719 1.608 . . . . 73.11 107.873 178.138 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 54.0 m 76.83 -42.53 0.42 Allowed 'General case' 0 N--CA 1.49 1.564 0 C-N-CA 124.678 1.191 . . . . 73.31 113.473 170.159 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 1.1 tmm_? -50.81 -51.24 52.77 Favored 'General case' 0 N--CA 1.482 1.135 0 C-N-CA 125.301 1.44 . . . . 75.13 111.522 -170.291 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 30.8 tt0 -61.61 -45.82 92.44 Favored 'General case' 0 C--N 1.355 0.831 0 O-C-N 123.496 0.497 . . . . 71.21 109.975 -175.781 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 64.4 tttp -68.29 -29.26 67.99 Favored 'General case' 0 N--CA 1.482 1.162 0 O-C-N 124.098 0.874 . . . . 71.04 111.737 179.542 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 35.1 t -72.79 -41.29 65.14 Favored 'General case' 0 N--CA 1.478 0.957 0 C-N-CA 123.361 0.665 . . . . 44.43 110.282 -177.551 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 102' ' ' LEU . . . . . 0.487 ' HB2' HD21 ' A' ' 72' ' ' LEU . 9.2 mp -79.36 -23.73 43.16 Favored 'General case' 0 N--CA 1.476 0.841 0 CA-C-N 116.07 -0.514 . . . . 61.25 110.934 174.97 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -72.46 -34.15 67.52 Favored 'General case' 0 N--CA 1.482 1.175 0 N-CA-C 108.602 -0.888 . . . . 72.15 108.602 174.476 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 9.6 t30 -71.65 -37.34 70.83 Favored 'General case' 0 N--CA 1.474 0.753 0 CA-C-N 115.213 -0.903 . . . . 73.11 109.226 174.037 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 105' ' ' ALA . . . . . 0.454 ' O ' ' HG ' ' A' ' 114' ' ' LEU . . . -61.1 -48.96 79.25 Favored 'General case' 0 CA--C 1.538 0.502 0 O-C-N 123.733 0.646 . . . . 75.24 110.315 175.504 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 106' ' ' TYR . . . . . 0.51 ' HE2' ' HB2' ' A' ' 69' ' ' LYS . 7.8 t80 -61.14 -51.9 67.14 Favored 'General case' 0 CA--C 1.541 0.611 0 CA-C-N 116.008 -0.542 . . . . 73.34 109.733 179.564 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -63.37 -44.48 96.78 Favored Glycine 0 C--N 1.354 1.581 0 O-C-N 124.212 0.945 . . . . 74.35 113.19 -173.815 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 5.8 tpm_? -69.13 -34.29 74.79 Favored 'General case' 0 C--N 1.348 0.522 0 C-N-CA 122.996 0.518 . . . . 72.33 109.909 179.935 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 109' ' ' LEU . . . . . 0.571 HD23 ' HB2' ' A' ' 65' ' ' ALA . 54.9 tp -65.91 -45.76 80.75 Favored 'General case' 0 N--CA 1.488 1.426 0 C-N-CA 123.055 0.542 . . . . 62.2 110.616 176.072 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 42.4 t -59.59 -48.58 81.11 Favored 'General case' 0 CA--C 1.531 0.249 0 O-C-N 124.738 1.274 . . . . 73.12 110.551 -176.471 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . -85.4 -59.32 1.94 Allowed Glycine 0 C--N 1.356 1.646 0 CA-C-O 119.299 -0.723 . . . . 65.52 112.957 -178.463 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 112' ' ' MET . . . . . . . . . . . . . 8.0 tpt -93.07 -70.4 0.7 Allowed 'General case' 0 N--CA 1.489 1.479 0 CA-C-N 118.216 1.008 . . . . 75.52 113.143 -178.011 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 113' ' ' LEU . . . . . 0.521 ' HB3' HG22 ' A' ' 115' ' ' VAL . 15.1 tp 168.36 13.9 0.0 OUTLIER 'General case' 0 N--CA 1.507 2.379 0 C-N-CA 123.575 0.75 . . . . 74.44 112.267 -173.498 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 114' ' ' LEU . . . . . 0.791 ' HB3' HG21 ' A' ' 52' ' ' THR . 0.9 OUTLIER 72.78 10.05 5.51 Favored 'General case' 0 N--CA 1.502 2.138 0 C-N-CA 125.089 1.356 . . . . 72.32 109.98 -176.153 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 115' ' ' VAL . . . . . 0.521 HG22 ' HB3' ' A' ' 113' ' ' LEU . 35.3 m -105.71 130.16 23.49 Favored Pre-proline 0 CA--C 1.551 1.011 0 N-CA-C 107.933 -1.136 . . . . 74.21 107.933 173.912 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 86.7 Cg_endo -76.72 -178.08 4.25 Favored 'Trans proline' 0 C--N 1.372 1.782 0 C-N-CA 122.437 2.091 . . . . 73.12 112.208 -178.136 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 24.3 t70 77.31 -31.2 0.17 Allowed 'General case' 0 N--CA 1.49 1.539 0 C-N-CA 125.269 1.428 . . . . 63.24 112.676 174.461 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -104.48 135.66 19.29 Favored Pre-proline 0 N--CA 1.475 0.81 0 C-N-CA 123.709 0.803 . . . . 73.34 110.506 -179.991 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 119' ' ' PRO . . . . . . . . . . . . . 56.3 Cg_endo -88.8 157.7 6.11 Favored 'Trans proline' 0 C--N 1.372 1.77 0 C-N-CA 122.692 2.261 . . . . 71.14 111.76 172.216 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . -116.03 175.27 15.74 Favored Glycine 0 C--N 1.343 0.965 0 CA-C-N 116.246 -0.434 . . . . 45.23 112.727 178.162 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . -70.5 132.53 45.68 Favored 'General case' 0 N--CA 1.476 0.868 0 C-N-CA 123.384 0.674 . . . . 54.4 110.652 -179.228 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 122' ' ' SER . . . . . . . . . . . . . 35.8 p . . . . . 0 C--O 1.251 1.14 0 C-N-CA 124.01 0.924 . . . . 72.31 109.382 -175.836 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . 0.435 ' O ' HG23 ' A' ' 5' ' ' VAL . 16.5 tpt . . . . . 0 N--CA 1.487 1.376 0 CA-C-O 119.325 -0.369 . . . . 70.34 111.383 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 30.5 p -55.63 -51.36 67.45 Favored 'General case' 0 N--CA 1.489 1.488 0 C-N-CA 123.224 0.61 . . . . 54.1 112.229 -176.647 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 35.6 m -64.55 -29.58 70.61 Favored 'General case' 0 CA--C 1.541 0.601 0 CA-C-N 115.551 -0.749 . . . . 72.5 111.14 178.576 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . 0.503 ' HA ' ' HG3' ' A' ' 53' ' ' PRO . 4.5 m -74.13 -33.3 63.5 Favored 'General case' 0 N--CA 1.473 0.688 0 C-N-CA 123.36 0.664 . . . . 70.13 110.976 178.845 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . 0.435 HG23 ' O ' ' A' ' 1' ' ' MET . 89.5 t -69.39 -45.64 78.33 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.793 0 N-CA-C 109.273 -0.64 . . . . 71.53 109.273 177.045 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 25.1 mm-40 -55.07 -47.76 74.43 Favored 'General case' 0 N--CA 1.478 0.961 0 O-C-N 123.627 0.579 . . . . 73.31 110.831 172.789 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 7' ' ' PHE . . . . . 0.672 ' HZ ' HD11 ' A' ' 109' ' ' LEU . 72.8 t80 -55.38 -61.8 2.09 Favored 'General case' 0 CA--C 1.558 1.275 0 C-N-CA 124.621 1.168 . . . . 73.11 111.922 -178.573 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . 0.411 ' O ' ' HG3' ' A' ' 12' ' ' GLN . 65.2 mt -57.77 -48.79 82.8 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.08 0 C-N-CA 123.473 0.709 . . . . 63.35 110.615 -178.905 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 2.7 t-20 -65.32 -37.82 88.28 Favored 'General case' 0 N--CA 1.473 0.679 0 O-C-N 124.067 0.855 . . . . 71.24 111.818 -171.329 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 56.3 mtt180 -69.67 -38.59 77.11 Favored 'General case' 0 CA--C 1.543 0.677 0 CA-C-N 116.151 -0.477 . . . . 75.12 110.343 176.674 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' TRP . . . . . . . . . . . . . 80.0 m95 -68.82 -27.92 66.28 Favored 'General case' 0 N--CA 1.488 1.44 0 N-CA-C 112.054 0.39 . . . . 63.24 112.054 174.419 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . 0.411 ' HG3' ' O ' ' A' ' 8' ' ' ILE . 56.1 mt-30 -64.12 -47.69 79.0 Favored 'General case' 0 N--CA 1.478 0.945 0 N-CA-C 109.083 -0.71 . . . . 52.14 109.083 172.581 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 15.7 tpt180 -54.24 -49.75 68.77 Favored 'General case' 0 CA--C 1.548 0.875 0 C-N-CA 124.036 0.934 . . . . 73.12 110.889 177.735 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 14' ' ' ILE . . . . . 0.487 HD11 HG21 ' A' ' 47' ' ' VAL . 96.9 mt -59.95 -52.56 59.7 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.894 0 C-N-CA 124.236 1.015 . . . . 74.14 111.582 -178.104 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -60.06 -45.2 93.64 Favored 'General case' 0 N--CA 1.474 0.746 0 C-N-CA 123.599 0.759 . . . . 72.05 112.037 -176.55 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 96.1 mt -69.27 -40.8 77.56 Favored 'General case' 0 N--CA 1.475 0.804 0 CA-C-N 114.956 -1.02 . . . . 55.25 111.107 -177.517 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.51 ' O ' ' HG ' ' A' ' 21' ' ' LEU . 43.1 mt -62.19 -51.92 65.87 Favored 'General case' 0 N--CA 1.478 0.927 0 C-N-CA 122.798 0.439 . . . . 63.03 110.485 177.894 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 77.8 p -61.94 -40.41 95.43 Favored 'General case' 0 N--CA 1.475 0.817 0 C-N-CA 123.275 0.63 . . . . 71.01 111.501 -176.676 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 6.6 tp-100 -63.75 -42.24 97.87 Favored 'General case' 0 C--N 1.36 1.034 0 O-C-N 123.294 0.371 . . . . 61.14 110.428 176.694 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 65.5 m -60.52 -45.45 93.79 Favored 'General case' 0 CA--C 1.538 0.498 0 O-C-N 123.468 0.48 . . . . 52.04 110.712 176.248 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . 0.668 HD22 ' HA ' ' A' ' 33' ' ' LEU . 69.6 mt -63.29 -33.54 75.73 Favored 'General case' 0 N--CA 1.476 0.839 0 C-N-CA 123.347 0.659 . . . . 75.2 110.696 -179.092 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.661 ' HA ' HD21 ' A' ' 78' ' ' LEU . 57.9 tp -67.56 -53.34 29.2 Favored 'General case' 0 CA--C 1.544 0.724 0 C-N-CA 123.183 0.593 . . . . 62.42 110.677 178.036 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . 0.413 ' O ' ' HG3' ' A' ' 27' ' ' ARG . 37.3 mt-10 -56.23 -47.87 77.62 Favored 'General case' 0 N--CA 1.481 1.093 0 C-N-CA 123.874 0.87 . . . . 54.12 110.556 179.035 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.496 HD22 HD12 ' A' ' 32' ' ' LEU . 87.6 mt -66.02 -35.34 80.3 Favored 'General case' 0 C--O 1.217 -0.653 0 CA-C-N 114.961 -1.018 . . . . 55.05 110.996 -177.138 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . 0.521 ' HB2' HD21 ' A' ' 33' ' ' LEU . . . -65.04 -38.97 92.61 Favored 'General case' 0 N--CA 1.482 1.154 0 CA-C-O 121.019 0.438 . . . . 63.31 111.27 175.397 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 96.7 mt-30 -70.94 -27.72 63.97 Favored 'General case' 0 N--CA 1.48 1.041 0 CA-C-N 115.323 -0.853 . . . . 75.1 111.333 177.456 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . 0.454 ' HD2' HD23 ' A' ' 24' ' ' LEU . 96.9 mtt180 -78.07 -26.85 48.43 Favored 'General case' 0 N--CA 1.478 0.97 0 C-N-CA 123.385 0.674 . . . . 64.23 110.469 172.469 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 95.54 13.95 49.17 Favored Glycine 0 C--N 1.346 1.121 0 CA-C-N 115.992 -0.549 . . . . 70.12 113.37 -177.534 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . 0.431 ' HG2' ' HB2' ' A' ' 27' ' ' ARG . 8.7 mm-40 -84.88 59.38 5.55 Favored 'General case' 0 CA--C 1.553 1.076 0 C-N-CA 123.961 0.904 . . . . 70.53 110.326 176.713 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 30' ' ' TRP . . . . . . . . . . . . . 95.2 m95 -65.4 -22.3 66.77 Favored 'General case' 0 N--CA 1.485 1.302 0 C-N-CA 123.875 0.87 . . . . 74.54 111.714 -177.734 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 11.9 m-20 -53.56 -53.27 54.13 Favored 'General case' 0 C--N 1.35 0.62 0 O-C-N 123.753 0.658 . . . . 60.23 109.919 171.354 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.496 HD12 HD22 ' A' ' 24' ' ' LEU . 78.5 mt -63.19 -27.25 69.24 Favored 'General case' 0 N--CA 1.475 0.788 0 O-C-N 124.082 0.864 . . . . 73.53 111.444 -175.198 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . 0.668 ' HA ' HD22 ' A' ' 21' ' ' LEU . 9.0 mp -69.2 -54.92 12.33 Favored 'General case' 0 N--CA 1.479 0.988 0 C-N-CA 122.551 0.34 . . . . 65.24 110.421 174.253 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 91.0 mt -63.96 -29.03 70.23 Favored 'General case' 0 N--CA 1.484 1.255 0 O-C-N 123.814 0.696 . . . . 45.11 112.017 -176.344 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 94.1 mt-30 -71.67 -43.32 66.24 Favored 'General case' 0 N--CA 1.476 0.87 0 C-N-CA 123.374 0.669 . . . . 72.34 110.7 176.889 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 81.9 mm-40 -85.56 -14.47 45.7 Favored 'General case' 0 N--CA 1.481 1.095 0 C-N-CA 123.166 0.586 . . . . 71.4 112.369 -178.219 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 41.2 tt0 -51.81 -55.79 17.82 Favored 'General case' 0 N--CA 1.479 1.004 0 C-N-CA 125.069 1.348 . . . . 72.34 112.54 -173.621 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 63.9 t -62.77 -44.61 99.63 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.895 0 C-N-CA 122.754 0.421 . . . . 54.2 111.101 -175.407 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 65.3 m -65.43 -38.62 90.45 Favored 'General case' 0 N--CA 1.481 1.086 0 C-N-CA 123.021 0.528 . . . . 63.13 111.029 -178.908 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 46.1 t80 -66.73 -54.46 22.66 Favored 'General case' 0 CA--C 1.539 0.554 0 CA-C-N 115.262 -0.881 . . . . 74.03 110.761 -178.924 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . 0.489 HD22 HD21 ' A' ' 92' ' ' LEU . 75.3 mt -62.11 -38.71 89.95 Favored 'General case' 0 N--CA 1.477 0.88 0 O-C-N 123.746 0.654 . . . . 72.34 110.375 -177.641 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 54.0 tt0 -53.53 -57.23 11.44 Favored 'General case' 0 C--O 1.247 0.925 0 C-N-CA 124.253 1.021 . . . . 63.41 110.329 174.682 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . 0.537 ' O ' HG23 ' A' ' 47' ' ' VAL . 51.6 m -54.02 -60.65 3.05 Favored 'General case' 0 CA--C 1.544 0.713 0 O-C-N 124.56 1.163 . . . . 73.4 111.397 179.496 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 44' ' ' ILE . . . . . 0.463 HG13 HD13 ' A' ' 14' ' ' ILE . 19.0 tt -60.15 -40.82 84.6 Favored 'Isoleucine or valine' 0 C--O 1.257 1.493 0 C-N-CA 123.677 0.791 . . . . 62.21 112.974 -168.586 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . 0.438 ' HG2' ' O ' ' A' ' 41' ' ' LEU . 23.1 mm-40 -67.99 -45.55 73.79 Favored 'General case' 0 C--N 1.348 0.538 0 CA-C-N 116.521 -0.309 . . . . 75.22 110.189 178.036 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 41.4 m -62.25 -26.36 68.34 Favored 'General case' 0 CA--C 1.56 1.349 0 O-C-N 123.38 0.425 . . . . 42.32 112.031 178.66 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 47' ' ' VAL . . . . . 0.537 HG23 ' O ' ' A' ' 43' ' ' SER . 59.3 t -72.12 -46.57 58.06 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.434 0 C-N-CA 122.718 0.407 . . . . 72.1 110.502 175.933 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 48' ' ' MET . . . . . . . . . . . . . 71.6 mtm -67.74 -26.43 66.13 Favored 'General case' 0 N--CA 1.488 1.43 0 N-CA-C 111.77 0.285 . . . . 72.03 111.77 178.822 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 42.8 mt-10 -81.53 -20.6 39.69 Favored 'General case' 0 N--CA 1.479 0.987 0 C-N-CA 123.69 0.796 . . . . 70.14 111.192 175.451 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -75.8 136.44 40.24 Favored 'General case' 0 C--O 1.244 0.781 0 N-CA-C 109.291 -0.633 . . . . 72.34 109.291 -179.706 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 7.2 tt0 -61.86 113.85 3.01 Favored 'General case' 0 C--O 1.241 0.656 0 O-C-N 123.448 0.467 . . . . 64.15 110.007 178.73 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 52' ' ' THR . . . . . 0.441 HG21 ' O ' ' A' ' 114' ' ' LEU . 89.3 m -65.26 128.47 93.82 Favored Pre-proline 0 CA--C 1.553 1.064 0 CA-C-N 115.769 -0.65 . . . . 74.22 109.71 173.883 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 53' ' ' PRO . . . . . 0.503 ' HG3' ' HA ' ' A' ' 4' ' ' THR . 29.3 Cg_endo -60.27 153.52 58.86 Favored 'Trans proline' 0 C--N 1.375 1.948 0 C-N-CA 122.915 2.41 . . . . 62.21 112.608 178.93 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 54' ' ' PRO . . . . . 0.468 ' HD3' ' HA ' ' A' ' 53' ' ' PRO . 5.0 Cg_exo -81.63 -49.16 0.05 OUTLIER 'Trans proline' 0 C--N 1.369 1.627 0 C-N-CA 123.117 2.544 . . . . 71.24 112.973 179.479 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . -78.53 80.9 1.39 Allowed Glycine 0 C--N 1.348 1.22 0 CA-C-N 116.498 -0.319 . . . . 73.2 112.509 -175.208 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 56' ' ' ILE . . . . . 0.629 HG21 HD22 ' A' ' 114' ' ' LEU . 74.2 mt -121.83 144.0 32.51 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.786 0 C-N-CA 123.977 0.911 . . . . 71.03 109.428 -179.039 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 57' ' ' THR . . . . . 0.411 ' H ' HD12 ' A' ' 60' ' ' ILE . 66.0 p -99.88 170.25 8.65 Favored 'General case' 0 N--CA 1.479 1.014 0 C-N-CA 123.554 0.742 . . . . 72.21 111.005 177.466 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 13.3 tpt180 -64.65 -35.42 80.97 Favored 'General case' 0 C--N 1.357 0.897 0 C-N-CA 123.208 0.603 . . . . 64.21 111.439 178.164 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 20.4 m -59.9 -41.81 92.48 Favored 'General case' 0 N--CA 1.482 1.138 0 CA-C-O 121.175 0.512 . . . . 74.53 110.768 178.518 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 60' ' ' ILE . . . . . 0.411 HD12 ' H ' ' A' ' 57' ' ' THR . 83.3 mt -66.93 -39.26 83.1 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.603 0 CA-C-N 114.996 -1.002 . . . . 75.14 110.03 176.109 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 61' ' ' GLN . . . . . 0.539 HE21 ' HA ' ' A' ' 110' ' ' SER . 52.3 tt0 -60.89 -35.72 77.36 Favored 'General case' 0 N--CA 1.481 1.076 0 C-N-CA 123.727 0.811 . . . . 60.44 111.16 176.876 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 57.8 m-20 -73.84 -45.42 51.33 Favored 'General case' 0 N--CA 1.478 0.958 0 C-N-CA 123.073 0.549 . . . . 74.21 111.468 -179.57 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 63' ' ' MET . . . . . . . . . . . . . 67.1 mtm -66.05 -51.36 58.95 Favored 'General case' 0 N--CA 1.481 1.119 0 C-N-CA 122.708 0.403 . . . . 74.35 110.889 -179.888 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 64' ' ' VAL . . . . . 0.429 ' O ' HG13 ' A' ' 68' ' ' ILE . 77.3 t -63.13 -59.56 4.17 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.538 0 C-N-CA 123.356 0.662 . . . . 72.34 111.364 -179.871 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . 0.54 ' HB2' HD23 ' A' ' 109' ' ' LEU . . . -69.14 -22.47 63.94 Favored 'General case' 0 N--CA 1.485 1.313 0 CA-C-N 118.491 0.587 . . . . 74.24 111.326 -176.606 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -67.42 -38.98 91.45 Favored Glycine 0 C--N 1.348 1.195 0 N-CA-C 111.886 -0.485 . . . . 74.24 111.886 170.752 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 67' ' ' TYR . . . . . 0.417 ' O ' HG22 ' A' ' 71' ' ' THR . 1.8 m-30 -74.92 -32.32 61.75 Favored 'General case' 0 C--O 1.241 0.636 0 C-N-CA 123.405 0.682 . . . . 65.31 112.034 175.603 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 68' ' ' ILE . . . . . 0.535 HD12 HD22 ' A' ' 109' ' ' LEU . 19.5 mt -68.53 -38.79 79.65 Favored 'Isoleucine or valine' 0 C--N 1.357 0.894 0 N-CA-C 108.495 -0.928 . . . . 73.13 108.495 175.03 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 12.3 tmtt? -57.73 -48.81 78.55 Favored 'General case' 0 N--CA 1.48 1.034 0 C-N-CA 123.767 0.827 . . . . 73.42 108.791 175.63 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 70' ' ' GLN . . . . . 0.5 ' HG2' HD21 ' A' ' 74' ' ' ASN . 64.6 tt0 -53.58 -49.91 66.71 Favored 'General case' 0 CA--C 1.544 0.734 0 O-C-N 124.522 1.139 . . . . 64.24 110.718 178.652 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 71' ' ' THR . . . . . 0.417 HG22 ' O ' ' A' ' 67' ' ' TYR . 2.9 t -75.12 -21.56 58.78 Favored 'General case' 0 C--N 1.358 0.959 0 CA-C-O 119.293 -0.384 . . . . 63.32 111.925 -178.542 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 72' ' ' LEU . . . . . 0.486 ' HG ' ' O ' ' A' ' 68' ' ' ILE . 25.4 mt -61.36 -52.43 64.67 Favored 'General case' 0 N--CA 1.487 1.406 0 N-CA-C 108.852 -0.796 . . . . 62.22 108.852 173.064 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 5.3 m-20 -61.66 -57.39 12.19 Favored 'General case' 0 N--CA 1.475 0.785 0 O-C-N 124.064 0.853 . . . . 71.21 110.846 178.675 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 74' ' ' ASN . . . . . 0.5 HD21 ' HG2' ' A' ' 70' ' ' GLN . 79.9 m-20 -51.87 -54.43 29.27 Favored 'General case' 0 N--CA 1.484 1.247 0 C-N-CA 124.177 0.991 . . . . 73.33 111.434 -174.403 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . 0.599 ' O ' ' HG2' ' A' ' 79' ' ' LYS . 10.4 mm-40 -60.26 -57.16 13.98 Favored 'General case' 0 C--O 1.221 -0.427 0 CA-C-N 115.268 -0.878 . . . . 65.5 111.295 179.224 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 9.3 tt0 -62.61 -29.64 70.75 Favored 'General case' 0 N--CA 1.484 1.247 0 O-C-N 123.67 0.606 . . . . 65.51 112.182 -172.014 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 77.2 mt -72.23 -40.89 67.41 Favored 'General case' 0 N--CA 1.473 0.711 0 C-N-CA 123.613 0.765 . . . . 72.23 110.042 175.604 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . 0.661 HD21 ' HA ' ' A' ' 22' ' ' LEU . 71.9 mt -61.94 -36.9 82.78 Favored 'General case' 0 N--CA 1.488 1.435 0 C-N-CA 123.135 0.574 . . . . 63.53 111.559 173.158 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 79' ' ' LYS . . . . . 0.625 ' HD2' ' HA ' ' A' ' 88' ' ' GLU . 33.7 mmtm -69.21 -47.64 64.26 Favored 'General case' 0 N--CA 1.473 0.723 0 N-CA-C 109.18 -0.674 . . . . 72.41 109.18 -177.634 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -64.68 -29.09 74.28 Favored Glycine 0 C--N 1.35 1.315 0 CA-C-N 115.283 -0.872 . . . . 51.14 112.731 175.782 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 2.6 tt -69.82 -40.39 75.95 Favored 'General case' 0 CA--C 1.547 0.854 0 C-N-CA 123.724 0.81 . . . . 73.44 109.321 177.418 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 93.1 mt -70.75 -64.77 0.84 Allowed 'General case' 0 C--N 1.352 0.699 0 N-CA-C 109.468 -0.567 . . . . 74.32 109.468 179.196 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 16.6 mm100 -142.09 -72.85 0.32 Allowed 'General case' 0 CA--C 1.548 0.876 0 C-N-CA 123.905 0.882 . . . . 75.1 109.509 -179.792 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 80.7 mt-30 -138.32 160.1 40.35 Favored 'General case' 0 N--CA 1.488 1.466 0 C-N-CA 123.886 0.874 . . . . 73.32 109.725 -171.257 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 85' ' ' ARG . . . . . . . . . . . . . 16.5 ptm180 -62.68 -14.91 49.3 Favored 'General case' 0 N--CA 1.491 1.59 0 N-CA-C 113.339 0.866 . . . . 62.24 113.339 -172.276 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 84.8 mt -107.92 -12.76 15.11 Favored 'General case' 0 N--CA 1.484 1.237 0 C-N-CA 123.215 0.606 . . . . 64.33 112.524 177.145 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 19.2 t70 -67.78 97.74 0.66 Allowed 'General case' 0 N--CA 1.489 1.479 0 C-N-CA 123.553 0.741 . . . . 73.32 109.445 179.322 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 88' ' ' GLU . . . . . 0.625 ' HA ' ' HD2' ' A' ' 79' ' ' LYS . 50.4 mt-10 -68.16 159.28 31.35 Favored 'General case' 0 N--CA 1.476 0.846 0 C-N-CA 124.135 0.974 . . . . 64.14 112.184 -170.227 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 83.6 mt -55.85 -45.87 78.35 Favored 'General case' 0 N--CA 1.484 1.233 0 N-CA-C 108.862 -0.792 . . . . 71.33 108.862 173.046 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 46.8 t -154.96 146.33 22.99 Favored 'General case' 0 C--O 1.248 0.978 0 CA-C-N 113.869 -1.514 . . . . 70.24 107.287 169.1 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 52.6 m -61.04 111.18 1.58 Allowed 'General case' 0 N--CA 1.48 1.072 0 C-N-CA 123.204 0.602 . . . . 63.1 111.75 -173.248 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 92' ' ' LEU . . . . . 0.489 HD21 HD22 ' A' ' 41' ' ' LEU . 81.0 mt -59.1 -66.01 0.57 Allowed 'General case' 0 N--CA 1.481 1.087 0 C-N-CA 124.104 0.962 . . . . 71.01 111.112 -174.381 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 59.5 mt -98.42 -34.23 4.49 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.884 0 C-N-CA 123.52 0.728 . . . . 74.42 109.444 175.239 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 140.31 -28.0 2.49 Favored Glycine 0 C--N 1.337 0.627 0 N-CA-C 110.281 -1.127 . . . . 74.23 110.281 -173.309 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 21.6 mp0 -98.74 146.84 25.48 Favored 'General case' 0 C--O 1.245 0.85 0 N-CA-C 107.649 -1.241 . . . . 75.53 107.649 173.765 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 52.8 p -72.08 83.08 0.98 Allowed 'General case' 0 CA--C 1.545 0.753 0 CA-C-O 121.804 0.811 . . . . 62.33 110.249 179.516 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 7.1 t -107.17 3.46 25.69 Favored 'General case' 0 CA--C 1.541 0.621 0 CA-C-N 115.058 -0.974 . . . . 70.54 111.425 -171.078 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 98' ' ' ARG . . . . . 0.467 ' HG2' HD11 ' A' ' 92' ' ' LEU . 0.0 OUTLIER -59.93 -61.97 2.22 Favored 'General case' 0 N--CA 1.482 1.131 0 CA-C-N 117.959 0.345 . . . . 71.42 110.432 -170.384 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 1.4 tm0? -72.68 -41.12 65.69 Favored 'General case' 0 N--CA 1.467 0.378 0 CA-C-N 115.541 -0.754 . . . . 73.21 109.799 -174.478 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 40.3 ttmt -63.28 -55.08 27.73 Favored 'General case' 0 C--N 1.348 0.539 0 O-C-N 123.754 0.659 . . . . 73.42 111.26 -175.1 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 33.7 t -75.14 -28.48 60.17 Favored 'General case' 0 N--CA 1.476 0.845 0 C-N-CA 123.357 0.663 . . . . 65.05 111.733 -174.939 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 102' ' ' LEU . . . . . 0.418 HD12 ' HA ' ' A' ' 102' ' ' LEU . 10.5 tp -75.84 -35.57 59.91 Favored 'General case' 0 CA--C 1.549 0.937 0 CA-C-N 118.18 0.445 . . . . 75.13 110.657 178.526 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 5.0 t-20 -78.86 -26.48 44.04 Favored 'General case' 0 N--CA 1.481 1.089 0 C-N-CA 123.428 0.691 . . . . 74.33 110.248 176.58 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 104' ' ' ASN . . . . . 0.417 ' ND2' HH11 ' A' ' 108' ' ' ARG . 24.6 t-20 -67.53 -50.42 58.76 Favored 'General case' 0 N--CA 1.476 0.862 0 C-N-CA 123.927 0.891 . . . . 72.31 109.386 173.543 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 105' ' ' ALA . . . . . 0.452 ' O ' ' HB2' ' A' ' 109' ' ' LEU . . . -56.23 -46.62 79.47 Favored 'General case' 0 C--N 1.35 0.596 0 CA-C-N 115.096 -0.956 . . . . 51.23 110.244 175.959 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 106' ' ' TYR . . . . . . . . . . . . . 6.4 t80 -57.6 -43.06 84.41 Favored 'General case' 0 N--CA 1.478 0.931 0 C-N-CA 124.539 1.135 . . . . 65.14 110.705 176.215 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -62.33 -51.55 55.68 Favored Glycine 0 C--N 1.348 1.232 0 O-C-N 123.595 0.56 . . . . 53.44 113.094 -176.453 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 108' ' ' ARG . . . . . 0.417 HH11 ' ND2' ' A' ' 104' ' ' ASN . 0.0 OUTLIER -67.81 -33.13 74.2 Favored 'General case' 0 C--O 1.251 1.137 0 C-N-CA 122.548 0.339 . . . . 62.52 110.459 177.717 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 109' ' ' LEU . . . . . 0.761 ' HA ' ' HA ' ' A' ' 114' ' ' LEU . 4.6 tp -61.92 -55.1 33.07 Favored 'General case' 0 C--N 1.354 0.774 0 O-C-N 124.213 0.945 . . . . 70.11 110.596 -177.733 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 110' ' ' SER . . . . . 0.539 ' HA ' HE21 ' A' ' 61' ' ' GLN . 17.2 m -78.62 -18.05 55.1 Favored 'General case' 0 CA--C 1.542 0.65 0 CA-C-N 114.965 -1.016 . . . . 63.04 110.526 179.084 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . -73.01 -62.41 3.15 Favored Glycine 0 C--N 1.359 1.836 0 CA-C-O 118.571 -1.127 . . . . 73.44 114.74 -176.565 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 112' ' ' MET . . . . . 0.41 ' HG2' ' HA ' ' A' ' 119' ' ' PRO . 2.8 tmm? -94.5 -63.93 1.13 Allowed 'General case' 0 N--CA 1.503 2.213 0 CA-C-N 119.487 1.644 . . . . 71.41 111.162 -175.139 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 2.5 tm? 170.75 60.8 0.0 OUTLIER 'General case' 0 N--CA 1.48 1.041 0 N-CA-C 105.487 -2.042 . . . . 73.25 105.487 -177.649 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 114' ' ' LEU . . . . . 0.761 ' HA ' ' HA ' ' A' ' 109' ' ' LEU . 5.4 mp 66.92 -5.68 0.64 Allowed 'General case' 0 N--CA 1.475 0.82 0 CA-C-N 113.02 -1.9 . . . . 74.12 115.33 171.53 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 115' ' ' VAL . . . . . . . . . . . . . 27.5 m -78.54 144.53 65.65 Favored Pre-proline 0 CA--C 1.558 1.268 0 C-N-CA 123.538 0.735 . . . . 45.34 110.72 179.884 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 24.2 Cg_exo -65.05 -12.25 33.77 Favored 'Trans proline' 0 C--N 1.381 2.242 0 C-N-CA 122.927 2.418 . . . . 64.02 112.886 174.902 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 24.8 t70 -55.35 -30.81 61.02 Favored 'General case' 0 CA--C 1.55 0.97 0 C-N-CA 125.293 1.437 . . . . 65.23 113.246 -178.242 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . 77.79 156.43 0.15 Allowed Pre-proline 0 N--CA 1.493 1.716 0 C-N-CA 124.889 1.276 . . . . 71.03 111.636 -177.759 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 119' ' ' PRO . . . . . 0.41 ' HA ' ' HG2' ' A' ' 112' ' ' MET . 71.5 Cg_endo -73.91 30.83 0.32 Allowed 'Trans proline' 0 C--N 1.384 2.444 0 C-N-CA 122.96 2.44 . . . . 74.13 115.077 179.004 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . -71.31 -71.76 1.0 Allowed Glycine 0 C--N 1.348 1.21 0 N-CA-C 112.081 -0.408 . . . . 61.22 112.081 178.394 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . -93.02 80.16 4.57 Favored 'General case' 0 N--CA 1.478 0.95 0 C-N-CA 123.312 0.645 . . . . 73.52 110.109 178.498 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 122' ' ' SER . . . . . . . . . . . . . 39.6 m . . . . . 0 CA--C 1.558 1.275 0 CA-C-N 115.316 -0.856 . . . . 64.41 110.927 -179.39 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 20.2 ptt? . . . . . 0 N--CA 1.479 1.005 0 CA-C-O 121.293 0.568 . . . . 71.33 109.888 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 52.0 p -56.79 -33.12 66.35 Favored 'General case' 0 N--CA 1.482 1.16 0 C-N-CA 123.52 0.728 . . . . 63.45 111.971 -176.012 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 59.2 p -63.39 -43.41 97.65 Favored 'General case' 0 CA--C 1.549 0.92 0 C-N-CA 123.502 0.721 . . . . 35.11 110.995 175.098 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 27.6 m -69.63 -37.53 76.85 Favored 'General case' 0 N--CA 1.478 0.934 0 C-N-CA 123.581 0.752 . . . . 63.31 111.581 179.211 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 89.3 t -64.47 -47.16 90.52 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.819 0 C-N-CA 123.078 0.551 . . . . 72.34 109.858 179.664 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 16.7 mm-40 -60.26 -42.44 95.34 Favored 'General case' 0 C--O 1.218 -0.595 0 O-C-N 123.897 0.748 . . . . 64.33 110.563 173.495 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 35.7 t80 -59.19 -53.51 57.46 Favored 'General case' 0 CA--C 1.546 0.805 0 C-N-CA 123.626 0.77 . . . . 74.52 111.181 -176.851 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 52.0 mt -63.04 -45.89 97.62 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.033 0 C-N-CA 123.184 0.594 . . . . 73.24 110.311 179.226 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 3.4 t-20 -63.49 -32.99 74.6 Favored 'General case' 0 N--CA 1.48 1.028 0 C-N-CA 123.615 0.766 . . . . 64.33 111.454 -176.398 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . 0.477 ' O ' ' HB3' ' A' ' 13' ' ' ARG . 94.7 mtt180 -79.59 -29.39 41.16 Favored 'General case' 0 C--O 1.214 -0.775 0 CA-C-N 115.828 -0.624 . . . . 73.14 110.5 177.202 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' TRP . . . . . . . . . . . . . 79.3 m95 -76.6 -19.71 57.55 Favored 'General case' 0 N--CA 1.479 1.004 0 CA-C-O 119.186 -0.435 . . . . 73.3 111.053 171.362 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 51.3 mt-30 -68.73 -48.87 62.7 Favored 'General case' 0 N--CA 1.481 1.102 0 N-CA-C 108.196 -1.038 . . . . 75.04 108.196 168.265 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . 0.477 ' HB3' ' O ' ' A' ' 10' ' ' ARG . 17.6 tpt180 -48.25 -52.33 21.63 Favored 'General case' 0 CA--C 1.554 1.1 0 C-N-CA 124.939 1.296 . . . . 61.25 110.997 173.771 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 14' ' ' ILE . . . . . 0.465 HG13 ' O ' ' A' ' 10' ' ' ARG . 74.7 mt -69.08 -48.35 69.97 Favored 'Isoleucine or valine' 0 CA--C 1.558 1.267 0 C-N-CA 123.774 0.83 . . . . 54.42 111.267 -177.053 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -60.66 -48.4 81.93 Favored 'General case' 0 N--CA 1.487 1.424 0 C-N-CA 123.562 0.745 . . . . 54.45 111.964 -177.328 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 95.4 mt -69.26 -44.29 72.2 Favored 'General case' 0 CA--C 1.539 0.544 0 CA-C-N 115.079 -0.964 . . . . 61.04 111.046 -177.074 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.431 ' O ' ' HG ' ' A' ' 21' ' ' LEU . 42.3 mt -68.45 -32.41 72.41 Favored 'General case' 0 N--CA 1.482 1.171 0 CA-C-O 119.129 -0.463 . . . . 70.13 112.091 -179.502 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 78.7 p -68.38 -43.64 76.9 Favored 'General case' 0 N--CA 1.481 1.115 0 CA-C-N 118.181 0.446 . . . . 65.3 110.129 176.299 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 6.8 tp-100 -63.58 -37.56 87.77 Favored 'General case' 0 C--N 1.355 0.839 0 O-C-N 123.858 0.724 . . . . 74.11 110.789 176.841 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 52.5 m -62.52 -53.49 54.02 Favored 'General case' 0 C--N 1.348 0.542 0 CA-C-N 115.85 -0.614 . . . . 71.11 110.075 176.364 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . 0.545 HD22 ' HA ' ' A' ' 33' ' ' LEU . 57.9 mt -58.0 -35.6 71.46 Favored 'General case' 0 N--CA 1.477 0.916 0 O-C-N 123.833 0.708 . . . . 71.32 111.224 -178.569 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.652 HD22 ' HA ' ' A' ' 74' ' ' ASN . 53.5 tp -65.83 -57.25 8.39 Favored 'General case' 0 N--CA 1.475 0.817 0 O-C-N 123.364 0.415 . . . . 62.24 111.152 178.914 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . 0.451 ' O ' ' HG3' ' A' ' 27' ' ' ARG . 43.6 mt-10 -57.21 -50.76 71.85 Favored 'General case' 0 N--CA 1.481 1.076 0 O-C-N 123.628 0.58 . . . . 75.4 110.297 -179.366 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.462 HD23 ' HD2' ' A' ' 27' ' ' ARG . 95.0 mt -61.11 -33.49 73.45 Favored 'General case' 0 N--CA 1.474 0.768 0 C-N-CA 124.469 1.107 . . . . 74.31 111.735 -178.747 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . 0.547 ' HB2' HD21 ' A' ' 33' ' ' LEU . . . -61.62 -48.52 80.54 Favored 'General case' 0 N--CA 1.477 0.882 0 CA-C-O 120.957 0.408 . . . . 35.43 110.378 173.869 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 81.3 mt-30 -67.62 -22.43 65.34 Favored 'General case' 0 CA--C 1.551 0.99 0 CA-C-N 115.156 -0.929 . . . . 72.34 111.607 178.848 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . 0.462 ' HD2' HD23 ' A' ' 24' ' ' LEU . 73.3 mtt180 -85.72 -6.76 59.08 Favored 'General case' 0 N--CA 1.482 1.145 0 C-N-CA 124.062 0.945 . . . . 73.12 112.012 177.86 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 81.78 8.16 87.13 Favored Glycine 0 C--N 1.352 1.469 0 N-CA-C 113.612 0.205 . . . . 72.44 113.612 -178.397 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 36.8 mm-40 -82.26 60.98 5.26 Favored 'General case' 0 CA--C 1.545 0.757 0 C-N-CA 124.571 1.148 . . . . 60.01 111.404 179.912 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 30' ' ' TRP . . . . . 0.478 ' O ' ' HG ' ' A' ' 34' ' ' LEU . 45.9 m95 -65.99 -29.06 69.38 Favored 'General case' 0 N--CA 1.481 1.106 0 C-N-CA 122.992 0.517 . . . . 62.13 110.819 -177.154 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 -62.02 -46.96 86.9 Favored 'General case' 0 N--CA 1.475 0.791 0 C-N-CA 123.522 0.729 . . . . 71.43 109.771 177.295 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.431 ' HB3' HD13 ' A' ' 24' ' ' LEU . 61.1 mt -62.14 -28.77 69.88 Favored 'General case' 0 N--CA 1.476 0.873 0 C-N-CA 123.068 0.547 . . . . 72.44 111.385 176.722 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . 0.547 HD21 ' HB2' ' A' ' 25' ' ' ALA . 10.7 mp -68.86 -42.03 77.61 Favored 'General case' 0 C--N 1.357 0.897 0 CA-C-O 119.047 -0.501 . . . . 72.22 110.742 171.769 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.478 ' HG ' ' O ' ' A' ' 30' ' ' TRP . 83.8 mt -64.18 -43.54 94.79 Favored 'General case' 0 N--CA 1.487 1.387 0 C-N-CA 123.558 0.743 . . . . 71.41 111.565 -177.847 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 1.4 mp0 -65.43 -57.78 7.47 Favored 'General case' 0 N--CA 1.478 0.958 0 C-N-CA 123.137 0.575 . . . . 75.33 110.471 177.777 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 84.6 mm-40 -74.14 -11.31 60.27 Favored 'General case' 0 N--CA 1.479 0.99 0 C-N-CA 123.502 0.721 . . . . 74.43 112.723 -175.378 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 35.2 tt0 -53.65 -54.74 33.44 Favored 'General case' 0 N--CA 1.487 1.399 0 C-N-CA 123.876 0.87 . . . . 62.14 110.485 172.742 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 57.4 t -59.99 -47.94 89.77 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.514 0 O-C-N 124.248 0.968 . . . . 75.43 110.177 -179.344 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 16.3 m -55.6 -57.31 12.48 Favored 'General case' 0 CA--C 1.548 0.884 0 C-N-CA 124.037 0.935 . . . . 75.32 111.498 -179.265 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 28.5 t80 -63.87 -52.02 61.89 Favored 'General case' 0 CA--C 1.54 0.57 0 C-N-CA 124.97 1.308 . . . . 71.13 112.069 -173.73 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . 0.496 ' HA ' HG22 ' A' ' 44' ' ' ILE . 96.3 mt -72.22 -39.37 68.59 Favored 'General case' 0 N--CA 1.468 0.471 0 CA-C-N 115.969 -0.56 . . . . 71.24 111.659 -172.605 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 29.1 tt0 -60.0 -42.74 94.92 Favored 'General case' 0 CA--C 1.546 0.824 0 N-CA-C 109.68 -0.489 . . . . 73.11 109.68 173.866 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . 0.436 ' O ' HG23 ' A' ' 47' ' ' VAL . 69.5 m -58.21 -54.84 42.48 Favored 'General case' 0 N--CA 1.483 1.189 0 C-N-CA 123.169 0.588 . . . . 73.12 112.151 176.892 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 44' ' ' ILE . . . . . 0.496 HG22 ' HA ' ' A' ' 41' ' ' LEU . 16.3 tt -62.83 -41.84 94.11 Favored 'Isoleucine or valine' 0 C--O 1.25 1.11 0 O-C-N 123.632 0.582 . . . . 71.33 111.146 -171.947 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . 0.496 ' O ' ' HG3' ' A' ' 49' ' ' GLU . 16.0 mm-40 -58.86 -51.02 71.82 Favored 'General case' 0 C--N 1.356 0.859 0 CA-C-N 115.801 -0.636 . . . . 62.43 110.166 174.812 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 46' ' ' THR . . . . . 0.514 ' O ' ' HD3' ' A' ' 50' ' ' LYS . 93.8 m -58.0 -36.31 72.48 Favored 'General case' 0 CA--C 1.55 0.976 0 O-C-N 124.319 1.012 . . . . 64.33 112.403 -178.115 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 47' ' ' VAL . . . . . 0.445 HG21 HD11 ' A' ' 14' ' ' ILE . 87.7 t -68.0 -45.42 83.69 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.063 0 C-N-CA 122.58 0.352 . . . . 63.41 110.167 177.721 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 48' ' ' MET . . . . . . . . . . . . . 65.8 mtm -76.0 -14.41 60.23 Favored 'General case' 0 N--CA 1.486 1.358 0 N-CA-C 112.989 0.737 . . . . 73.22 112.989 -177.799 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . 0.496 ' HG3' ' O ' ' A' ' 45' ' ' GLU . 69.0 mt-10 -70.53 -35.51 73.21 Favored 'General case' 0 N--CA 1.484 1.259 0 CA-C-O 120.839 0.352 . . . . 72.45 111.063 172.988 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . 0.514 ' HD3' ' O ' ' A' ' 46' ' ' THR . 13.4 mptt -90.21 166.84 13.13 Favored 'General case' 0 N--CA 1.477 0.915 0 C-N-CA 123.8 0.84 . . . . 61.04 110.65 -173.801 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 20.4 pt20 -71.92 146.78 47.59 Favored 'General case' 0 C--O 1.243 0.756 0 CA-C-N 115.431 -0.804 . . . . 72.23 110.635 -179.613 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 52' ' ' THR . . . . . 0.578 HG22 HD11 ' A' ' 56' ' ' ILE . 39.5 m -83.98 122.81 76.13 Favored Pre-proline 0 CA--C 1.546 0.807 0 N-CA-C 108.559 -0.904 . . . . 72.52 108.559 171.477 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 22.9 Cg_endo -57.38 157.06 23.32 Favored 'Trans proline' 0 C--N 1.379 2.149 0 C-N-CA 123.02 2.48 . . . . 51.13 113.411 -177.104 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 20.5 Cg_exo -68.22 -48.13 1.38 Allowed 'Trans proline' 0 C--N 1.371 1.755 0 C-N-CA 122.647 2.231 . . . . 71.12 112.354 174.394 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . -74.71 76.64 1.15 Allowed Glycine 0 C--N 1.351 1.378 0 CA-C-N 115.701 -0.681 . . . . 63.41 113.549 -175.97 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 56' ' ' ILE . . . . . 0.669 ' O ' ' HB ' ' A' ' 60' ' ' ILE . 26.6 mt -106.15 -14.14 9.26 Favored 'Isoleucine or valine' 0 C--O 1.202 -1.444 0 C-N-CA 123.583 0.753 . . . . 73.44 110.453 -179.989 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 73.6 p 38.82 -178.18 0.0 OUTLIER 'General case' 0 N--CA 1.506 2.338 0 N-CA-C 114.931 1.456 . . . . 73.13 114.931 -173.734 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 13.8 tpt85 -73.95 -37.04 64.67 Favored 'General case' 0 N--CA 1.476 0.854 0 O-C-N 120.482 -1.386 . . . . 74.5 108.378 171.194 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 33.4 m -62.51 -55.46 27.28 Favored 'General case' 0 C--O 1.246 0.875 0 C-N-CA 124.282 1.033 . . . . 73.1 111.93 -178.211 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 60' ' ' ILE . . . . . 0.669 ' HB ' ' O ' ' A' ' 56' ' ' ILE . 66.9 mt -75.03 -27.57 20.07 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.916 0 N-CA-C 109.046 -0.724 . . . . 75.23 109.046 -176.928 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 60.9 tt0 -57.23 -45.63 83.72 Favored 'General case' 0 C--N 1.376 1.732 0 CA-C-N 118.31 0.505 . . . . 65.24 110.862 171.915 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 65.9 m-20 -66.65 -41.78 87.7 Favored 'General case' 0 N--CA 1.472 0.666 0 O-C-N 123.591 0.557 . . . . 74.1 111.325 178.686 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 63' ' ' MET . . . . . . . . . . . . . 63.5 mtm -63.61 -54.78 30.53 Favored 'General case' 0 N--CA 1.486 1.343 0 O-C-N 123.318 0.386 . . . . 73.41 111.775 -179.455 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 64' ' ' VAL . . . . . 0.428 ' O ' HG13 ' A' ' 68' ' ' ILE . 73.5 t -59.04 -52.39 61.25 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.841 0 C-N-CA 123.719 0.808 . . . . 62.34 111.38 176.673 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . 0.465 ' HB2' HD23 ' A' ' 109' ' ' LEU . . . -64.46 -26.87 68.63 Favored 'General case' 0 N--CA 1.487 1.406 0 C-N-CA 122.534 0.333 . . . . 54.25 111.47 -179.836 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 66' ' ' GLY . . . . . 0.411 ' O ' ' HG3' ' A' ' 70' ' ' GLN . . . -68.1 -40.55 88.22 Favored Glycine 0 C--N 1.342 0.915 0 N-CA-C 111.296 -0.722 . . . . 73.4 111.296 174.357 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 67' ' ' TYR . . . . . 0.512 ' O ' HG23 ' A' ' 71' ' ' THR . 19.0 m-30 -67.06 -41.05 87.13 Favored 'General case' 0 N--CA 1.468 0.453 0 C-N-CA 123.533 0.733 . . . . 71.12 110.914 175.425 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 68' ' ' ILE . . . . . 0.584 ' O ' ' HG ' ' A' ' 72' ' ' LEU . 48.5 mt -61.09 -40.89 87.26 Favored 'Isoleucine or valine' 0 C--N 1.358 0.939 0 O-C-N 123.904 0.752 . . . . 63.24 109.001 174.665 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 69' ' ' LYS . . . . . 0.555 ' HA ' ' HE2' ' A' ' 69' ' ' LYS . 0.6 OUTLIER -58.72 -42.94 89.91 Favored 'General case' 0 N--CA 1.474 0.758 0 C-N-CA 123.305 0.642 . . . . 74.33 110.128 179.738 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 70' ' ' GLN . . . . . 0.411 ' HG3' ' O ' ' A' ' 66' ' ' GLY . 75.7 mt-30 -58.91 -45.92 89.18 Favored 'General case' 0 N--CA 1.476 0.84 0 O-C-N 124.176 0.922 . . . . 71.14 111.082 175.01 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 71' ' ' THR . . . . . 0.512 HG23 ' O ' ' A' ' 67' ' ' TYR . 10.0 p -60.59 -39.29 87.55 Favored 'General case' 0 N--CA 1.486 1.367 0 CA-C-O 120.862 0.363 . . . . 61.24 110.291 -178.63 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 72' ' ' LEU . . . . . 0.584 ' HG ' ' O ' ' A' ' 68' ' ' ILE . 52.7 mt -64.33 -54.59 30.7 Favored 'General case' 0 C--N 1.355 0.828 0 CA-C-N 115.144 -0.935 . . . . 74.43 109.812 -178.128 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 15.8 m-20 -58.7 -59.37 5.51 Favored 'General case' 0 N--CA 1.487 1.414 0 O-C-N 123.558 0.536 . . . . 74.14 111.243 178.542 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 74' ' ' ASN . . . . . 0.652 ' HA ' HD22 ' A' ' 22' ' ' LEU . 87.0 m-20 -56.71 -57.88 10.51 Favored 'General case' 0 N--CA 1.479 1.02 0 C-N-CA 124.471 1.108 . . . . 64.31 112.019 -173.59 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . 0.522 ' O ' ' HG2' ' A' ' 79' ' ' LYS . 61.8 tt0 -73.02 -29.25 62.87 Favored 'General case' 0 CA--C 1.545 0.78 0 CA-C-O 118.696 -0.668 . . . . 74.44 111.129 -172.694 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 7.0 tt0 -66.97 -38.43 86.07 Favored 'General case' 0 N--CA 1.491 1.578 0 CA-C-N 118.444 0.566 . . . . 70.44 110.763 173.536 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 92.6 mt -66.19 -30.56 71.05 Favored 'General case' 0 N--CA 1.471 0.583 0 N-CA-C 109.993 -0.373 . . . . 65.12 109.993 175.571 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . 0.609 HD21 ' HA ' ' A' ' 22' ' ' LEU . 85.3 mt -71.98 -35.01 69.37 Favored 'General case' 0 N--CA 1.479 1.019 0 C-N-CA 123.111 0.564 . . . . 65.02 111.912 170.437 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 79' ' ' LYS . . . . . 0.738 ' HD2' ' HA ' ' A' ' 86' ' ' LEU . 35.5 mmtm -60.7 -43.92 97.17 Favored 'General case' 0 N--CA 1.485 1.28 0 N-CA-C 109.19 -0.67 . . . . 65.13 109.19 174.997 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -75.23 -33.44 53.88 Favored Glycine 0 C--N 1.346 1.117 0 CA-C-N 114.674 -1.148 . . . . 52.33 113.643 -179.431 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 5.4 tt -73.24 -60.13 2.39 Favored 'General case' 0 N--CA 1.477 0.91 0 C-N-CA 123.367 0.667 . . . . 71.25 109.407 -178.247 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 74.3 mt -65.74 -49.4 68.56 Favored 'General case' 0 CA--C 1.544 0.738 0 CA-C-N 114.909 -1.041 . . . . 72.22 112.113 -171.018 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 19.5 tp60 -136.01 8.43 3.23 Favored 'General case' 0 N--CA 1.489 1.497 0 N-CA-C 112.705 0.632 . . . . 71.11 112.705 -169.845 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 23.8 mt-30 66.63 4.59 3.44 Favored 'General case' 0 N--CA 1.492 1.651 0 C-N-CA 124.412 1.085 . . . . 62.14 113.562 176.62 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 85' ' ' ARG . . . . . 0.602 ' HG3' ' H ' ' A' ' 86' ' ' LEU . 0.6 OUTLIER -167.17 -176.32 3.28 Favored 'General case' 0 CA--C 1.544 0.733 0 N-CA-C 109.007 -0.738 . . . . 71.35 109.007 -175.49 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 86' ' ' LEU . . . . . 0.738 ' HA ' ' HD2' ' A' ' 79' ' ' LYS . 72.9 mt -69.48 82.2 0.4 Allowed 'General case' 0 CA--C 1.55 0.951 0 C-N-CA 123.635 0.774 . . . . 72.02 112.813 -168.015 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 20.4 t70 -95.59 116.78 29.32 Favored 'General case' 0 C--O 1.24 0.573 0 C-N-CA 124.223 1.009 . . . . 75.15 109.031 174.475 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 33.4 mm-40 -85.48 11.94 9.48 Favored 'General case' 0 CA--C 1.544 0.712 0 C-N-CA 123.257 0.623 . . . . 64.13 112.457 -170.475 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 80.1 mt 56.7 -139.43 0.91 Allowed 'General case' 0 CA--C 1.558 1.278 0 C-N-CA 123.324 0.65 . . . . 73.23 110.154 -179.4 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 4.8 m -117.09 140.98 48.84 Favored 'General case' 0 N--CA 1.476 0.826 0 N-CA-C 109.108 -0.701 . . . . 64.43 109.108 173.524 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 34.7 t 77.68 41.09 0.14 Allowed 'General case' 0 N--CA 1.492 1.635 0 C-N-CA 125.066 1.346 . . . . 64.35 112.243 176.756 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 92' ' ' LEU . . . . . 0.499 HD22 HH12 ' A' ' 98' ' ' ARG . 33.0 mt -124.31 177.09 6.05 Favored 'General case' 0 N--CA 1.486 1.348 0 C-N-CA 123.792 0.837 . . . . 70.41 109.222 163.021 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 36.7 mt -68.71 145.52 13.38 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.943 0 C-N-CA 123.729 0.812 . . . . 71.53 109.617 176.473 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -64.64 138.63 40.41 Favored Glycine 0 C--N 1.348 1.2 0 O-C-N 123.551 0.532 . . . . 53.14 113.996 -175.881 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 6.9 tt0 61.56 88.19 0.09 Allowed 'General case' 0 CA--C 1.554 1.12 0 C-N-CA 125.127 1.371 . . . . 61.21 113.103 173.007 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 45.2 m 47.03 68.01 0.7 Allowed 'General case' 0 N--CA 1.486 1.337 0 C-N-CA 125.017 1.327 . . . . 70.33 114.114 163.922 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 12.0 t -96.48 -34.22 11.57 Favored 'General case' 0 N--CA 1.474 0.753 0 C-N-CA 122.49 0.316 . . . . 71.53 111.399 -177.25 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 98' ' ' ARG . . . . . 0.538 ' HA ' ' NE ' ' A' ' 98' ' ' ARG . 0.2 OUTLIER -62.61 -51.16 68.4 Favored 'General case' 0 C--N 1.353 0.752 0 O-C-N 123.584 0.552 . . . . 75.01 112.488 -161.486 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 22.7 tp60 -55.66 -55.58 30.53 Favored 'General case' 0 CA--C 1.545 0.765 0 O-C-N 124.159 0.912 . . . . 74.34 111.157 -176.519 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 24.1 tptp -70.88 -51.84 23.82 Favored 'General case' 0 CA--C 1.54 0.58 0 CA-C-N 115.585 -0.734 . . . . 71.2 111.153 -171.573 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 40.6 t -69.05 -38.36 79.08 Favored 'General case' 0 N--CA 1.474 0.748 0 C-N-CA 123.698 0.799 . . . . 71.52 112.353 -173.236 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 13.9 tp -83.5 -33.63 25.5 Favored 'General case' 0 N--CA 1.476 0.86 0 C-N-CA 122.485 0.314 . . . . 64.24 110.866 -174.405 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 27.9 t-20 -69.09 -34.23 74.79 Favored 'General case' 0 N--CA 1.482 1.158 0 N-CA-C 110.109 -0.33 . . . . 72.5 110.109 171.723 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 104' ' ' ASN . . . . . 0.453 ' O ' ' HG2' ' A' ' 108' ' ' ARG . 27.4 t-20 -60.88 -46.19 91.6 Favored 'General case' 0 N--CA 1.478 0.957 0 C-N-CA 123.16 0.584 . . . . 72.53 109.479 171.671 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -57.09 -42.79 81.38 Favored 'General case' 0 N--CA 1.477 0.887 0 O-C-N 124.018 0.824 . . . . 50.51 111.24 178.841 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 106' ' ' TYR . . . . . 0.402 ' HE2' ' HB2' ' A' ' 69' ' ' LYS . 9.1 t80 -58.47 -51.56 69.34 Favored 'General case' 0 CA--C 1.547 0.848 0 O-C-N 123.737 0.648 . . . . 74.02 110.276 175.384 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -65.79 -38.59 94.54 Favored Glycine 0 C--N 1.353 1.521 0 O-C-N 123.909 0.755 . . . . 72.1 113.232 -174.568 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 108' ' ' ARG . . . . . 0.453 ' HG2' ' O ' ' A' ' 104' ' ' ASN . 21.3 mmt180 -70.2 -35.62 74.03 Favored 'General case' 0 C--N 1.348 0.526 0 C-N-CA 122.998 0.519 . . . . 73.34 109.62 179.248 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 109' ' ' LEU . . . . . 0.465 HD23 ' HB2' ' A' ' 65' ' ' ALA . 53.2 tp -63.81 -52.69 59.07 Favored 'General case' 0 N--CA 1.48 1.058 0 C-N-CA 122.803 0.441 . . . . 73.13 110.216 175.782 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 16.2 t -62.91 -37.44 86.97 Favored 'General case' 0 CA--C 1.54 0.581 0 O-C-N 125.109 1.506 . . . . 71.24 111.03 -172.677 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . -91.05 -62.08 1.24 Allowed Glycine 0 C--N 1.35 1.326 0 CA-C-O 119.919 -0.378 . . . . 75.23 113.869 178.252 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 112' ' ' MET . . . . . . . . . . . . . 7.3 tpt -93.18 -65.81 0.97 Allowed 'General case' 0 N--CA 1.487 1.425 0 N-CA-C 113.167 0.802 . . . . 65.31 113.167 -168.213 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 113' ' ' LEU . . . . . 0.581 ' HB3' HG22 ' A' ' 115' ' ' VAL . 14.4 tp 168.08 16.75 0.0 OUTLIER 'General case' 0 N--CA 1.504 2.271 0 C-N-CA 124.336 1.055 . . . . 71.21 110.917 -173.911 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 114' ' ' LEU . . . . . 0.445 ' N ' ' HA ' ' A' ' 109' ' ' LEU . 0.7 OUTLIER 68.3 18.01 9.21 Favored 'General case' 0 N--CA 1.502 2.13 0 C-N-CA 125.158 1.383 . . . . 71.21 110.098 -171.633 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 115' ' ' VAL . . . . . 0.581 HG22 ' HB3' ' A' ' 113' ' ' LEU . 27.4 m -107.98 105.94 57.46 Favored Pre-proline 0 CA--C 1.557 1.242 0 N-CA-C 107.83 -1.174 . . . . 42.35 107.83 173.379 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 72.6 Cg_endo -80.8 88.86 1.35 Allowed 'Trans proline' 0 C--N 1.375 1.954 0 C-N-CA 122.336 2.024 . . . . 71.2 112.134 179.948 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 2.3 m-20 -66.34 -54.35 25.65 Favored 'General case' 0 N--CA 1.475 0.808 0 CA-C-N 114.995 -1.002 . . . . 72.31 110.322 174.94 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -155.95 134.91 7.68 Favored Pre-proline 0 CA--C 1.541 0.623 0 CA-C-N 114.854 -1.066 . . . . 64.11 109.662 -177.125 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 119' ' ' PRO . . . . . . . . . . . . . 49.3 Cg_exo -59.18 117.89 4.7 Favored 'Trans proline' 0 C--N 1.371 1.715 0 C-N-CA 122.583 2.189 . . . . 71.34 111.716 168.757 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . -79.11 -178.08 50.53 Favored Glycine 0 C--N 1.349 1.284 0 O-C-N 123.151 0.282 . . . . 60.44 113.2 179.955 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . -64.57 94.97 0.13 Allowed 'General case' 0 N--CA 1.478 0.945 0 C-N-CA 123.739 0.816 . . . . 64.35 111.574 -177.494 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 122' ' ' SER . . . . . . . . . . . . . 20.8 m . . . . . 0 C--O 1.248 0.983 0 C-N-CA 124.209 1.003 . . . . 73.31 109.269 176.23 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 23.4 ttt . . . . . 0 N--CA 1.48 1.027 0 CA-C-O 119.773 -0.156 . . . . 71.11 111.083 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 87.1 m -52.0 -49.16 63.85 Favored 'General case' 0 N--CA 1.484 1.228 0 C-N-CA 123.387 0.675 . . . . 73.14 111.865 -178.08 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 22.9 m -63.08 -35.37 80.04 Favored 'General case' 0 N--CA 1.471 0.596 0 C-N-CA 123.708 0.803 . . . . 52.32 111.479 -178.901 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . 0.558 HG21 HD13 ' A' ' 60' ' ' ILE . 5.0 m -68.42 -47.9 66.06 Favored 'General case' 0 CA--C 1.544 0.732 0 C-N-CA 123.461 0.704 . . . . 71.15 110.875 179.37 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 76.5 t -65.23 -39.51 85.66 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.979 0 C-N-CA 123.595 0.758 . . . . 63.11 110.484 -178.2 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 39.0 mm-40 -59.73 -49.23 78.53 Favored 'General case' 0 C--N 1.35 0.615 0 C-N-CA 123.291 0.636 . . . . 72.54 110.218 172.479 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 29.3 t80 -59.35 -45.78 90.45 Favored 'General case' 0 CA--C 1.551 1.0 0 C-N-CA 124.296 1.038 . . . . 74.34 110.873 -176.188 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . 0.464 HD11 HG23 ' A' ' 60' ' ' ILE . 77.7 mt -66.8 -42.95 90.0 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.914 0 C-N-CA 123.943 0.897 . . . . 71.05 110.693 179.635 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 28.5 t-20 -66.64 -34.18 77.31 Favored 'General case' 0 N--CA 1.485 1.32 0 C-N-CA 123.531 0.732 . . . . 64.32 111.355 -178.16 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 75.9 mtt180 -68.57 -41.42 79.72 Favored 'General case' 0 CA--C 1.537 0.469 0 CA-C-N 115.601 -0.727 . . . . 74.43 109.383 174.521 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 11' ' ' TRP . . . . . 0.468 ' HH2' ' HG ' ' A' ' 102' ' ' LEU . 42.5 m95 -65.66 -29.26 69.8 Favored 'General case' 0 N--CA 1.477 0.884 0 O-C-N 123.458 0.474 . . . . 73.25 111.632 173.905 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 50.1 mt-30 -61.91 -50.08 73.61 Favored 'General case' 0 C--N 1.359 0.987 0 N-CA-C 108.568 -0.901 . . . . 63.54 108.568 172.506 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 14.6 tpt180 -57.67 -49.25 77.12 Favored 'General case' 0 CA--C 1.545 0.785 0 O-C-N 124.103 0.877 . . . . 74.32 111.411 -179.078 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 14' ' ' ILE . . . . . 0.458 HD11 HG21 ' A' ' 47' ' ' VAL . 65.6 mt -63.59 -48.34 87.28 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.359 0 C-N-CA 123.427 0.691 . . . . 72.04 111.051 -177.897 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . 0.463 ' HB1' ' OE1' ' A' ' 70' ' ' GLN . . . -60.72 -47.79 84.69 Favored 'General case' 0 N--CA 1.478 0.934 0 C-N-CA 124.296 1.038 . . . . 70.55 111.412 -177.813 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 96.3 mt -74.69 -34.13 62.59 Favored 'General case' 0 N--CA 1.481 1.11 0 CA-C-N 114.756 -1.111 . . . . 72.04 111.452 -176.531 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.495 ' O ' ' HG ' ' A' ' 21' ' ' LEU . 18.6 mt -63.95 -54.97 26.27 Favored 'General case' 0 C--N 1.36 1.058 0 N-CA-C 109.41 -0.589 . . . . 61.54 109.41 175.745 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 79.6 p -59.63 -35.38 74.28 Favored 'General case' 0 CA--C 1.544 0.749 0 O-C-N 123.894 0.746 . . . . 63.12 111.276 -178.568 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 6.2 tp-100 -62.29 -49.16 76.76 Favored 'General case' 0 N--CA 1.478 0.932 0 C-N-CA 123.503 0.721 . . . . 61.42 110.907 174.673 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 57.1 m -60.58 -43.21 97.57 Favored 'General case' 0 N--CA 1.472 0.665 0 C-N-CA 123.33 0.652 . . . . 54.01 110.444 177.023 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . 0.693 HD22 ' HA ' ' A' ' 33' ' ' LEU . 77.2 mt -68.75 -28.81 67.14 Favored 'General case' 0 C--N 1.346 0.415 0 C-N-CA 123.959 0.904 . . . . 74.45 110.288 -177.015 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.597 ' HA ' HD21 ' A' ' 78' ' ' LEU . 35.8 tp -68.65 -51.26 43.9 Favored 'General case' 0 C--N 1.354 0.779 0 O-C-N 123.859 0.725 . . . . 53.42 109.652 175.928 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 76.2 mm-40 -51.87 -54.61 27.21 Favored 'General case' 0 N--CA 1.478 0.94 0 O-C-N 124.091 0.869 . . . . 74.22 110.526 175.799 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.553 ' HB3' ' HB2' ' A' ' 29' ' ' GLU . 95.5 mt -64.2 -37.27 86.87 Favored 'General case' 0 CA--C 1.545 0.768 0 CA-C-N 114.505 -1.225 . . . . 73.44 111.46 -174.196 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . 0.629 ' HB2' HD21 ' A' ' 33' ' ' LEU . . . -66.7 -38.12 86.09 Favored 'General case' 0 N--CA 1.489 1.511 0 C-N-CA 122.837 0.455 . . . . 71.3 111.378 177.73 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 87.1 mt-30 -67.01 -26.76 66.95 Favored 'General case' 0 N--CA 1.478 0.96 0 C-N-CA 123.84 0.856 . . . . 71.33 110.833 175.481 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 59.2 mtt180 -88.51 -15.19 35.89 Favored 'General case' 0 N--CA 1.481 1.091 0 C-N-CA 124.025 0.93 . . . . 74.32 111.874 175.086 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 81.44 35.77 22.15 Favored Glycine 0 C--N 1.352 1.443 0 C-N-CA 123.01 0.338 . . . . 60.43 113.285 178.999 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . 0.553 ' HB2' ' HB3' ' A' ' 24' ' ' LEU . 13.6 mm-40 -97.83 59.89 1.48 Allowed 'General case' 0 CA--C 1.545 0.774 0 C-N-CA 124.806 1.243 . . . . 74.24 109.527 -177.551 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 30' ' ' TRP . . . . . 0.401 ' O ' ' HG ' ' A' ' 34' ' ' LEU . 61.3 m95 -53.58 -38.71 64.17 Favored 'General case' 0 N--CA 1.485 1.319 0 C-N-CA 124.245 1.018 . . . . 71.52 112.028 -174.421 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 31' ' ' ASP . . . . . 0.43 ' O ' ' HG3' ' A' ' 35' ' ' GLN . 4.2 m-20 -58.0 -50.15 74.39 Favored 'General case' 0 N--CA 1.483 1.186 0 C-N-CA 123.743 0.817 . . . . 72.3 110.652 -179.272 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 95.7 mt -62.89 -31.52 72.58 Favored 'General case' 0 N--CA 1.479 0.993 0 C-N-CA 123.93 0.892 . . . . 61.51 111.755 -176.778 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . 0.693 ' HA ' HD22 ' A' ' 21' ' ' LEU . 11.2 mp -66.26 -45.78 79.35 Favored 'General case' 0 N--CA 1.478 0.956 0 C-N-CA 123.045 0.538 . . . . 74.23 110.54 173.131 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.401 ' HG ' ' O ' ' A' ' 30' ' ' TRP . 81.1 mt -69.31 -24.77 63.98 Favored 'General case' 0 CA--C 1.548 0.897 0 CA-C-N 115.84 -0.618 . . . . 75.15 111.712 179.43 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 35' ' ' GLN . . . . . 0.43 ' HG3' ' O ' ' A' ' 31' ' ' ASP . 95.1 mt-30 -77.84 -32.42 52.13 Favored 'General case' 0 N--CA 1.474 0.752 0 C-N-CA 122.822 0.449 . . . . 74.33 111.24 178.067 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 36' ' ' GLN . . . . . 0.569 ' HB2' HD21 ' A' ' 21' ' ' LEU . 87.0 mm-40 -90.67 -14.63 31.89 Favored 'General case' 0 N--CA 1.483 1.183 0 C-N-CA 123.101 0.56 . . . . 74.51 112.37 174.746 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 42.2 tt0 -47.83 -56.37 7.62 Favored 'General case' 0 N--CA 1.488 1.462 0 C-N-CA 124.104 0.962 . . . . 71.4 112.871 -176.998 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 91.9 t -60.88 -43.9 96.65 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.869 0 C-N-CA 123.057 0.543 . . . . 74.45 111.684 -175.3 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 44.7 p -68.47 -34.75 76.49 Favored 'General case' 0 N--CA 1.473 0.723 0 C-N-CA 122.903 0.481 . . . . 65.45 111.148 -178.725 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 66.2 t80 -69.02 -51.74 35.93 Favored 'General case' 0 CA--C 1.541 0.61 0 C-N-CA 123.707 0.803 . . . . 75.2 110.027 -179.478 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 72.7 mt -63.73 -43.46 96.45 Favored 'General case' 0 N--CA 1.473 0.71 0 O-C-N 124.254 0.972 . . . . 61.22 110.834 -179.284 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 53.3 tt0 -67.57 -45.81 74.52 Favored 'General case' 0 N--CA 1.476 0.837 0 C-N-CA 123.027 0.531 . . . . 74.3 111.102 -176.903 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . 0.489 ' O ' HG23 ' A' ' 47' ' ' VAL . 68.7 m -65.74 -42.43 90.98 Favored 'General case' 0 N--CA 1.474 0.757 0 O-C-N 123.312 0.383 . . . . 61.44 111.457 -178.941 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 44' ' ' ILE . . . . . 0.423 HG13 HD13 ' A' ' 14' ' ' ILE . 15.7 tt -69.45 -35.74 68.25 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.019 0 O-C-N 123.077 0.235 . . . . 63.03 110.704 -178.147 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 9.6 mm-40 -59.12 -44.91 92.03 Favored 'General case' 0 C--N 1.359 1.019 0 C-N-CA 123.428 0.691 . . . . 73.5 110.527 171.726 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 90.0 m -58.61 -45.3 89.47 Favored 'General case' 0 CA--C 1.544 0.738 0 O-C-N 124.277 0.986 . . . . 74.13 111.261 178.604 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 47' ' ' VAL . . . . . 0.489 HG23 ' O ' ' A' ' 43' ' ' SER . 57.8 t -64.04 -47.85 88.53 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.172 0 C-N-CA 123.108 0.563 . . . . 70.32 111.443 -178.468 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 48' ' ' MET . . . . . . . . . . . . . 73.6 mtm -73.51 -24.02 60.1 Favored 'General case' 0 N--CA 1.48 1.034 0 CA-C-N 115.95 -0.568 . . . . 73.23 111.642 -177.397 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 9.8 tp10 -82.16 -35.33 28.52 Favored 'General case' 0 N--CA 1.475 0.777 0 C-N-CA 122.847 0.459 . . . . 72.51 110.396 178.169 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 12.3 mptt -84.62 151.46 24.48 Favored 'General case' 0 N--CA 1.479 0.991 0 C-N-CA 123.475 0.71 . . . . 62.15 110.874 -176.971 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 8.7 tt0 -76.23 132.9 40.18 Favored 'General case' 0 CA--C 1.543 0.707 0 CA-C-N 114.76 -1.109 . . . . 61.25 110.921 -175.131 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 24.1 m -74.46 125.65 89.58 Favored Pre-proline 0 CA--C 1.551 0.989 0 C-N-CA 123.712 0.805 . . . . 72.42 109.079 170.314 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 73.7 Cg_endo -72.45 152.05 54.19 Favored 'Trans proline' 0 C--N 1.373 1.864 0 C-N-CA 122.075 1.85 . . . . 62.04 112.777 -178.903 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 54' ' ' PRO . . . . . 0.533 ' HA ' HG21 ' A' ' 115' ' ' VAL . 52.8 Cg_exo -58.72 -44.94 32.43 Favored 'Trans proline' 0 C--N 1.378 2.099 0 C-N-CA 123.716 2.944 . . . . 72.55 113.583 176.427 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . -63.83 80.38 0.05 OUTLIER Glycine 0 C--N 1.351 1.409 0 O-C-N 124.342 1.027 . . . . 40.23 114.117 -176.849 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 72.5 mt -130.49 111.61 21.08 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.673 0 C-N-CA 124.804 1.242 . . . . 65.31 108.752 178.522 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 57' ' ' THR . . . . . 0.467 ' H ' HD12 ' A' ' 60' ' ' ILE . 74.2 p -80.23 175.14 10.91 Favored 'General case' 0 N--CA 1.471 0.577 0 C-N-CA 123.47 0.708 . . . . 73.54 109.454 172.544 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 26.3 tpt180 -63.94 -38.96 93.01 Favored 'General case' 0 CA--C 1.541 0.622 0 CA-C-O 119.428 -0.32 . . . . 72.53 110.398 177.538 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 21.9 m -59.41 -47.39 85.62 Favored 'General case' 0 CA--C 1.548 0.889 0 C-N-CA 122.987 0.515 . . . . 71.22 110.854 178.252 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 60' ' ' ILE . . . . . 0.558 HD13 HG21 ' A' ' 4' ' ' THR . 93.5 mt -61.09 -42.17 92.18 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.149 0 C-N-CA 123.623 0.769 . . . . 63.41 110.372 176.159 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 64.4 tt0 -62.54 -38.7 91.01 Favored 'General case' 0 CA--C 1.547 0.837 0 C-N-CA 124.024 0.929 . . . . 70.33 111.092 -179.171 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 63.9 m-20 -67.68 -43.52 80.0 Favored 'General case' 0 N--CA 1.48 1.028 0 C-N-CA 123.433 0.693 . . . . 73.14 110.79 177.686 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 63' ' ' MET . . . . . . . . . . . . . 72.3 mtm -64.46 -52.39 58.23 Favored 'General case' 0 N--CA 1.48 1.054 0 O-C-N 123.72 0.638 . . . . 62.2 111.447 -178.356 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 64' ' ' VAL . . . . . 0.465 ' O ' HG13 ' A' ' 68' ' ' ILE . 92.4 t -60.71 -50.42 80.53 Favored 'Isoleucine or valine' 0 C--N 1.353 0.739 0 C-N-CA 123.71 0.804 . . . . 72.14 110.372 -179.747 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . 0.404 ' HB2' HD23 ' A' ' 109' ' ' LEU . . . -61.91 -36.5 81.52 Favored 'General case' 0 N--CA 1.484 1.231 0 O-C-N 123.432 0.457 . . . . 72.31 111.327 179.78 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -64.25 -38.81 96.41 Favored Glycine 0 C--N 1.345 1.038 0 O-C-N 123.73 0.644 . . . . 33.4 112.402 178.41 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 67' ' ' TYR . . . . . 0.528 ' O ' HG22 ' A' ' 71' ' ' THR . 17.9 m-30 -72.58 -42.32 64.71 Favored 'General case' 0 N--CA 1.471 0.577 0 C-N-CA 123.277 0.631 . . . . 74.35 111.452 179.371 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 68' ' ' ILE . . . . . 0.522 ' O ' ' HG ' ' A' ' 72' ' ' LEU . 68.0 mt -56.49 -52.22 55.52 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.112 0 N-CA-C 108.652 -0.87 . . . . 75.51 108.652 175.207 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 69' ' ' LYS . . . . . 0.549 ' HB2' ' HE2' ' A' ' 106' ' ' TYR . 13.5 tmtt? -53.35 -45.8 69.3 Favored 'General case' 0 N--CA 1.476 0.842 0 C-N-CA 125.25 1.42 . . . . 71.42 110.345 179.125 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 70' ' ' GLN . . . . . 0.463 ' OE1' ' HB1' ' A' ' 15' ' ' ALA . 61.4 tt0 -61.39 -49.1 78.25 Favored 'General case' 0 C--N 1.349 0.557 0 CA-C-N 115.428 -0.806 . . . . 73.43 111.328 -176.158 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 71' ' ' THR . . . . . 0.528 HG22 ' O ' ' A' ' 67' ' ' TYR . 1.0 OUTLIER -73.18 -23.59 60.44 Favored 'General case' 0 N--CA 1.474 0.736 0 CA-C-O 119.469 -0.3 . . . . 64.15 110.874 -178.871 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 72' ' ' LEU . . . . . 0.522 ' HG ' ' O ' ' A' ' 68' ' ' ILE . 37.4 mt -61.21 -55.61 30.2 Favored 'General case' 0 C--N 1.363 1.16 0 N-CA-C 108.878 -0.786 . . . . 63.42 108.878 173.175 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 73' ' ' ASP . . . . . 0.427 ' O ' ' HG ' ' A' ' 77' ' ' LEU . 4.5 m-20 -55.09 -61.89 2.02 Favored 'General case' 0 N--CA 1.482 1.133 0 O-C-N 124.505 1.128 . . . . 75.32 111.001 177.373 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 74' ' ' ASN . . . . . 0.529 ' HA ' HD22 ' A' ' 22' ' ' LEU . 83.0 m-20 -53.5 -54.7 33.41 Favored 'General case' 0 N--CA 1.478 0.933 0 O-C-N 124.506 1.129 . . . . 74.23 112.294 -172.292 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . 0.41 ' HB3' ' NH2' ' A' ' 98' ' ' ARG . 5.4 tt0 -73.03 -32.77 65.31 Favored 'General case' 0 CA--C 1.547 0.832 0 O-C-N 123.211 0.32 . . . . 72.43 111.516 -174.634 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 9.0 tt0 -64.9 -37.15 86.69 Favored 'General case' 0 N--CA 1.484 1.266 0 CA-C-O 120.764 0.316 . . . . 73.3 110.197 175.43 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . 0.427 ' HG ' ' O ' ' A' ' 73' ' ' ASP . 96.8 mt -68.72 -34.92 76.45 Favored 'General case' 0 CA--C 1.539 0.539 0 CA-C-N 116.057 -0.52 . . . . 61.34 110.198 176.142 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . 0.597 HD21 ' HA ' ' A' ' 22' ' ' LEU . 57.3 mt -61.04 -39.88 91.47 Favored 'General case' 0 N--CA 1.483 1.193 0 C-N-CA 122.89 0.476 . . . . 73.12 111.03 171.675 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 79' ' ' LYS . . . . . 0.528 ' HD2' ' HA ' ' A' ' 86' ' ' LEU . 48.8 mmtm -65.01 -45.57 84.97 Favored 'General case' 0 C--O 1.22 -0.449 0 CA-C-N 116.416 -0.356 . . . . 74.02 110.334 178.224 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -71.32 -25.24 75.83 Favored Glycine 0 CA--C 1.531 1.081 0 O-C-N 124.104 0.877 . . . . 74.15 113.851 -179.294 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 6.4 tt -86.05 -64.26 1.18 Allowed 'General case' 0 N--CA 1.48 1.052 0 C-N-CA 123.312 0.645 . . . . 64.22 109.613 -178.002 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 25.6 mt -69.38 -48.87 59.87 Favored 'General case' 0 N--CA 1.479 1.008 0 C-N-CA 123.914 0.885 . . . . 71.3 112.167 -168.511 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 15.5 mm-40 -120.86 -2.43 9.79 Favored 'General case' 0 N--CA 1.488 1.457 0 N-CA-C 112.809 0.67 . . . . 70.44 112.809 -174.496 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 7.8 tt0 65.39 11.7 7.55 Favored 'General case' 0 CA--C 1.566 1.585 0 C-N-CA 124.796 1.238 . . . . 74.22 112.076 179.89 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 85' ' ' ARG . . . . . . . . . . . . . 48.7 ttt180 -175.05 162.93 3.13 Favored 'General case' 0 N--CA 1.486 1.336 0 C-N-CA 124.21 1.004 . . . . 75.54 109.762 -173.897 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 86' ' ' LEU . . . . . 0.528 ' HA ' ' HD2' ' A' ' 79' ' ' LYS . 92.0 mt -55.42 115.51 2.33 Favored 'General case' 0 C--N 1.358 0.948 0 C-N-CA 123.699 0.799 . . . . 60.21 109.916 166.255 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 35.0 t70 -154.39 -76.88 0.11 Allowed 'General case' 0 CA--C 1.543 0.675 0 N-CA-C 109.701 -0.481 . . . . 53.21 109.701 -177.133 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 48.2 mt-10 -112.96 167.42 10.53 Favored 'General case' 0 N--CA 1.485 1.298 0 C-N-CA 123.455 0.702 . . . . 75.31 111.102 178.745 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 87.3 mt 62.65 38.15 12.34 Favored 'General case' 0 N--CA 1.486 1.347 0 C-N-CA 125.119 1.368 . . . . 55.14 110.143 -168.326 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 32.3 p -159.41 15.1 0.15 Allowed 'General case' 0 N--CA 1.481 1.117 0 CA-C-N 115.58 -0.737 . . . . 52.34 112.029 -179.827 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 67.6 p -77.64 78.29 4.15 Favored 'General case' 0 CA--C 1.547 0.844 0 CA-C-O 121.757 0.789 . . . . 73.44 109.48 177.33 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 75.7 mt -87.95 -81.2 0.25 Allowed 'General case' 0 CA--C 1.54 0.582 0 CA-C-N 114.961 -1.018 . . . . 71.2 110.852 -175.277 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 62.6 mt -90.05 -40.01 12.57 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.69 0 N-CA-C 108.259 -1.015 . . . . 74.22 108.259 174.161 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 178.92 -56.67 0.09 OUTLIER Glycine 0 C--N 1.345 1.032 0 CA-C-N 114.446 -1.252 . . . . 75.33 110.176 177.037 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 13.8 pt20 -81.27 175.32 10.7 Favored 'General case' 0 C--O 1.244 0.784 0 C-N-CA 123.626 0.77 . . . . 63.42 110.764 176.811 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 35.0 p -83.99 51.67 2.11 Favored 'General case' 0 CA--C 1.552 1.042 0 C-N-CA 124.369 1.067 . . . . 65.11 110.666 177.937 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 15.2 t -67.56 -9.76 45.62 Favored 'General case' 0 N--CA 1.479 1.01 0 C-N-CA 124.189 0.996 . . . . 64.32 112.837 -174.325 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 98' ' ' ARG . . . . . 0.594 HH11 HD22 ' A' ' 102' ' ' LEU . 2.0 tmm_? -51.28 -50.34 59.47 Favored 'General case' 0 N--CA 1.479 1.003 0 C-N-CA 125.265 1.426 . . . . 74.41 111.506 -176.439 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 24.7 tm0? -57.26 -53.3 59.71 Favored 'General case' 0 N--CA 1.474 0.752 0 C-N-CA 124.025 0.93 . . . . 74.43 110.053 -176.887 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 61.5 tttp -65.02 -49.16 71.25 Favored 'General case' 0 C--O 1.218 -0.567 0 O-C-N 124.016 0.823 . . . . 74.3 111.425 -176.589 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 51.1 m -60.27 -43.98 95.72 Favored 'General case' 0 CA--C 1.542 0.649 0 C-N-CA 123.587 0.755 . . . . 71.21 111.584 -173.877 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 102' ' ' LEU . . . . . 0.594 HD22 HH11 ' A' ' 98' ' ' ARG . 10.8 mp -78.45 -35.64 46.48 Favored 'General case' 0 N--CA 1.48 1.026 0 N-CA-C 112.306 0.484 . . . . 71.21 112.306 -179.08 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 26.9 t-20 -69.41 -37.84 77.65 Favored 'General case' 0 N--CA 1.484 1.254 0 CA-C-O 121.035 0.445 . . . . 63.45 110.392 179.727 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -73.72 -36.51 65.21 Favored 'General case' 0 N--CA 1.47 0.561 0 CA-C-N 115.615 -0.721 . . . . 74.24 109.164 176.768 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -61.56 -36.76 81.53 Favored 'General case' 0 C--N 1.358 0.937 0 O-C-N 123.605 0.566 . . . . 73.53 110.892 173.715 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 106' ' ' TYR . . . . . 0.549 ' HE2' ' HB2' ' A' ' 69' ' ' LYS . 2.3 t80 -67.45 -42.03 83.75 Favored 'General case' 0 CA--C 1.541 0.614 0 N-CA-C 108.964 -0.754 . . . . 73.42 108.964 176.762 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -67.01 -31.79 78.97 Favored Glycine 0 CA--C 1.535 1.283 0 O-C-N 123.59 0.556 . . . . 54.24 113.449 177.809 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 52.6 mtp180 -71.7 -41.59 68.43 Favored 'General case' 0 N--CA 1.474 0.759 0 C-N-CA 123.694 0.798 . . . . 75.25 109.643 176.668 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 109' ' ' LEU . . . . . 0.404 HD23 ' HB2' ' A' ' 65' ' ' ALA . 34.8 tp -66.73 -46.59 75.01 Favored 'General case' 0 C--N 1.351 0.635 0 O-C-N 124.248 0.968 . . . . 71.15 110.021 -179.471 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 33.8 t -66.07 -36.16 82.45 Favored 'General case' 0 CA--C 1.536 0.439 0 C-N-CA 124.221 1.008 . . . . 73.52 110.548 177.556 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . -77.84 -66.18 1.8 Allowed Glycine 0 C--N 1.36 1.878 0 C-N-CA 120.692 -0.766 . . . . 73.25 112.702 -176.728 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 112' ' ' MET . . . . . . . . . . . . . 41.7 mmm -99.13 -72.89 0.64 Allowed 'General case' 0 N--CA 1.481 1.101 0 CA-C-N 118.315 1.057 . . . . 72.32 111.647 172.524 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 113' ' ' LEU . . . . . 0.403 HD13 HG23 ' A' ' 115' ' ' VAL . 0.3 OUTLIER 171.4 33.27 0.0 OUTLIER 'General case' 0 N--CA 1.487 1.415 0 C-N-CA 125.85 1.66 . . . . 75.55 109.666 -178.66 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 11.5 tp 75.76 -10.99 1.18 Allowed 'General case' 0 N--CA 1.491 1.604 0 C-N-CA 125.242 1.417 . . . . 73.21 113.941 170.011 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 115' ' ' VAL . . . . . 0.533 HG21 ' HA ' ' A' ' 54' ' ' PRO . 60.8 t -73.49 -55.7 3.42 Favored Pre-proline 0 N--CA 1.486 1.368 0 CA-C-O 118.555 -0.736 . . . . 74.54 110.246 -177.347 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 116' ' ' PRO . . . . . 0.451 ' HD3' ' HB ' ' A' ' 115' ' ' VAL . 89.0 Cg_endo -85.67 161.57 10.75 Favored 'Trans proline' 0 C--N 1.38 2.207 0 CA-C-N 120.911 1.361 . . . . 63.23 111.225 169.925 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 5.3 p-10 -79.9 -30.16 40.02 Favored 'General case' 0 N--CA 1.475 0.803 0 CA-C-N 116.136 -0.484 . . . . 74.41 109.988 176.42 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -74.31 143.75 80.32 Favored Pre-proline 0 CA--C 1.552 1.027 0 C-N-CA 123.518 0.727 . . . . 42.14 110.524 176.919 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 119' ' ' PRO . . . . . . . . . . . . . 84.8 Cg_endo -76.87 -179.23 5.19 Favored 'Trans proline' 0 C--N 1.374 1.911 0 C-N-CA 122.714 2.276 . . . . 71.42 111.879 176.268 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . -174.01 -126.84 0.95 Allowed Glycine 0 C--N 1.336 0.565 0 N-CA-C 110.325 -1.11 . . . . 62.22 110.325 -178.97 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . -159.77 145.65 15.79 Favored 'General case' 0 N--CA 1.477 0.903 0 C-N-CA 123.541 0.736 . . . . 74.11 109.508 174.892 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 122' ' ' SER . . . . . . . . . . . . . 40.3 t . . . . . 0 CA--C 1.546 0.798 0 N-CA-C 107.957 -1.127 . . . . 62.02 107.957 -178.058 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 25.0 ptm . . . . . 0 N--CA 1.485 1.28 0 N-CA-C 111.936 0.347 . . . . 71.42 111.936 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 28.6 m -62.69 -40.19 96.36 Favored 'General case' 0 N--CA 1.482 1.127 0 C-N-CA 122.931 0.492 . . . . 74.15 111.531 -176.111 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 14.3 m -65.59 -35.99 82.44 Favored 'General case' 0 N--CA 1.476 0.871 0 C-N-CA 122.964 0.505 . . . . 72.5 110.467 176.331 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . 0.555 ' HA ' ' HG2' ' A' ' 53' ' ' PRO . 33.5 m -66.4 -50.0 64.93 Favored 'General case' 0 C--N 1.361 1.086 0 C-N-CA 123.602 0.761 . . . . 74.1 111.3 179.241 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 59.0 t -60.45 -40.02 82.91 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.084 0 C-N-CA 123.401 0.68 . . . . 73.34 110.022 179.173 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . 0.478 ' O ' ' HG3' ' A' ' 10' ' ' ARG . 0.2 OUTLIER -63.68 -41.42 98.15 Favored 'General case' 0 CA--C 1.548 0.895 0 CA-C-N 115.326 -0.852 . . . . 62.42 110.293 176.823 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 7' ' ' PHE . . . . . 0.598 ' HD1' HH11 ' A' ' 10' ' ' ARG . 39.4 t80 -69.44 -40.71 77.04 Favored 'General case' 0 N--CA 1.483 1.198 0 C-N-CA 123.968 0.907 . . . . 73.23 111.316 -176.665 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . 0.465 ' O ' ' HG3' ' A' ' 12' ' ' GLN . 76.7 mt -60.73 -42.48 92.26 Favored 'Isoleucine or valine' 0 C--N 1.353 0.733 0 N-CA-C 108.593 -0.892 . . . . 73.21 108.593 172.863 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 3.3 t-20 -66.46 -27.62 67.95 Favored 'General case' 0 N--CA 1.475 0.823 0 O-C-N 124.354 1.034 . . . . 72.52 111.426 -179.835 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . 0.633 ' HB3' HG22 ' A' ' 47' ' ' VAL . 53.8 mtt180 -71.36 -39.02 71.54 Favored 'General case' 0 N--CA 1.475 0.802 0 C-N-CA 123.442 0.697 . . . . 74.23 110.764 174.465 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 11' ' ' TRP . . . . . 0.452 ' CD1' HG13 ' A' ' 64' ' ' VAL . 92.1 m95 -75.17 -24.18 57.84 Favored 'General case' 0 N--CA 1.477 0.875 0 CA-C-N 116.25 -0.432 . . . . 71.54 111.654 173.871 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . 0.504 ' HG2' ' CE2' ' A' ' 67' ' ' TYR . 55.7 mt-30 -68.59 -39.74 80.81 Favored 'General case' 0 N--CA 1.473 0.692 0 N-CA-C 108.743 -0.836 . . . . 65.52 108.743 170.11 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 22.4 tpt180 -60.19 -53.51 56.84 Favored 'General case' 0 CA--C 1.545 0.759 0 C-N-CA 124.174 0.99 . . . . 75.21 110.658 178.748 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 14' ' ' ILE . . . . . 0.477 HG22 ' OG1' ' A' ' 71' ' ' THR . 49.1 mt -66.32 -42.74 91.22 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.006 0 O-C-N 123.338 0.399 . . . . 71.54 110.45 -178.466 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . 0.598 ' HA ' ' HB ' ' A' ' 71' ' ' THR . . . -60.34 -48.04 83.46 Favored 'General case' 0 N--CA 1.486 1.337 0 C-N-CA 123.249 0.619 . . . . 43.12 112.1 -178.776 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 92.1 mt -70.11 -44.36 69.14 Favored 'General case' 0 N--CA 1.481 1.098 0 O-C-N 124.304 1.003 . . . . 72.32 110.856 -175.985 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.495 ' O ' ' HG ' ' A' ' 21' ' ' LEU . 49.3 mt -62.62 -53.43 54.68 Favored 'General case' 0 C--N 1.354 0.799 0 O-C-N 123.606 0.566 . . . . 72.22 110.527 179.982 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 94.9 p -60.8 -37.84 83.31 Favored 'General case' 0 N--CA 1.479 0.975 0 C-N-CA 123.338 0.655 . . . . 44.15 111.432 -178.51 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 6.9 tp-100 -62.65 -48.11 80.78 Favored 'General case' 0 C--N 1.36 1.025 0 O-C-N 123.939 0.775 . . . . 71.45 110.348 177.699 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . 0.407 ' O ' ' HG ' ' A' ' 24' ' ' LEU . 65.2 m -58.91 -49.04 79.29 Favored 'General case' 0 C--O 1.213 -0.855 0 O-C-N 123.944 0.777 . . . . 41.4 110.3 176.405 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . 0.587 HD22 ' HA ' ' A' ' 33' ' ' LEU . 79.7 mt -64.43 -31.33 72.5 Favored 'General case' 0 N--CA 1.475 0.807 0 C-N-CA 123.93 0.892 . . . . 71.24 111.28 -176.471 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.603 ' HA ' HD21 ' A' ' 78' ' ' LEU . 69.9 tp -67.42 -55.42 13.74 Favored 'General case' 0 C--N 1.353 0.738 0 C-N-CA 123.191 0.596 . . . . 54.43 109.766 176.996 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 45.5 mt-10 -55.05 -50.69 68.47 Favored 'General case' 0 C--N 1.352 0.689 0 O-C-N 124.635 1.209 . . . . 70.3 110.549 179.933 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.487 ' HB3' ' HB2' ' A' ' 29' ' ' GLU . 93.7 mt -63.38 -36.22 82.98 Favored 'General case' 0 CA--C 1.544 0.736 0 C-N-CA 124.508 1.123 . . . . 71.33 111.251 -177.46 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -63.9 -41.16 97.77 Favored 'General case' 0 N--CA 1.485 1.277 0 C-N-CA 122.87 0.468 . . . . 73.24 111.279 174.948 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 86.3 mt-30 -71.41 -23.38 61.86 Favored 'General case' 0 N--CA 1.483 1.195 0 C-N-CA 123.892 0.877 . . . . 73.32 111.289 177.958 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 89.0 mtt180 -91.98 -11.59 35.66 Favored 'General case' 0 N--CA 1.481 1.113 0 C-N-CA 123.943 0.897 . . . . 75.32 111.685 176.649 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 88.21 6.98 73.95 Favored Glycine 0 C--N 1.349 1.284 0 CA-C-O 119.924 -0.375 . . . . 73.11 113.941 178.549 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . 0.487 ' HB2' ' HB3' ' A' ' 24' ' ' LEU . 44.2 mm-40 -79.01 55.91 1.87 Allowed 'General case' 0 N--CA 1.484 1.23 0 C-N-CA 124.805 1.242 . . . . 65.42 111.643 176.424 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 30' ' ' TRP . . . . . 0.624 ' HH2' HD22 ' A' ' 81' ' ' LEU . 93.8 m95 -64.17 -27.51 69.12 Favored 'General case' 0 N--CA 1.481 1.08 0 C-N-CA 124.162 0.985 . . . . 54.32 111.904 -177.492 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 4.9 m-20 -56.94 -47.86 79.67 Favored 'General case' 0 CA--C 1.539 0.536 0 C-N-CA 124.12 0.968 . . . . 70.02 110.353 176.275 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 98.4 mt -64.84 -26.8 68.49 Favored 'General case' 0 CA--C 1.546 0.826 0 CA-C-N 115.574 -0.739 . . . . 74.41 111.204 179.983 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . 0.587 ' HA ' HD22 ' A' ' 21' ' ' LEU . 9.8 mp -68.93 -39.63 79.5 Favored 'General case' 0 N--CA 1.484 1.249 0 C-N-CA 122.465 0.306 . . . . 73.0 110.458 171.34 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.42 ' HG ' ' O ' ' A' ' 30' ' ' TRP . 75.7 mt -66.69 -37.92 85.71 Favored 'General case' 0 N--CA 1.487 1.385 0 O-C-N 123.585 0.553 . . . . 65.24 111.975 -179.681 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 1.3 mp0 -71.67 -49.19 42.0 Favored 'General case' 0 N--CA 1.485 1.315 0 C-N-CA 122.638 0.375 . . . . 74.34 110.957 177.598 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 36' ' ' GLN . . . . . 0.476 ' HB2' HD21 ' A' ' 21' ' ' LEU . 87.4 mm-40 -74.42 -13.44 60.72 Favored 'General case' 0 N--CA 1.478 0.955 0 C-N-CA 123.22 0.608 . . . . 72.23 111.96 -179.563 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . 0.512 ' O ' ' HG ' ' A' ' 41' ' ' LEU . 32.4 tt0 -48.51 -61.14 2.17 Favored 'General case' 0 N--CA 1.486 1.332 0 C-N-CA 124.672 1.189 . . . . 72.42 111.885 177.584 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 66.0 t -53.55 -46.27 59.91 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.346 0 O-C-N 124.322 1.014 . . . . 73.23 111.235 -176.517 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 44.6 m -65.66 -38.51 89.51 Favored 'General case' 0 CA--C 1.544 0.748 0 CA-C-N 114.99 -1.005 . . . . 54.45 111.727 179.818 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 40' ' ' TYR . . . . . 0.414 ' O ' HG22 ' A' ' 44' ' ' ILE . 40.0 t80 -69.29 -46.08 68.04 Favored 'General case' 0 N--CA 1.476 0.87 0 C-N-CA 123.056 0.542 . . . . 73.21 110.564 -177.758 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . 0.512 ' HG ' ' O ' ' A' ' 37' ' ' GLU . 49.9 mt -55.75 -51.79 66.15 Favored 'General case' 0 C--N 1.355 0.829 0 O-C-N 124.673 1.233 . . . . 63.2 109.81 177.382 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 50.1 tt0 -54.54 -48.02 72.48 Favored 'General case' 0 C--N 1.355 0.812 0 CA-C-N 114.62 -1.173 . . . . 45.23 111.017 179.404 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . 0.54 ' O ' HG23 ' A' ' 47' ' ' VAL . 67.5 m -59.03 -62.18 2.08 Favored 'General case' 0 C--N 1.349 0.552 0 O-C-N 124.057 0.848 . . . . 74.35 111.307 -177.721 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 44' ' ' ILE . . . . . 0.414 HG22 ' O ' ' A' ' 40' ' ' TYR . 14.6 tt -64.52 -34.78 71.84 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.955 0 O-C-N 123.571 0.544 . . . . 72.0 111.628 -171.46 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . 0.538 ' HG2' HD22 ' A' ' 92' ' ' LEU . 17.6 mm-40 -58.93 -53.02 63.15 Favored 'General case' 0 N--CA 1.484 1.237 0 C-N-CA 122.663 0.385 . . . . 70.03 110.539 171.947 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 87.2 m -56.43 -40.31 74.54 Favored 'General case' 0 C--N 1.358 0.949 0 C-N-CA 123.502 0.721 . . . . 71.01 111.486 -178.654 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 47' ' ' VAL . . . . . 0.633 HG22 ' HB3' ' A' ' 10' ' ' ARG . 44.9 t -70.36 -41.22 78.43 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.078 0 C-N-CA 123.406 0.682 . . . . 73.33 111.293 -177.055 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 48' ' ' MET . . . . . . . . . . . . . 77.3 mtm -71.34 -30.8 66.62 Favored 'General case' 0 N--CA 1.486 1.361 0 C-N-CA 122.505 0.322 . . . . 75.32 111.667 179.519 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 62.3 mt-10 -82.57 -8.3 59.61 Favored 'General case' 0 N--CA 1.482 1.167 0 C-N-CA 123.314 0.646 . . . . 73.33 111.334 176.332 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -90.41 139.9 30.23 Favored 'General case' 0 N--CA 1.469 0.502 0 C-N-CA 123.002 0.521 . . . . 72.24 110.407 -176.002 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 7.7 tt0 -68.78 140.97 55.31 Favored 'General case' 0 CA--C 1.537 0.477 0 C-N-CA 124.172 0.989 . . . . 74.21 109.893 174.784 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 52' ' ' THR . . . . . 0.433 ' HA ' ' HD3' ' A' ' 53' ' ' PRO . 25.2 m -83.76 128.18 64.5 Favored Pre-proline 0 CA--C 1.547 0.844 0 N-CA-C 109.548 -0.538 . . . . 63.4 109.548 174.709 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 53' ' ' PRO . . . . . 0.555 ' HG2' ' HA ' ' A' ' 4' ' ' THR . 25.7 Cg_exo -65.57 155.07 70.89 Favored 'Trans proline' 0 C--N 1.376 1.99 0 C-N-CA 123.086 2.524 . . . . 52.02 113.548 -179.422 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 54' ' ' PRO . . . . . 0.485 ' HA ' HD11 ' A' ' 113' ' ' LEU . 37.9 Cg_endo -66.1 -47.46 3.47 Favored 'Trans proline' 0 C--N 1.382 2.292 0 C-N-CA 123.165 2.577 . . . . 73.43 112.687 176.736 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . -75.34 78.89 1.09 Allowed Glycine 0 C--N 1.343 0.938 0 O-C-N 123.748 0.655 . . . . 72.2 113.882 -172.824 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 65.4 mt -116.88 117.16 54.49 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.651 0 N-CA-C 108.134 -1.062 . . . . 72.14 108.134 173.99 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 62.8 p -95.92 -168.05 1.69 Allowed 'General case' 0 N--CA 1.476 0.866 0 C-N-CA 123.663 0.785 . . . . 75.11 110.024 179.11 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 32.5 tpt180 -58.82 -63.76 1.18 Allowed 'General case' 0 C--N 1.355 0.819 0 C-N-CA 124.025 0.93 . . . . 72.21 110.271 175.355 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 13.1 m -59.84 -38.04 80.94 Favored 'General case' 0 C--N 1.353 0.73 0 O-C-N 123.989 0.805 . . . . 53.42 111.655 -175.111 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 60' ' ' ILE . . . . . 0.485 HD13 HG21 ' A' ' 4' ' ' THR . 94.5 mt -61.62 -48.79 87.11 Favored 'Isoleucine or valine' 0 C--N 1.357 0.923 0 O-C-N 123.833 0.708 . . . . 75.44 110.28 176.71 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 49.8 tt0 -59.26 -41.69 89.41 Favored 'General case' 0 N--CA 1.479 1.022 0 C-N-CA 123.259 0.623 . . . . 75.34 111.261 -179.211 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 23.6 m-20 -74.04 -32.81 63.5 Favored 'General case' 0 N--CA 1.476 0.833 0 N-CA-C 112.297 0.48 . . . . 63.44 112.297 -178.54 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 63' ' ' MET . . . . . . . . . . . . . 67.8 mtm -71.51 -43.55 66.29 Favored 'General case' 0 N--CA 1.486 1.374 0 CA-C-N 118.194 0.452 . . . . 74.21 110.432 177.408 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 64' ' ' VAL . . . . . 0.483 ' O ' HG13 ' A' ' 68' ' ' ILE . 78.9 t -63.65 -61.64 1.58 Allowed 'Isoleucine or valine' 0 CA--C 1.54 0.576 0 O-C-N 123.936 0.772 . . . . 73.42 109.443 177.68 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -63.26 -26.45 68.79 Favored 'General case' 0 N--CA 1.485 1.287 0 C-N-CA 123.433 0.693 . . . . 31.31 112.442 -179.201 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -66.17 -46.69 78.11 Favored Glycine 0 C--N 1.343 0.958 0 N-CA-C 111.581 -0.607 . . . . 40.43 111.581 174.797 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 67' ' ' TYR . . . . . 0.504 ' CE2' ' HG2' ' A' ' 12' ' ' GLN . 12.6 m-30 -77.15 -23.17 51.67 Favored 'General case' 0 N--CA 1.468 0.446 0 CA-C-O 118.8 -0.619 . . . . 65.24 112.12 178.095 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 68' ' ' ILE . . . . . 0.483 HG13 ' O ' ' A' ' 64' ' ' VAL . 49.4 mt -68.96 -53.68 24.72 Favored 'Isoleucine or valine' 0 C--N 1.363 1.156 0 N-CA-C 108.04 -1.096 . . . . 73.24 108.04 172.472 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 69' ' ' LYS . . . . . 0.511 ' HB2' ' HE2' ' A' ' 106' ' ' TYR . 49.9 tptt -54.14 -46.18 72.15 Favored 'General case' 0 N--CA 1.487 1.394 0 C-N-CA 123.641 0.776 . . . . 75.43 110.962 178.106 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 62.9 tt0 -57.84 -50.2 74.09 Favored 'General case' 0 CA--C 1.537 0.456 0 O-C-N 124.3 1.0 . . . . 72.35 109.99 179.532 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 71' ' ' THR . . . . . 0.598 ' HB ' ' HA ' ' A' ' 15' ' ' ALA . 11.5 t -74.16 -20.44 60.22 Favored 'General case' 0 C--O 1.207 -1.179 0 CA-C-O 118.539 -0.743 . . . . 71.3 111.632 -178.818 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 72' ' ' LEU . . . . . 0.56 HD21 ' HB3' ' A' ' 102' ' ' LEU . 17.9 mt -70.15 -40.04 74.98 Favored 'General case' 0 N--CA 1.484 1.237 0 CA-C-N 118.622 0.646 . . . . 73.22 109.436 175.464 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 71.5 m-20 -66.88 -52.54 42.17 Favored 'General case' 0 C--N 1.342 0.266 0 O-C-N 123.898 0.749 . . . . 62.23 109.799 178.808 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 74' ' ' ASN . . . . . 0.518 ' HA ' HD22 ' A' ' 22' ' ' LEU . 53.9 m-20 -58.04 -50.45 73.39 Favored 'General case' 0 N--CA 1.479 1.025 0 C-N-CA 123.661 0.785 . . . . 73.24 110.932 -179.523 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . 0.495 ' O ' ' HG2' ' A' ' 79' ' ' LYS . 4.8 tp10 -57.35 -60.2 3.99 Favored 'General case' 0 N--CA 1.473 0.724 0 C-N-CA 124.162 0.985 . . . . 72.32 110.564 179.674 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 7.8 tt0 -61.29 -35.48 77.45 Favored 'General case' 0 N--CA 1.479 1.002 0 C-N-CA 123.985 0.914 . . . . 71.21 111.658 -171.525 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . 0.418 ' O ' ' HB2' ' A' ' 81' ' ' LEU . 63.5 mt -60.35 -51.29 70.13 Favored 'General case' 0 C--N 1.357 0.902 0 O-C-N 123.862 0.726 . . . . 74.14 109.426 173.579 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . 0.603 HD21 ' HA ' ' A' ' 22' ' ' LEU . 75.6 mt -59.03 -39.4 81.83 Favored 'General case' 0 N--CA 1.484 1.246 0 O-C-N 123.765 0.666 . . . . 74.24 112.45 177.952 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 79' ' ' LYS . . . . . 0.495 ' HG2' ' O ' ' A' ' 75' ' ' GLU . 7.8 mmpt? -65.5 -40.19 92.76 Favored 'General case' 0 CA--C 1.546 0.802 0 N-CA-C 109.618 -0.512 . . . . 70.24 109.618 -178.079 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -85.5 -8.87 79.99 Favored Glycine 0 C--N 1.349 1.257 0 CA-C-N 115.347 -0.842 . . . . 61.22 113.586 176.291 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . 0.624 HD22 ' HH2' ' A' ' 30' ' ' TRP . 2.5 tt -81.99 -41.85 20.18 Favored 'General case' 0 N--CA 1.479 0.996 0 C-N-CA 123.114 0.565 . . . . 72.55 109.635 178.693 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 82' ' ' LEU . . . . . 0.452 ' HB2' ' HB2' ' A' ' 87' ' ' ASP . 97.1 mt -57.78 -63.33 1.28 Allowed 'General case' 0 N--CA 1.482 1.144 0 N-CA-C 112.68 0.622 . . . . 70.23 112.68 -173.976 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 43.0 mt-30 -135.59 29.83 3.21 Favored 'General case' 0 N--CA 1.496 1.838 0 C-N-CA 122.663 0.385 . . . . 74.45 111.0 -179.625 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 6.1 tp-100 71.17 16.28 6.3 Favored 'General case' 0 N--CA 1.492 1.654 0 C-N-CA 124.328 1.051 . . . . 74.51 113.05 169.499 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 85' ' ' ARG . . . . . . . . . . . . . 65.8 mtp85 -129.25 -120.61 0.23 Allowed 'General case' 0 N--CA 1.487 1.396 0 O-C-N 121.593 -0.692 . . . . 72.41 110.595 -178.02 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 91.2 mt -133.81 55.37 1.9 Allowed 'General case' 0 N--CA 1.478 0.949 0 N-CA-C 107.676 -1.231 . . . . 64.42 107.676 178.797 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 87' ' ' ASP . . . . . 0.452 ' HB2' ' HB2' ' A' ' 82' ' ' LEU . 6.2 m-20 -78.93 167.64 20.84 Favored 'General case' 0 N--CA 1.472 0.65 0 CA-C-N 113.36 -1.746 . . . . 70.43 111.19 -173.736 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 88' ' ' GLU . . . . . 0.42 ' HG3' ' H ' ' A' ' 90' ' ' SER . 14.4 tp10 -136.48 147.18 47.03 Favored 'General case' 0 N--CA 1.485 1.324 0 N-CA-C 109.315 -0.624 . . . . 65.32 109.315 179.556 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 98.1 mt -55.02 -38.86 68.46 Favored 'General case' 0 C--N 1.358 0.954 0 O-C-N 124.248 0.967 . . . . 74.33 110.688 177.611 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 90' ' ' SER . . . . . 0.42 ' H ' ' HG3' ' A' ' 88' ' ' GLU . 23.0 t -137.39 -124.01 0.14 Allowed 'General case' 0 CA--C 1.549 0.938 0 N-CA-C 107.738 -1.208 . . . . 64.5 107.738 175.599 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 71.1 m -145.31 141.53 28.62 Favored 'General case' 0 N--CA 1.473 0.717 0 CA-C-N 119.263 0.938 . . . . 75.32 109.637 170.963 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 92' ' ' LEU . . . . . 0.538 HD22 ' HG2' ' A' ' 45' ' ' GLU . 20.8 mt -97.91 -134.03 0.24 Allowed 'General case' 0 N--CA 1.474 0.767 0 C-N-CA 123.808 0.843 . . . . 71.43 109.003 173.55 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 65.3 mt -42.52 -48.24 1.1 Allowed 'Isoleucine or valine' 0 C--N 1.367 1.368 0 C-N-CA 124.151 0.98 . . . . 65.22 110.341 167.915 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 169.87 -133.97 3.0 Favored Glycine 0 C--N 1.344 1.009 0 CA-C-N 115.534 -0.757 . . . . 23.21 111.424 171.211 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -69.91 154.72 41.59 Favored 'General case' 0 CA--C 1.548 0.871 0 C-N-CA 123.077 0.551 . . . . 70.53 110.919 173.493 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 19.6 m 66.12 -82.91 0.03 OUTLIER 'General case' 0 N--CA 1.48 1.068 0 C-N-CA 125.15 1.38 . . . . 73.34 110.749 -175.766 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 97' ' ' THR . . . . . 0.462 ' HB ' ' HD3' ' A' ' 98' ' ' ARG . 28.6 m 47.02 -82.35 0.01 OUTLIER 'General case' 0 CA--C 1.553 1.072 0 C-N-CA 126.23 1.812 . . . . 55.2 114.795 175.676 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 98' ' ' ARG . . . . . 0.606 ' H ' ' HD3' ' A' ' 98' ' ' ARG . 0.8 OUTLIER -57.48 -56.44 21.79 Favored 'General case' 0 N--CA 1.477 0.919 0 C-N-CA 124.593 1.157 . . . . 74.41 111.539 -164.993 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 51.3 tt0 -61.28 -54.89 38.27 Favored 'General case' 0 CA--C 1.539 0.547 0 CA-C-N 114.672 -1.149 . . . . 64.21 110.596 -174.142 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 87.9 tttt -64.99 -53.65 42.85 Favored 'General case' 0 N--CA 1.476 0.854 0 O-C-N 123.719 0.637 . . . . 73.22 111.704 -176.034 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 44.8 t -57.48 -49.26 76.87 Favored 'General case' 0 N--CA 1.478 0.938 0 C-N-CA 123.773 0.829 . . . . 72.33 111.772 -174.747 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 102' ' ' LEU . . . . . 0.56 ' HB3' HD21 ' A' ' 72' ' ' LEU . 9.4 mp -77.49 -27.03 51.78 Favored 'General case' 0 CA--C 1.556 1.187 0 O-C-N 123.586 0.554 . . . . 62.55 111.55 -176.203 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 24.9 t-20 -70.1 -41.35 74.12 Favored 'General case' 0 N--CA 1.49 1.574 0 C-N-CA 122.64 0.376 . . . . 74.12 111.119 173.946 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -68.89 -41.22 78.59 Favored 'General case' 0 N--CA 1.476 0.871 0 C-N-CA 123.536 0.734 . . . . 71.3 109.194 178.035 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -60.08 -40.11 88.42 Favored 'General case' 0 C--N 1.352 0.694 0 O-C-N 124.07 0.856 . . . . 40.4 110.478 176.284 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 106' ' ' TYR . . . . . 0.511 ' HE2' ' HB2' ' A' ' 69' ' ' LYS . 4.6 t80 -64.2 -49.5 71.76 Favored 'General case' 0 N--CA 1.475 0.784 0 C-N-CA 123.695 0.798 . . . . 73.24 110.596 178.278 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -63.96 -40.49 98.31 Favored Glycine 0 C--N 1.353 1.513 0 O-C-N 123.431 0.457 . . . . 31.44 113.019 -175.65 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 93.8 mtt180 -74.49 -30.22 61.74 Favored 'General case' 0 N--CA 1.469 0.49 0 C-N-CA 123.446 0.698 . . . . 72.4 110.603 178.239 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 52.4 tp -64.17 -45.06 90.09 Favored 'General case' 0 N--CA 1.484 1.238 0 C-N-CA 123.368 0.667 . . . . 75.21 110.272 173.895 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 39.8 t -63.0 -48.75 77.47 Favored 'General case' 0 CA--C 1.538 0.484 0 O-C-N 124.558 1.161 . . . . 63.35 110.149 -179.521 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . -81.22 -61.45 2.1 Favored Glycine 0 C--N 1.349 1.295 0 C-N-CA 121.243 -0.503 . . . . 62.03 113.515 -176.565 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 112' ' ' MET . . . . . . . . . . . . . 64.6 mmm -93.44 -65.72 0.97 Allowed 'General case' 0 N--CA 1.484 1.271 0 N-CA-C 114.127 1.158 . . . . 72.04 114.127 -173.351 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 113' ' ' LEU . . . . . 0.485 HD11 ' HA ' ' A' ' 54' ' ' PRO . 5.8 tt 179.94 -36.29 0.01 OUTLIER 'General case' 0 N--CA 1.474 0.771 0 C-N-CA 124.099 0.96 . . . . 74.11 108.517 -168.947 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 114' ' ' LEU . . . . . 0.442 ' HB2' ' O ' ' A' ' 113' ' ' LEU . 3.5 tt 147.84 -16.08 0.0 OUTLIER 'General case' 0 N--CA 1.498 1.936 0 C-N-CA 129.263 3.025 . . . . 63.12 106.367 178.284 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 115' ' ' VAL . . . . . . . . . . . . . 23.6 m -74.32 137.96 75.03 Favored Pre-proline 0 CA--C 1.551 1.012 0 CA-C-N 115.247 -0.888 . . . . 75.44 110.423 179.231 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 3.4 Cg_exo -74.81 122.53 7.35 Favored 'Trans proline' 0 C--N 1.377 2.047 0 C-N-CA 122.557 2.171 . . . . 62.41 110.828 176.428 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 14.1 t70 -133.92 -68.56 0.56 Allowed 'General case' 0 N--CA 1.475 0.802 0 N-CA-C 107.383 -1.34 . . . . 61.05 107.383 -179.826 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -116.24 115.35 40.4 Favored Pre-proline 0 C--O 1.239 0.541 0 N-CA-C 107.766 -1.198 . . . . 71.52 107.766 169.822 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 119' ' ' PRO . . . . . . . . . . . . . 31.2 Cg_endo -62.3 -29.92 80.51 Favored 'Trans proline' 0 C--N 1.372 1.804 0 C-N-CA 122.45 2.1 . . . . 75.01 112.102 173.605 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . 167.9 165.85 25.99 Favored Glycine 0 C--N 1.348 1.216 0 N-CA-C 111.848 -0.501 . . . . 72.2 111.848 177.287 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . -156.9 100.58 1.9 Allowed 'General case' 0 N--CA 1.475 0.8 0 C-N-CA 123.733 0.813 . . . . 73.45 109.807 178.759 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 122' ' ' SER . . . . . . . . . . . . . 29.3 t . . . . . 0 CA--C 1.553 1.079 0 N-CA-C 108.396 -0.964 . . . . 73.31 108.396 176.625 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 22.1 ttt . . . . . 0 N--CA 1.485 1.313 0 CA-C-O 119.628 -0.225 . . . . 65.42 110.777 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 36.8 p -52.36 -45.84 65.91 Favored 'General case' 0 N--CA 1.487 1.378 0 C-N-CA 123.736 0.815 . . . . 75.34 112.394 -175.221 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 17.4 m -67.81 -33.47 74.87 Favored 'General case' 0 CA--C 1.552 1.051 0 C-N-CA 123.46 0.704 . . . . 73.1 111.497 -178.547 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . 0.545 HG21 HD13 ' A' ' 60' ' ' ILE . 60.2 m -70.94 -41.18 71.49 Favored 'General case' 0 N--CA 1.475 0.793 0 C-N-CA 123.705 0.802 . . . . 23.31 110.739 177.536 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 95.5 t -66.67 -37.56 79.78 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.835 0 C-N-CA 123.353 0.661 . . . . 70.21 109.62 -179.168 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . 0.401 ' O ' ' HG3' ' A' ' 10' ' ' ARG . 57.2 mt-10 -62.49 -48.69 78.46 Favored 'General case' 0 C--N 1.356 0.861 0 O-C-N 123.727 0.642 . . . . 43.41 110.242 171.344 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 30.4 t80 -61.34 -46.17 91.36 Favored 'General case' 0 N--CA 1.481 1.102 0 C-N-CA 124.268 1.027 . . . . 63.21 111.249 -174.086 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 82.9 mt -65.57 -41.31 90.49 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.785 0 C-N-CA 123.789 0.835 . . . . 70.41 109.741 176.208 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 3.7 t-20 -65.6 -28.17 68.94 Favored 'General case' 0 N--CA 1.484 1.26 0 C-N-CA 123.02 0.528 . . . . 61.41 111.426 179.452 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . 0.425 ' HD3' HG22 ' A' ' 47' ' ' VAL . 62.4 mtt85 -70.11 -46.9 63.84 Favored 'General case' 0 C--O 1.224 -0.244 0 N-CA-C 109.168 -0.679 . . . . 74.0 109.168 174.504 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 11' ' ' TRP . . . . . 0.432 ' CD1' HG13 ' A' ' 64' ' ' VAL . 91.1 m95 -68.86 -20.96 64.29 Favored 'General case' 0 N--CA 1.478 0.935 0 O-C-N 123.385 0.428 . . . . 62.0 111.818 175.731 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 53.9 mt-30 -65.97 -52.19 51.72 Favored 'General case' 0 N--CA 1.477 0.921 0 N-CA-C 108.016 -1.105 . . . . 73.41 108.016 169.323 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 14.8 tpt180 -55.61 -44.86 77.44 Favored 'General case' 0 CA--C 1.547 0.856 0 O-C-N 124.267 0.98 . . . . 73.13 111.224 -179.368 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 14' ' ' ILE . . . . . 0.634 HD11 HG21 ' A' ' 47' ' ' VAL . 77.8 mt -70.41 -50.25 47.3 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.81 0 C-N-CA 123.775 0.83 . . . . 72.45 111.096 -177.011 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -58.54 -44.57 89.66 Favored 'General case' 0 N--CA 1.485 1.275 0 C-N-CA 123.688 0.795 . . . . 73.14 111.263 -178.8 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 95.1 mt -71.92 -43.58 65.09 Favored 'General case' 0 N--CA 1.475 0.821 0 CA-C-N 114.514 -1.221 . . . . 63.14 110.918 -177.879 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.427 ' O ' ' HG ' ' A' ' 21' ' ' LEU . 17.7 mt -63.1 -44.59 95.26 Favored 'General case' 0 N--CA 1.487 1.396 0 CA-C-O 119.227 -0.416 . . . . 64.45 110.992 178.772 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 81.0 p -65.08 -39.58 93.41 Favored 'General case' 0 N--CA 1.474 0.773 0 C-N-CA 123.006 0.522 . . . . 54.03 110.667 -178.961 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 19' ' ' GLN . . . . . 0.439 HE21 HE21 ' A' ' 70' ' ' GLN . 6.6 tp-100 -59.66 -47.98 83.46 Favored 'General case' 0 C--N 1.359 1.014 0 O-C-N 123.894 0.746 . . . . 73.21 110.33 174.47 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 68.1 m -58.37 -52.94 63.51 Favored 'General case' 0 C--O 1.208 -1.116 0 CA-C-N 115.456 -0.793 . . . . 61.2 110.481 177.701 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . 0.566 HD22 ' HA ' ' A' ' 33' ' ' LEU . 89.1 mt -65.92 -24.71 66.88 Favored 'General case' 0 N--CA 1.474 0.736 0 C-N-CA 124.197 0.999 . . . . 60.11 111.486 -175.145 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.691 ' HA ' HD21 ' A' ' 78' ' ' LEU . 57.4 tp -69.88 -53.81 16.34 Favored 'General case' 0 C--N 1.356 0.873 0 N-CA-C 109.814 -0.439 . . . . 75.43 109.814 174.357 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . 0.408 ' O ' ' HG3' ' A' ' 27' ' ' ARG . 40.8 mt-10 -57.27 -49.94 74.47 Favored 'General case' 0 N--CA 1.48 1.067 0 O-C-N 123.968 0.792 . . . . 74.11 110.161 178.628 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.53 ' HB3' ' HB2' ' A' ' 29' ' ' GLU . 95.0 mt -59.4 -42.23 91.27 Favored 'General case' 0 CA--C 1.536 0.438 0 C-N-CA 125.244 1.418 . . . . 71.22 110.878 -178.218 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . 0.64 ' HB2' HD21 ' A' ' 33' ' ' LEU . . . -58.73 -48.62 80.52 Favored 'General case' 0 N--CA 1.48 1.032 0 C-N-CA 122.613 0.365 . . . . 64.11 110.753 175.78 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 96.1 mt-30 -63.04 -30.25 71.45 Favored 'General case' 0 CA--C 1.55 0.945 0 O-C-N 124.063 0.852 . . . . 61.23 111.407 -179.591 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . 0.408 ' HG3' ' O ' ' A' ' 23' ' ' GLU . 90.4 mtt180 -78.83 -28.05 44.36 Favored 'General case' 0 N--CA 1.483 1.207 0 C-N-CA 123.688 0.795 . . . . 74.22 111.082 178.216 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 98.73 22.53 13.66 Favored Glycine 0 C--N 1.352 1.436 0 C-N-CA 123.117 0.389 . . . . 44.11 113.603 -176.493 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . 0.53 ' HB2' ' HB3' ' A' ' 24' ' ' LEU . 14.8 mm-40 -86.52 54.27 3.1 Favored 'General case' 0 CA--C 1.552 1.044 0 C-N-CA 125.04 1.336 . . . . 74.44 110.396 177.72 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 30' ' ' TRP . . . . . 0.517 ' HH2' HD21 ' A' ' 81' ' ' LEU . 57.2 m95 -59.49 -33.84 71.84 Favored 'General case' 0 N--CA 1.486 1.34 0 C-N-CA 124.257 1.023 . . . . 71.22 112.009 -171.952 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 3.7 m-20 -58.62 -41.42 85.88 Favored 'General case' 0 N--CA 1.474 0.736 0 C-N-CA 124.462 1.105 . . . . 75.24 110.697 -178.407 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 86.0 mt -69.78 -31.83 69.99 Favored 'General case' 0 N--CA 1.472 0.647 0 CA-C-N 115.141 -0.936 . . . . 63.13 110.955 -177.369 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . 0.64 HD21 ' HB2' ' A' ' 25' ' ' ALA . 10.1 mp -67.71 -43.94 78.85 Favored 'General case' 0 N--CA 1.482 1.146 0 C-N-CA 122.934 0.494 . . . . 75.24 110.466 174.35 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.421 ' HG ' ' O ' ' A' ' 30' ' ' TRP . 73.1 mt -67.07 -37.58 84.25 Favored 'General case' 0 N--CA 1.484 1.238 0 O-C-N 123.606 0.566 . . . . 61.32 111.767 -177.53 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 98.5 mt-30 -70.91 -54.1 12.64 Favored 'General case' 0 N--CA 1.477 0.889 0 C-N-CA 123.025 0.53 . . . . 53.51 110.172 177.969 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 83.6 mm-40 -68.34 -16.45 63.94 Favored 'General case' 0 N--CA 1.474 0.741 0 CA-C-O 118.484 -0.769 . . . . 74.13 112.382 -178.622 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 33.3 tt0 -50.39 -46.3 56.01 Favored 'General case' 0 N--CA 1.48 1.068 0 C-N-CA 123.306 0.642 . . . . 74.51 111.348 176.947 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 60.5 t -62.32 -55.67 22.51 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.752 0 C-N-CA 123.336 0.655 . . . . 55.2 111.403 -176.022 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 29.4 p -68.52 -39.62 81.11 Favored 'General case' 0 N--CA 1.478 0.95 0 C-N-CA 123.614 0.766 . . . . 63.01 111.675 -175.957 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 45.6 t80 -64.83 -49.31 71.12 Favored 'General case' 0 N--CA 1.477 0.92 0 C-N-CA 124.189 0.996 . . . . 72.34 111.063 -177.412 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . 0.562 ' HA ' HG22 ' A' ' 44' ' ' ILE . 86.8 mt -72.77 -34.09 66.73 Favored 'General case' 0 C--O 1.243 0.76 0 O-C-N 123.721 0.638 . . . . 71.33 111.066 -178.566 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 53.2 tt0 -57.36 -51.85 67.72 Favored 'General case' 0 C--N 1.353 0.736 0 O-C-N 123.666 0.604 . . . . 73.34 109.513 173.625 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . 0.594 ' O ' HG23 ' A' ' 47' ' ' VAL . 69.0 m -56.94 -56.39 22.31 Favored 'General case' 0 C--N 1.351 0.664 0 O-C-N 124.479 1.112 . . . . 63.15 110.423 179.865 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 44' ' ' ILE . . . . . 0.607 HG13 HD13 ' A' ' 14' ' ' ILE . 14.3 tt -62.61 -38.54 81.78 Favored 'Isoleucine or valine' 0 C--O 1.252 1.236 0 C-N-CA 123.553 0.741 . . . . 54.03 112.205 -168.687 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 31.9 mm-40 -69.62 -37.78 76.97 Favored 'General case' 0 C--N 1.359 0.993 0 O-C-N 123.114 0.258 . . . . 62.24 110.508 174.819 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 87.6 m -65.46 -28.4 69.19 Favored 'General case' 0 CA--C 1.557 1.214 0 C-N-CA 123.44 0.696 . . . . 61.42 111.762 176.166 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 47' ' ' VAL . . . . . 0.634 HG21 HD11 ' A' ' 14' ' ' ILE . 12.9 t -77.23 -42.45 31.09 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.396 0 O-C-N 122.086 -0.384 . . . . 75.05 110.074 179.123 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 48' ' ' MET . . . . . . . . . . . . . 74.3 mtm -74.43 -13.63 60.74 Favored 'General case' 0 N--CA 1.482 1.135 0 CA-C-N 116.294 -0.412 . . . . 73.53 110.936 173.927 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 15.8 tp10 -80.47 -35.21 35.18 Favored 'General case' 0 N--CA 1.477 0.877 0 C-N-CA 123.457 0.703 . . . . 53.25 109.649 169.171 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 13.9 mptt -70.52 123.58 22.15 Favored 'General case' 0 N--CA 1.472 0.649 0 N-CA-C 109.156 -0.683 . . . . 64.2 109.156 175.611 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 8.8 tt0 -62.71 150.46 41.07 Favored 'General case' 0 C--O 1.242 0.672 0 CA-C-N 115.049 -0.978 . . . . 72.31 110.289 178.316 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 52' ' ' THR . . . . . 0.424 HG21 ' HG ' ' A' ' 113' ' ' LEU . 11.3 m -58.56 116.23 14.45 Favored Pre-proline 0 CA--C 1.552 1.037 0 N-CA-C 109.737 -0.468 . . . . 64.33 109.737 174.452 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 46.5 Cg_endo -64.93 156.08 64.34 Favored 'Trans proline' 0 C--N 1.373 1.848 0 C-N-CA 122.378 2.052 . . . . 75.51 112.414 -177.196 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 46.8 Cg_exo -57.49 -46.4 27.73 Favored 'Trans proline' 0 C--N 1.378 2.102 0 C-N-CA 123.249 2.632 . . . . 54.55 112.875 179.167 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . -77.47 71.13 2.34 Favored Glycine 0 C--N 1.348 1.206 0 CA-C-N 115.597 -0.728 . . . . 34.2 114.343 -175.511 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 19.8 mm -103.56 108.39 24.39 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.6 0 N-CA-C 107.93 -1.137 . . . . 52.44 107.93 170.595 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 57' ' ' THR . . . . . 0.443 ' H ' HD12 ' A' ' 60' ' ' ILE . 64.5 p -89.67 176.31 6.91 Favored 'General case' 0 C--O 1.247 0.946 0 N-CA-C 108.349 -0.982 . . . . 43.33 108.349 167.725 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 34.2 tpt85 -61.5 -50.67 71.8 Favored 'General case' 0 CA--C 1.543 0.702 0 N-CA-C 109.747 -0.464 . . . . 72.23 109.747 179.813 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 37.4 m -58.02 -39.94 79.6 Favored 'General case' 0 CA--C 1.543 0.71 0 O-C-N 124.083 0.865 . . . . 51.43 111.64 179.207 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 60' ' ' ILE . . . . . 0.545 HD13 HG21 ' A' ' 4' ' ' THR . 81.2 mt -63.02 -46.48 96.16 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.094 0 C-N-CA 123.664 0.786 . . . . 62.22 110.784 178.387 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 56.6 tt0 -57.18 -42.71 81.66 Favored 'General case' 0 N--CA 1.478 0.947 0 C-N-CA 123.541 0.736 . . . . 61.13 110.918 177.573 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 44.3 m-20 -70.61 -38.99 74.03 Favored 'General case' 0 N--CA 1.48 1.033 0 CA-C-N 116.025 -0.534 . . . . 63.23 112.151 179.571 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 63' ' ' MET . . . . . . . . . . . . . 72.6 mtm -69.67 -42.37 74.25 Favored 'General case' 0 N--CA 1.485 1.318 0 C-N-CA 122.509 0.324 . . . . 62.22 110.774 -177.816 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 64' ' ' VAL . . . . . 0.522 ' O ' HG13 ' A' ' 68' ' ' ILE . 79.4 t -64.07 -56.7 15.08 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.519 0 O-C-N 123.994 0.809 . . . . 64.42 109.421 177.499 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . 0.407 ' HB2' HD23 ' A' ' 109' ' ' LEU . . . -63.33 -29.58 70.87 Favored 'General case' 0 N--CA 1.486 1.339 0 C-N-CA 122.871 0.468 . . . . 73.32 112.012 -179.158 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -67.16 -40.85 92.64 Favored Glycine 0 C--N 1.347 1.168 0 N-CA-C 111.659 -0.576 . . . . 74.24 111.659 175.84 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 67' ' ' TYR . . . . . 0.478 ' O ' HG22 ' A' ' 71' ' ' THR . 15.4 m-30 -69.21 -39.85 78.34 Favored 'General case' 0 C--O 1.241 0.639 0 C-N-CA 123.425 0.69 . . . . 61.31 110.999 175.943 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 68' ' ' ILE . . . . . 0.542 ' O ' ' HG ' ' A' ' 72' ' ' LEU . 36.9 mt -60.11 -44.71 95.67 Favored 'Isoleucine or valine' 0 C--N 1.365 1.256 0 N-CA-C 108.286 -1.005 . . . . 73.21 108.286 176.152 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 69' ' ' LYS . . . . . 0.477 ' HB2' ' HE2' ' A' ' 106' ' ' TYR . 51.5 tptt -58.07 -45.26 87.38 Favored 'General case' 0 N--CA 1.476 0.856 0 C-N-CA 123.82 0.848 . . . . 73.24 110.683 179.166 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 70' ' ' GLN . . . . . 0.439 HE21 HE21 ' A' ' 19' ' ' GLN . 60.5 tt0 -60.02 -45.97 91.02 Favored 'General case' 0 C--N 1.352 0.688 0 O-C-N 123.798 0.687 . . . . 74.11 110.413 -179.676 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 71' ' ' THR . . . . . 0.478 HG22 ' O ' ' A' ' 67' ' ' TYR . 1.8 t -75.57 -22.74 56.71 Favored 'General case' 0 C--N 1.355 0.814 0 CA-C-O 119.196 -0.431 . . . . 71.33 111.259 -178.584 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 72' ' ' LEU . . . . . 0.542 ' HG ' ' O ' ' A' ' 68' ' ' ILE . 34.2 mt -64.03 -53.33 51.69 Favored 'General case' 0 C--N 1.361 1.101 0 N-CA-C 108.794 -0.817 . . . . 75.12 108.794 173.871 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 66.9 m-20 -64.39 -52.92 55.83 Favored 'General case' 0 N--CA 1.475 0.779 0 O-C-N 123.906 0.754 . . . . 74.35 111.24 -177.077 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 74' ' ' ASN . . . . . 0.428 ' ND2' ' HG2' ' A' ' 70' ' ' GLN . 90.3 m-20 -55.58 -54.0 49.44 Favored 'General case' 0 N--CA 1.482 1.17 0 O-C-N 124.164 0.915 . . . . 75.5 111.188 -177.964 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . 0.444 ' HG2' ' HE2' ' A' ' 79' ' ' LYS . 13.8 tt0 -73.31 -30.09 63.14 Favored 'General case' 0 CA--C 1.553 1.077 0 CA-C-N 115.723 -0.672 . . . . 72.42 110.857 -173.225 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 10.1 tt0 -69.1 -39.08 79.19 Favored 'General case' 0 N--CA 1.488 1.472 0 C-N-CA 123.458 0.703 . . . . 75.2 110.568 177.284 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 90.4 mt -63.37 -40.08 96.28 Favored 'General case' 0 C--N 1.351 0.671 0 CA-C-N 115.516 -0.766 . . . . 63.12 109.251 172.478 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . 0.691 HD21 ' HA ' ' A' ' 22' ' ' LEU . 50.2 mt -60.56 -37.07 80.08 Favored 'General case' 0 N--CA 1.478 0.958 0 O-C-N 123.904 0.752 . . . . 75.44 112.12 175.112 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 79' ' ' LYS . . . . . 0.444 ' HE2' ' HG2' ' A' ' 75' ' ' GLU . 66.4 mmtt -63.99 -54.79 28.82 Favored 'General case' 0 N--CA 1.476 0.853 0 N-CA-C 108.747 -0.835 . . . . 74.35 108.747 176.493 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -59.87 -26.95 63.67 Favored Glycine 0 C--N 1.358 1.764 0 O-C-N 124.214 0.946 . . . . 53.41 113.72 -179.767 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . 0.517 HD21 ' HH2' ' A' ' 30' ' ' TRP . 8.5 tt -77.91 -40.71 38.94 Favored 'General case' 0 CA--C 1.545 0.76 0 C-N-CA 124.258 1.023 . . . . 25.44 109.755 179.711 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 58.1 mt -76.11 -63.35 1.34 Allowed 'General case' 0 N--CA 1.478 0.968 0 C-N-CA 122.447 0.299 . . . . 61.11 111.435 -178.624 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 38.0 tt0 -155.94 7.59 0.22 Allowed 'General case' 0 N--CA 1.485 1.324 0 N-CA-C 111.978 0.362 . . . . 54.13 111.978 -172.247 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 47.2 mt-30 61.91 13.06 5.25 Favored 'General case' 0 N--CA 1.49 1.536 0 C-N-CA 124.769 1.228 . . . . 75.35 112.618 -170.845 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 85' ' ' ARG . . . . . . . . . . . . . 51.3 mtt180 -134.25 167.08 21.34 Favored 'General case' 0 N--CA 1.479 0.984 0 C-N-CA 123.562 0.745 . . . . 72.2 110.912 -169.784 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 86' ' ' LEU . . . . . 0.489 HD12 ' HA ' ' A' ' 96' ' ' SER . 81.8 mt -100.01 44.57 1.01 Allowed 'General case' 0 CA--C 1.547 0.836 0 C-N-CA 124.322 1.049 . . . . 73.25 111.514 -173.375 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 4.2 m-20 -78.56 -73.31 0.33 Allowed 'General case' 0 N--CA 1.479 0.991 0 N-CA-C 109.306 -0.628 . . . . 72.12 109.306 172.235 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 52.3 mt-10 -92.07 155.07 18.33 Favored 'General case' 0 N--CA 1.476 0.858 0 C-N-CA 123.945 0.898 . . . . 74.24 110.765 -178.395 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . 0.524 HD11 HD23 ' A' ' 33' ' ' LEU . 86.7 mt 58.41 26.13 13.76 Favored 'General case' 0 N--CA 1.484 1.242 0 C-N-CA 125.074 1.349 . . . . 75.2 110.572 -170.559 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 90' ' ' SER . . . . . 0.406 ' HA ' ' HD2' ' A' ' 98' ' ' ARG . 36.9 t -147.86 18.73 1.14 Allowed 'General case' 0 CA--C 1.551 0.993 0 C-N-CA 124.153 0.981 . . . . 72.42 110.636 -176.093 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 10.9 m -72.58 94.53 1.72 Allowed 'General case' 0 CA--C 1.549 0.919 0 N-CA-C 108.937 -0.764 . . . . 53.54 108.937 171.862 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 92' ' ' LEU . . . . . 0.549 HD11 ' HE ' ' A' ' 98' ' ' ARG . 11.2 mt -125.32 -83.61 0.64 Allowed 'General case' 0 N--CA 1.483 1.191 0 CA-C-O 121.505 0.669 . . . . 72.03 110.437 -176.244 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 93' ' ' ILE . . . . . 0.413 ' H ' ' HB2' ' A' ' 92' ' ' LEU . 65.5 mt -148.87 -51.46 0.08 OUTLIER 'Isoleucine or valine' 0 N--CA 1.476 0.839 0 N-CA-C 106.179 -1.785 . . . . 54.12 106.179 -164.93 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -131.63 -175.74 14.12 Favored Glycine 0 C--N 1.352 1.426 0 CA-C-N 114.032 -1.44 . . . . 63.04 112.568 -178.627 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 34.9 tt0 -74.15 -71.25 0.34 Allowed 'General case' 0 N--CA 1.473 0.719 0 C-N-CA 125.145 1.378 . . . . 72.51 111.708 -170.829 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 96' ' ' SER . . . . . 0.489 ' HA ' HD12 ' A' ' 86' ' ' LEU . 33.4 p -94.66 10.78 33.58 Favored 'General case' 0 C--O 1.241 0.609 0 C-N-CA 123.428 0.691 . . . . 70.43 111.63 -173.869 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 88.4 m -52.59 -39.51 61.67 Favored 'General case' 0 C--N 1.361 1.071 0 C-N-CA 124.544 1.138 . . . . 51.3 111.976 177.833 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 98' ' ' ARG . . . . . 0.924 HH12 HD22 ' A' ' 102' ' ' LEU . 4.0 tpm_? -56.89 -61.68 2.27 Favored 'General case' 0 N--CA 1.469 0.515 0 C-N-CA 123.275 0.63 . . . . 70.04 112.039 -168.145 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 8.4 tt0 -83.66 -42.57 16.52 Favored 'General case' 0 CA--C 1.534 0.362 0 CA-C-N 115.063 -0.972 . . . . 71.52 110.28 -169.526 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 8.0 tmtm? -62.81 -55.61 24.8 Favored 'General case' 0 N--CA 1.476 0.835 0 O-C-N 124.106 0.879 . . . . 73.43 109.529 -177.332 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 46.6 t -72.79 -35.37 67.38 Favored 'General case' 0 N--CA 1.478 0.931 0 CA-C-O 118.622 -0.704 . . . . 74.34 111.916 -174.896 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 102' ' ' LEU . . . . . 0.924 HD22 HH12 ' A' ' 98' ' ' ARG . 21.6 tp -67.96 -47.35 68.87 Favored 'General case' 0 C--N 1.368 1.402 0 CA-C-N 118.93 0.786 . . . . 75.34 111.212 179.748 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 59.7 t30 -74.08 -24.35 59.48 Favored 'General case' 0 N--CA 1.478 0.93 0 CA-C-N 115.796 -0.638 . . . . 74.12 110.792 -178.754 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 104' ' ' ASN . . . . . 0.421 ' O ' ' HG2' ' A' ' 108' ' ' ARG . 7.7 t30 -71.13 -39.16 72.16 Favored 'General case' 0 N--CA 1.479 1.016 0 C-N-CA 122.531 0.332 . . . . 75.21 110.223 170.781 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -63.09 -37.92 89.13 Favored 'General case' 0 N--CA 1.483 1.2 0 C-N-CA 123.047 0.539 . . . . 54.52 110.306 178.204 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 106' ' ' TYR . . . . . 0.477 ' HE2' ' HB2' ' A' ' 69' ' ' LYS . 3.5 t80 -57.93 -52.07 67.01 Favored 'General case' 0 C--N 1.356 0.876 0 CA-C-N 114.941 -1.027 . . . . 64.35 108.973 168.85 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -60.51 -31.95 76.29 Favored Glycine 0 C--N 1.352 1.423 0 O-C-N 124.056 0.848 . . . . 62.34 113.673 -176.235 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 108' ' ' ARG . . . . . 0.421 ' HG2' ' O ' ' A' ' 104' ' ' ASN . 5.1 mmp_? -76.69 -36.42 57.26 Favored 'General case' 0 C--N 1.344 0.344 0 N-CA-C 109.259 -0.645 . . . . 73.31 109.259 177.871 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 109' ' ' LEU . . . . . 0.41 HD13 ' HB2' ' A' ' 114' ' ' LEU . 42.1 tp -68.75 -30.69 69.35 Favored 'General case' 0 N--CA 1.489 1.489 0 C-N-CA 123.015 0.526 . . . . 44.42 111.152 177.235 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 38.5 t -77.66 -39.04 46.34 Favored 'General case' 0 CA--C 1.543 0.699 0 CA-C-N 115.014 -0.994 . . . . 71.1 109.584 178.105 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . -90.07 -64.03 1.25 Allowed Glycine 0 C--N 1.36 1.904 0 CA-C-O 119.571 -0.572 . . . . 72.11 114.272 -177.36 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 112' ' ' MET . . . . . 0.435 ' HG2' ' O ' ' A' ' 116' ' ' PRO . 11.2 tpt -96.79 -70.56 0.71 Allowed 'General case' 0 N--CA 1.489 1.501 0 CA-C-N 118.104 0.952 . . . . 74.51 113.272 -178.548 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 113' ' ' LEU . . . . . 0.424 ' HG ' HG21 ' A' ' 52' ' ' THR . 22.0 tp 170.11 41.69 0.0 OUTLIER 'General case' 0 N--CA 1.495 1.822 0 C-N-CA 124.195 0.998 . . . . 75.44 109.389 -177.125 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 114' ' ' LEU . . . . . 0.41 ' HB2' HD13 ' A' ' 109' ' ' LEU . 5.3 tt 75.66 -21.49 0.3 Allowed 'General case' 0 N--CA 1.504 2.248 0 C-N-CA 126.36 1.864 . . . . 73.1 111.575 179.668 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 115' ' ' VAL . . . . . . . . . . . . . 28.7 m -83.57 163.39 49.76 Favored Pre-proline 0 CA--C 1.562 1.415 0 C-N-CA 124.263 1.025 . . . . 70.13 108.561 170.555 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 116' ' ' PRO . . . . . 0.435 ' O ' ' HG2' ' A' ' 112' ' ' MET . 37.5 Cg_endo -63.29 179.46 0.86 Allowed 'Trans proline' 0 C--N 1.377 2.045 0 C-N-CA 122.2 1.933 . . . . 73.24 112.559 174.786 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 18.1 t70 -49.5 -66.02 0.47 Allowed 'General case' 0 N--CA 1.487 1.417 0 C-N-CA 124.892 1.277 . . . . 70.35 112.525 -172.56 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -127.07 84.12 64.29 Favored Pre-proline 0 N--CA 1.477 0.88 0 C-N-CA 123.595 0.758 . . . . 65.22 110.077 177.956 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 119' ' ' PRO . . . . . 0.411 ' HB3' ' HG2' ' A' ' 116' ' ' PRO . 45.5 Cg_endo -85.36 -11.36 7.27 Favored 'Trans proline' 0 C--N 1.378 2.102 0 C-N-CA 123.093 2.529 . . . . 61.04 112.742 177.815 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . 78.9 1.63 84.99 Favored Glycine 0 C--N 1.352 1.447 0 CA-C-N 116.141 -0.481 . . . . 71.21 113.829 -177.449 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . -70.04 100.06 1.55 Allowed 'General case' 0 CA--C 1.544 0.715 0 C-N-CA 123.308 0.643 . . . . 70.2 110.634 -177.696 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 122' ' ' SER . . . . . . . . . . . . . 29.8 p . . . . . 0 C--O 1.252 1.185 0 C-N-CA 123.44 0.696 . . . . 74.41 110.205 179.113 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 25.5 ptm . . . . . 0 N--CA 1.482 1.167 0 N-CA-C 110.621 -0.14 . . . . 72.33 110.621 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 40.3 p -57.06 -46.32 82.54 Favored 'General case' 0 N--CA 1.479 0.996 0 C-N-CA 123.802 0.841 . . . . 71.1 112.356 -175.784 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 23.5 m -70.79 -25.42 62.87 Favored 'General case' 0 N--CA 1.473 0.724 0 C-N-CA 123.265 0.626 . . . . 60.42 111.331 -179.518 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . 0.411 ' HA ' ' HG3' ' A' ' 53' ' ' PRO . 25.5 m -75.56 -40.63 56.48 Favored 'General case' 0 C--N 1.35 0.602 0 C-N-CA 123.426 0.691 . . . . 53.2 110.839 178.1 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 92.8 t -67.85 -34.9 70.15 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.849 0 C-N-CA 123.543 0.737 . . . . 72.11 109.538 175.285 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . 0.521 ' O ' ' HG3' ' A' ' 10' ' ' ARG . 10.5 tm-20 -71.91 -32.32 67.27 Favored 'General case' 0 N--CA 1.472 0.668 0 C-N-CA 124.179 0.992 . . . . 72.11 110.226 176.504 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 7' ' ' PHE . . . . . 0.413 ' O ' ' HB2' ' A' ' 10' ' ' ARG . 62.3 t80 -70.68 -43.48 69.0 Favored 'General case' 0 N--CA 1.48 1.03 0 C-N-CA 123.871 0.868 . . . . 64.5 110.72 177.47 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . 0.539 HD11 HG23 ' A' ' 60' ' ' ILE . 84.5 mt -62.34 -39.21 83.38 Favored 'Isoleucine or valine' 0 C--O 1.212 -0.898 0 N-CA-C 109.178 -0.675 . . . . 75.14 109.178 173.326 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 3.3 t-20 -61.09 -38.03 84.81 Favored 'General case' 0 N--CA 1.483 1.177 0 C-N-CA 124.043 0.937 . . . . 73.21 111.086 175.866 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . 0.531 ' HB3' HG22 ' A' ' 47' ' ' VAL . 73.4 mtt180 -56.77 -53.77 53.94 Favored 'General case' 0 N--CA 1.475 0.811 0 O-C-N 123.82 0.7 . . . . 72.32 109.925 174.625 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 11' ' ' TRP . . . . . 0.424 ' CD1' HG13 ' A' ' 64' ' ' VAL . 99.7 m95 -75.59 -23.27 56.45 Favored 'General case' 0 N--CA 1.471 0.58 0 CA-C-N 114.918 -1.037 . . . . 75.54 113.107 -176.062 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 51.4 mt-30 -62.88 -46.7 86.6 Favored 'General case' 0 N--CA 1.47 0.556 0 N-CA-C 108.134 -1.061 . . . . 75.53 108.134 169.841 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 10.9 tpt180 -63.99 -48.39 76.58 Favored 'General case' 0 CA--C 1.54 0.59 0 CA-C-N 114.695 -1.139 . . . . 73.25 111.226 -175.721 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 14' ' ' ILE . . . . . 0.55 HD13 HG13 ' A' ' 44' ' ' ILE . 48.2 mt -64.62 -48.91 82.83 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.316 0 O-C-N 123.194 0.309 . . . . 61.44 110.287 -179.978 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . 0.567 ' HA ' ' HB ' ' A' ' 71' ' ' THR . . . -54.41 -45.56 72.97 Favored 'General case' 0 C--N 1.36 1.046 0 O-C-N 123.983 0.802 . . . . 74.3 111.163 -178.969 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 84.4 mt -78.73 -36.52 43.11 Favored 'General case' 0 N--CA 1.476 0.858 0 CA-C-N 114.989 -1.005 . . . . 55.34 112.124 -174.311 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.451 ' O ' ' HG ' ' A' ' 21' ' ' LEU . 64.3 mt -67.54 -45.36 75.91 Favored 'General case' 0 N--CA 1.487 1.375 0 CA-C-N 118.057 0.39 . . . . 64.04 110.395 179.813 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 77.8 p -67.49 -37.25 82.58 Favored 'General case' 0 N--CA 1.477 0.901 0 C-N-CA 123.211 0.604 . . . . 71.13 110.79 176.794 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 19' ' ' GLN . . . . . 0.449 HE21 ' NE2' ' A' ' 70' ' ' GLN . 6.9 tp-100 -61.13 -42.29 98.27 Favored 'General case' 0 C--N 1.357 0.906 0 O-C-N 123.701 0.626 . . . . 70.32 110.612 175.407 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 69.2 m -60.31 -49.5 77.36 Favored 'General case' 0 C--N 1.347 0.461 0 O-C-N 124.069 0.856 . . . . 73.42 109.686 176.37 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . 0.719 HD22 ' HA ' ' A' ' 33' ' ' LEU . 26.2 mt -61.36 -33.36 73.5 Favored 'General case' 0 CA--C 1.547 0.85 0 O-C-N 124.014 0.821 . . . . 60.33 110.917 -178.919 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.741 ' HA ' HD21 ' A' ' 78' ' ' LEU . 56.0 tp -67.29 -54.01 24.62 Favored 'General case' 0 N--CA 1.482 1.139 0 C-N-CA 123.271 0.629 . . . . 73.41 110.692 179.74 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 42.5 mt-10 -56.53 -49.6 74.32 Favored 'General case' 0 N--CA 1.474 0.752 0 C-N-CA 124.335 1.054 . . . . 72.13 110.735 178.95 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.407 HD22 HD12 ' A' ' 32' ' ' LEU . 91.5 mt -67.24 -33.74 75.98 Favored 'General case' 0 C--O 1.217 -0.62 0 CA-C-N 114.987 -1.006 . . . . 75.31 111.21 -176.133 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . 0.542 ' HB2' HD21 ' A' ' 33' ' ' LEU . . . -67.65 -42.62 81.92 Favored 'General case' 0 N--CA 1.483 1.208 0 C-N-CA 122.867 0.467 . . . . 74.42 111.594 177.699 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 97.1 mt-30 -70.97 -23.86 62.3 Favored 'General case' 0 N--CA 1.475 0.812 0 CA-C-N 115.532 -0.758 . . . . 73.3 111.069 176.678 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 79.0 mtt180 -78.68 -21.13 48.67 Favored 'General case' 0 N--CA 1.479 0.999 0 C-N-CA 123.562 0.745 . . . . 73.13 110.588 170.71 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 91.77 9.55 62.52 Favored Glycine 0 C--N 1.348 1.216 0 C-N-CA 123.05 0.357 . . . . 72.34 113.332 179.485 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 18.6 mm-40 -82.81 61.27 5.78 Favored 'General case' 0 CA--C 1.547 0.828 0 C-N-CA 124.622 1.169 . . . . 72.32 110.687 177.775 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 30' ' ' TRP . . . . . 0.41 ' O ' ' HG ' ' A' ' 34' ' ' LEU . 59.6 m95 -63.91 -29.71 70.86 Favored 'General case' 0 N--CA 1.484 1.25 0 C-N-CA 123.863 0.865 . . . . 74.21 110.999 -176.788 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 -56.21 -47.31 78.65 Favored 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 124.265 1.026 . . . . 64.31 110.287 175.718 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.407 HD12 HD22 ' A' ' 24' ' ' LEU . 35.5 mt -64.59 -31.03 72.07 Favored 'General case' 0 N--CA 1.474 0.733 0 CA-C-N 115.16 -0.927 . . . . 72.0 110.927 -179.0 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . 0.719 ' HA ' HD22 ' A' ' 21' ' ' LEU . 10.5 mp -62.42 -49.01 77.19 Favored 'General case' 0 N--CA 1.477 0.884 0 N-CA-C 109.76 -0.459 . . . . 71.33 109.76 171.554 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.41 ' HG ' ' O ' ' A' ' 30' ' ' TRP . 80.5 mt -58.01 -41.47 83.19 Favored 'General case' 0 N--CA 1.484 1.257 0 O-C-N 123.856 0.722 . . . . 65.31 112.397 -177.195 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 1.4 mp0 -73.81 -56.55 4.84 Favored 'General case' 0 N--CA 1.488 1.438 0 C-N-CA 122.859 0.464 . . . . 73.31 111.778 178.572 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 84.7 mm-40 -66.04 -19.71 65.94 Favored 'General case' 0 N--CA 1.488 1.46 0 C-N-CA 122.965 0.506 . . . . 74.55 111.793 -175.205 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . 0.473 ' O ' ' HG ' ' A' ' 41' ' ' LEU . 22.7 tt0 -60.02 -36.98 78.43 Favored 'General case' 0 C--N 1.358 0.969 0 C-N-CA 123.291 0.636 . . . . 73.1 111.277 179.578 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 62.2 t -53.1 -48.95 52.62 Favored 'Isoleucine or valine' 0 CA--C 1.556 1.182 0 C-N-CA 123.341 0.656 . . . . 71.11 110.764 -179.24 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 70.9 m -72.65 -33.2 66.43 Favored 'General case' 0 CA--C 1.537 0.444 0 CA-C-N 115.129 -0.941 . . . . 64.54 111.617 177.618 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 33.2 t80 -62.12 -40.75 96.97 Favored 'General case' 0 N--CA 1.481 1.08 0 C-N-CA 122.786 0.434 . . . . 73.15 110.984 176.24 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . 0.473 ' HG ' ' O ' ' A' ' 37' ' ' GLU . 56.0 mt -69.74 -52.78 22.43 Favored 'General case' 0 C--O 1.245 0.857 0 C-N-CA 123.953 0.901 . . . . 63.15 109.859 -178.28 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 53.2 tt0 -55.81 -49.97 71.8 Favored 'General case' 0 C--N 1.358 0.954 0 CA-C-N 114.882 -1.054 . . . . 72.24 110.832 -179.112 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . 0.535 ' O ' HG23 ' A' ' 47' ' ' VAL . 66.1 m -60.94 -56.28 22.93 Favored 'General case' 0 C--N 1.348 0.541 0 O-C-N 123.991 0.807 . . . . 53.2 111.055 -178.78 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 44' ' ' ILE . . . . . 0.55 HG13 HD13 ' A' ' 14' ' ' ILE . 11.9 tt -58.97 -42.77 87.09 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.192 0 O-C-N 123.692 0.62 . . . . 74.34 111.558 -171.806 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . 0.484 ' HG2' HD22 ' A' ' 92' ' ' LEU . 54.9 mm-40 -63.65 -44.96 92.3 Favored 'General case' 0 C--N 1.359 0.99 0 C-N-CA 122.705 0.402 . . . . 75.11 111.039 177.263 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 99.2 m -55.93 -42.58 76.33 Favored 'General case' 0 N--CA 1.479 1.003 0 O-C-N 123.638 0.586 . . . . 75.53 111.248 177.55 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 47' ' ' VAL . . . . . 0.535 HG23 ' O ' ' A' ' 43' ' ' SER . 96.2 t -63.67 -46.45 94.69 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.701 0 C-N-CA 124.018 0.927 . . . . 73.43 111.074 -179.579 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 48' ' ' MET . . . . . 0.565 ' SD ' HD13 ' A' ' 102' ' ' LEU . 77.2 mtm -71.52 -25.89 62.43 Favored 'General case' 0 N--CA 1.478 0.939 0 CA-C-N 115.432 -0.804 . . . . 72.12 112.469 -176.55 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 54.9 mt-10 -94.3 -18.79 21.28 Favored 'General case' 0 N--CA 1.485 1.284 0 N-CA-C 112.544 0.572 . . . . 72.31 112.544 179.605 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 1.3 mptm? -91.38 146.33 23.9 Favored 'General case' 0 N--CA 1.483 1.213 0 C-N-CA 122.981 0.512 . . . . 75.14 109.861 179.387 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 4.9 pt20 -70.75 143.54 51.21 Favored 'General case' 0 CA--C 1.537 0.479 0 C-N-CA 123.503 0.721 . . . . 74.24 112.806 -167.888 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 95.2 m -80.16 118.26 71.58 Favored Pre-proline 0 CA--C 1.55 0.949 0 C-N-CA 124.413 1.085 . . . . 64.2 108.735 172.007 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 53' ' ' PRO . . . . . 0.411 ' HG3' ' HA ' ' A' ' 4' ' ' THR . 31.8 Cg_endo -61.99 153.37 69.18 Favored 'Trans proline' 0 C--N 1.374 1.884 0 C-N-CA 122.28 1.987 . . . . 74.32 112.14 -179.266 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 45.6 Cg_endo -68.27 -46.86 1.88 Allowed 'Trans proline' 0 C--N 1.371 1.757 0 C-N-CA 122.612 2.208 . . . . 52.22 112.216 179.236 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . -74.24 79.4 0.91 Allowed Glycine 0 C--N 1.349 1.28 0 O-C-N 123.591 0.557 . . . . 63.21 113.23 -176.571 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 56' ' ' ILE . . . . . 0.455 ' HB ' HD21 ' A' ' 113' ' ' LEU . 66.9 mt -128.49 107.84 16.56 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.79 0 C-N-CA 124.858 1.263 . . . . 74.24 107.704 175.554 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 57' ' ' THR . . . . . 0.408 ' H ' HD12 ' A' ' 60' ' ' ILE . 38.4 p -82.4 -178.44 7.05 Favored 'General case' 0 CA--C 1.542 0.662 0 C-N-CA 123.506 0.722 . . . . 64.42 110.989 -179.678 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 25.1 tpt180 -53.71 -55.61 24.6 Favored 'General case' 0 N--CA 1.475 0.802 0 C-N-CA 124.892 1.277 . . . . 72.44 111.884 -177.329 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 17.5 m -59.6 -40.31 87.06 Favored 'General case' 0 N--CA 1.478 0.954 0 O-C-N 123.782 0.676 . . . . 74.43 112.107 -177.542 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 60' ' ' ILE . . . . . 0.539 HG23 HD11 ' A' ' 8' ' ' ILE . 66.4 mt -66.42 -40.8 87.52 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.75 0 O-C-N 123.941 0.775 . . . . 74.44 110.61 178.625 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 61.1 tt0 -64.17 -38.62 91.73 Favored 'General case' 0 CA--C 1.543 0.711 0 C-N-CA 124.288 1.035 . . . . 75.12 110.524 -179.049 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 43.4 m-20 -72.8 -38.14 67.32 Favored 'General case' 0 N--CA 1.476 0.868 0 CA-C-N 115.661 -0.699 . . . . 71.44 111.731 177.815 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 63' ' ' MET . . . . . . . . . . . . . 74.1 mtm -65.23 -48.23 74.04 Favored 'General case' 0 N--CA 1.486 1.327 0 C-N-CA 122.291 0.236 . . . . 72.44 110.963 177.841 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 64' ' ' VAL . . . . . 0.51 ' O ' HG13 ' A' ' 68' ' ' ILE . 75.7 t -61.87 -55.93 21.06 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.589 0 C-N-CA 123.554 0.742 . . . . 65.01 110.729 179.188 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -63.59 -27.36 69.19 Favored 'General case' 0 N--CA 1.485 1.32 0 C-N-CA 122.416 0.286 . . . . 74.54 111.368 -179.396 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -67.23 -40.11 92.28 Favored Glycine 0 C--N 1.349 1.271 0 O-C-N 123.66 0.6 . . . . 51.42 112.063 174.677 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 18.6 m-30 -71.39 -35.44 71.04 Favored 'General case' 0 N--CA 1.472 0.656 0 C-N-CA 123.499 0.72 . . . . 73.23 111.624 176.866 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 68' ' ' ILE . . . . . 0.528 ' O ' ' HG ' ' A' ' 72' ' ' LEU . 20.3 mt -63.55 -48.92 84.72 Favored 'Isoleucine or valine' 0 C--N 1.358 0.947 0 N-CA-C 108.162 -1.051 . . . . 74.02 108.162 176.541 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 69' ' ' LYS . . . . . 0.554 ' HB2' ' HE2' ' A' ' 106' ' ' TYR . 46.6 tptt -53.74 -47.71 70.36 Favored 'General case' 0 N--CA 1.481 1.079 0 C-N-CA 124.239 1.016 . . . . 71.45 110.879 176.76 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 70' ' ' GLN . . . . . 0.449 ' NE2' HE21 ' A' ' 19' ' ' GLN . 62.4 tt0 -60.99 -46.04 92.37 Favored 'General case' 0 CA--C 1.535 0.39 0 O-C-N 124.094 0.871 . . . . 73.12 110.97 -177.638 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 71' ' ' THR . . . . . 0.567 ' HB ' ' HA ' ' A' ' 15' ' ' ALA . 13.1 t -79.16 -21.29 46.66 Favored 'General case' 0 C--N 1.352 0.683 0 CA-C-O 118.904 -0.57 . . . . 62.13 111.45 -176.017 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 72' ' ' LEU . . . . . 0.528 ' HG ' ' O ' ' A' ' 68' ' ' ILE . 25.2 mt -75.98 -31.72 59.13 Favored 'General case' 0 N--CA 1.486 1.354 0 N-CA-C 109.802 -0.444 . . . . 64.25 109.802 173.385 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 97.8 m-20 -70.33 -51.12 32.44 Favored 'General case' 0 N--CA 1.469 0.491 0 O-C-N 123.744 0.652 . . . . 73.42 109.842 174.723 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 67.4 m-20 -57.35 -42.96 83.0 Favored 'General case' 0 N--CA 1.479 0.997 0 O-C-N 123.96 0.788 . . . . 73.33 109.912 178.314 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 53.5 tp10 -58.54 -56.37 23.03 Favored 'General case' 0 N--CA 1.473 0.68 0 C-N-CA 124.494 1.117 . . . . 53.23 110.712 177.202 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 10.1 tt0 -65.67 -39.05 90.91 Favored 'General case' 0 N--CA 1.477 0.897 0 C-N-CA 122.724 0.41 . . . . 72.51 111.786 -174.441 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 92.9 mt -64.58 -47.74 77.55 Favored 'General case' 0 N--CA 1.478 0.934 0 C-N-CA 123.349 0.66 . . . . 75.22 110.524 179.881 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . 0.741 HD21 ' HA ' ' A' ' 22' ' ' LEU . 42.5 mt -61.01 -61.86 2.27 Favored 'General case' 0 N--CA 1.482 1.128 0 C-N-CA 123.968 0.907 . . . . 73.21 111.985 178.68 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 79' ' ' LYS . . . . . 0.554 ' HB3' ' H ' ' A' ' 87' ' ' ASP . 43.9 mmtm -67.17 -38.04 84.75 Favored 'General case' 0 CA--C 1.543 0.679 0 CA-C-N 113.872 -1.513 . . . . 74.4 110.356 -171.563 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -68.94 -29.69 72.44 Favored Glycine 0 C--N 1.343 0.939 0 CA-C-N 115.822 -0.626 . . . . 60.45 113.037 175.957 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 8.5 tt -63.14 -44.79 94.56 Favored 'General case' 0 N--CA 1.475 0.81 0 N-CA-C 109.044 -0.725 . . . . 63.3 109.044 171.016 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 82' ' ' LEU . . . . . 0.437 ' HG ' ' O ' ' A' ' 78' ' ' LEU . 67.4 mt -66.3 -66.39 0.56 Allowed 'General case' 0 N--CA 1.477 0.875 0 O-C-N 123.663 0.602 . . . . 72.1 110.497 -178.411 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 23.5 mt-30 -148.8 -62.93 0.24 Allowed 'General case' 0 N--CA 1.482 1.171 0 C-N-CA 124.335 1.054 . . . . 65.13 110.447 179.508 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 10.8 pt20 -135.58 151.78 50.61 Favored 'General case' 0 N--CA 1.492 1.667 0 C-N-CA 123.273 0.629 . . . . 72.21 111.27 -169.497 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 85' ' ' ARG . . . . . . . . . . . . . 7.3 ptp85 -48.86 -31.38 7.07 Favored 'General case' 0 N--CA 1.497 1.918 0 C-N-CA 125.288 1.435 . . . . 72.54 114.064 -172.212 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 85.4 mt -126.7 79.28 1.86 Allowed 'General case' 0 N--CA 1.472 0.632 0 N-CA-C 107.631 -1.248 . . . . 71.23 107.631 174.807 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 87' ' ' ASP . . . . . 0.554 ' H ' ' HB3' ' A' ' 79' ' ' LYS . 23.2 t70 -94.85 152.01 18.75 Favored 'General case' 0 N--CA 1.475 0.809 0 C-N-CA 124.581 1.152 . . . . 74.22 110.46 -174.769 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 8.0 mp0 -94.84 95.62 8.8 Favored 'General case' 0 C--O 1.242 0.665 0 CA-C-N 115.523 -0.762 . . . . 64.25 109.857 -175.454 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 75.2 mt -64.49 -66.24 0.57 Allowed 'General case' 0 N--CA 1.48 1.029 0 N-CA-C 107.437 -1.32 . . . . 71.11 107.437 165.604 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 40.2 m -126.34 0.23 7.01 Favored 'General case' 0 N--CA 1.481 1.082 0 C-N-CA 124.372 1.069 . . . . 70.43 110.145 167.218 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 11.9 t 68.16 -179.63 0.22 Allowed 'General case' 0 N--CA 1.483 1.186 0 C-N-CA 125.2 1.4 . . . . 75.02 112.13 178.77 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 92' ' ' LEU . . . . . 0.484 HD22 ' HG2' ' A' ' 45' ' ' GLU . 40.5 mt -123.85 -72.45 0.68 Allowed 'General case' 0 N--CA 1.478 0.944 0 C-N-CA 123.83 0.852 . . . . 71.33 109.598 176.158 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 93' ' ' ILE . . . . . 0.47 ' HB ' ' HA ' ' A' ' 97' ' ' THR . 35.2 mt -120.44 146.39 25.38 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.06 0 C-N-CA 124.093 0.957 . . . . 70.11 109.072 -177.755 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -64.46 126.7 33.46 Favored Glycine 0 C--N 1.344 0.988 0 O-C-N 123.316 0.385 . . . . 23.33 112.585 177.09 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 17.4 mt-30 66.18 -85.76 0.03 OUTLIER 'General case' 0 N--CA 1.477 0.905 0 C-N-CA 125.038 1.335 . . . . 71.44 111.584 179.247 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 22.7 m -92.39 102.94 15.42 Favored 'General case' 0 N--CA 1.467 0.384 0 C-N-CA 123.547 0.739 . . . . 61.02 109.624 -177.908 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 97' ' ' THR . . . . . 0.624 HG22 ' H ' ' A' ' 99' ' ' GLN . 97.1 m -93.16 155.64 17.34 Favored 'General case' 0 CA--C 1.55 0.949 0 C-N-CA 123.869 0.868 . . . . 75.13 109.916 173.036 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 30.7 mmt180 -58.16 -13.26 4.56 Favored 'General case' 0 CA--C 1.556 1.181 0 C-N-CA 125.291 1.436 . . . . 72.21 113.016 175.554 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 99' ' ' GLN . . . . . 0.624 ' H ' HG22 ' A' ' 97' ' ' THR . 12.5 pt20 -57.89 -29.8 65.34 Favored 'General case' 0 N--CA 1.491 1.601 0 C-N-CA 124.34 1.056 . . . . 71.15 112.069 176.444 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 27.5 ttpp -68.3 -46.47 70.21 Favored 'General case' 0 N--CA 1.478 0.944 0 N-CA-C 109.061 -0.718 . . . . 71.53 109.061 173.65 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 101' ' ' SER . . . . . 0.406 ' HA ' ' HB3' ' A' ' 104' ' ' ASN . 48.7 m -72.1 -12.68 61.31 Favored 'General case' 0 N--CA 1.479 1.011 0 C-N-CA 124.307 1.043 . . . . 70.3 111.941 174.897 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 102' ' ' LEU . . . . . 0.565 HD13 ' SD ' ' A' ' 48' ' ' MET . 24.7 tp -76.49 -48.26 20.11 Favored 'General case' 0 N--CA 1.483 1.188 0 C-N-CA 124.751 1.22 . . . . 52.34 109.19 177.098 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 9.2 t30 -65.53 -37.87 87.99 Favored 'General case' 0 CA--C 1.553 1.087 0 CA-C-N 114.672 -1.149 . . . . 72.25 110.536 173.433 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 104' ' ' ASN . . . . . 0.406 ' HB3' ' HA ' ' A' ' 101' ' ' SER . 24.5 t-20 -70.03 -32.54 70.74 Favored 'General case' 0 N--CA 1.478 0.947 0 CA-C-N 115.611 -0.722 . . . . 63.41 110.936 175.952 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -63.69 -40.23 96.29 Favored 'General case' 0 N--CA 1.48 1.072 0 C-N-CA 123.572 0.749 . . . . 71.42 110.165 175.853 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 106' ' ' TYR . . . . . 0.554 ' HE2' ' HB2' ' A' ' 69' ' ' LYS . 2.9 t80 -57.34 -51.97 67.24 Favored 'General case' 0 C--N 1.353 0.758 0 O-C-N 124.274 0.983 . . . . 64.34 109.443 172.016 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -53.19 -55.01 26.4 Favored Glycine 0 C--N 1.353 1.49 0 O-C-N 124.133 0.896 . . . . 42.51 114.204 -177.179 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 108' ' ' ARG . . . . . 0.638 ' HG3' ' HA ' ' A' ' 114' ' ' LEU . 17.2 ptp180 -66.6 -31.43 72.12 Favored 'General case' 0 CA--C 1.548 0.897 0 C-N-CA 123.295 0.638 . . . . 74.4 111.905 178.983 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 109' ' ' LEU . . . . . 0.543 ' HA ' ' H ' ' A' ' 114' ' ' LEU . 56.4 tp -68.05 -45.81 72.87 Favored 'General case' 0 N--CA 1.484 1.247 0 C-N-CA 122.645 0.378 . . . . 74.33 111.096 176.505 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 11.6 t -72.23 -29.54 64.04 Favored 'General case' 0 CA--C 1.54 0.595 0 CA-C-N 115.344 -0.843 . . . . 42.13 109.84 -174.659 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . -88.03 -62.96 1.4 Allowed Glycine 0 C--N 1.36 1.905 0 CA-C-O 119.364 -0.687 . . . . 72.42 113.844 -179.928 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 112' ' ' MET . . . . . 0.591 ' HG3' ' HB3' ' A' ' 117' ' ' ASP . 1.0 OUTLIER -98.99 -69.92 0.75 Allowed 'General case' 0 N--CA 1.485 1.31 0 CA-C-N 118.622 1.211 . . . . 71.52 112.065 177.576 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 113' ' ' LEU . . . . . 0.455 HD21 ' HB ' ' A' ' 56' ' ' ILE . 0.9 OUTLIER 163.29 51.2 0.0 OUTLIER 'General case' 0 N--CA 1.497 1.899 0 C-N-CA 125.746 1.618 . . . . 42.24 108.228 -174.322 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 114' ' ' LEU . . . . . 0.638 ' HA ' ' HG3' ' A' ' 108' ' ' ARG . 0.3 OUTLIER 69.31 11.52 8.15 Favored 'General case' 0 N--CA 1.487 1.414 0 C-N-CA 125.574 1.55 . . . . 73.13 112.934 171.221 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 115' ' ' VAL . . . . . . . . . . . . . 25.0 m -127.19 140.67 38.5 Favored Pre-proline 0 CA--C 1.552 1.022 0 C-N-CA 123.499 0.72 . . . . 74.34 109.102 171.499 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 24.3 Cg_exo -63.79 99.83 0.28 Allowed 'Trans proline' 0 C--N 1.378 2.1 0 C-N-CA 122.766 2.31 . . . . 75.23 111.219 174.347 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 117' ' ' ASP . . . . . 0.591 ' HB3' ' HG3' ' A' ' 112' ' ' MET . 32.4 t70 -167.09 21.82 0.03 OUTLIER 'General case' 0 N--CA 1.483 1.192 0 C-N-CA 124.007 0.923 . . . . 74.52 109.487 -175.662 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -63.26 137.45 97.07 Favored Pre-proline 0 N--CA 1.482 1.146 0 C-N-CA 123.465 0.706 . . . . 55.42 112.314 -172.735 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 119' ' ' PRO . . . . . . . . . . . . . 23.1 Cg_exo -64.91 147.71 89.43 Favored 'Trans proline' 0 C--N 1.38 2.194 0 C-N-CA 123.187 2.591 . . . . 72.4 112.68 -179.691 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . -73.61 -13.61 80.16 Favored Glycine 0 CA--C 1.529 0.932 0 CA-C-N 115.889 -0.596 . . . . 62.22 113.016 175.18 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . -135.13 112.02 10.18 Favored 'General case' 0 CA--C 1.536 0.44 0 C-N-CA 124.594 1.158 . . . . 62.55 108.731 175.606 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 122' ' ' SER . . . . . . . . . . . . . 22.8 m . . . . . 0 C--O 1.25 1.106 0 N-CA-C 107.876 -1.157 . . . . 71.2 107.876 176.447 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 23.5 ttt . . . . . 0 N--CA 1.488 1.439 0 CA-C-O 119.475 -0.298 . . . . 73.25 111.326 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 27.2 p -47.13 -39.02 12.61 Favored 'General case' 0 N--CA 1.497 1.885 0 N-CA-C 113.634 0.975 . . . . 72.24 113.634 -174.25 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 16.6 m -65.19 -45.35 85.16 Favored 'General case' 0 N--CA 1.478 0.932 0 C-N-CA 123.249 0.62 . . . . 73.11 111.464 178.384 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . 0.53 ' HA ' ' HG3' ' A' ' 53' ' ' PRO . 5.2 m -70.96 -37.21 72.78 Favored 'General case' 0 N--CA 1.476 0.863 0 C-N-CA 123.351 0.66 . . . . 65.32 111.822 179.947 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 69.9 t -62.1 -47.58 92.48 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.84 0 C-N-CA 123.258 0.623 . . . . 74.31 109.758 178.529 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 44.9 mm-40 -57.27 -51.72 68.21 Favored 'General case' 0 N--CA 1.473 0.718 0 CA-C-N 115.778 -0.646 . . . . 53.51 110.927 172.205 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 40.7 t80 -57.32 -50.3 73.36 Favored 'General case' 0 CA--C 1.552 1.024 0 C-N-CA 124.197 0.999 . . . . 72.52 111.849 -173.853 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . 0.432 HD11 HG23 ' A' ' 60' ' ' ILE . 83.6 mt -62.38 -46.25 96.87 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.065 0 C-N-CA 123.977 0.911 . . . . 71.35 110.237 177.337 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 25.1 t-20 -67.09 -27.69 67.57 Favored 'General case' 0 N--CA 1.486 1.351 0 C-N-CA 123.781 0.833 . . . . 73.12 112.032 -176.441 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . 0.465 ' O ' HG13 ' A' ' 14' ' ' ILE . 96.5 mtt180 -76.23 -38.41 56.39 Favored 'General case' 0 N--CA 1.469 0.484 0 N-CA-C 109.041 -0.726 . . . . 64.32 109.041 175.325 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 11' ' ' TRP . . . . . 0.514 ' HH2' ' HG ' ' A' ' 102' ' ' LEU . 57.0 m95 -67.42 -29.65 69.19 Favored 'General case' 0 N--CA 1.484 1.274 0 C-N-CA 123.055 0.542 . . . . 75.12 111.696 172.152 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . 0.413 ' HG3' ' O ' ' A' ' 8' ' ' ILE . 52.7 mt-30 -64.08 -49.45 72.2 Favored 'General case' 0 N--CA 1.472 0.65 0 N-CA-C 107.671 -1.233 . . . . 44.25 107.671 171.773 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 53.5 ttt180 -60.85 -43.25 98.59 Favored 'General case' 0 CA--C 1.548 0.898 0 CA-C-N 114.996 -1.002 . . . . 74.01 111.382 -176.303 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 14' ' ' ILE . . . . . 0.465 HG13 ' O ' ' A' ' 10' ' ' ARG . 64.2 mt -66.52 -47.41 83.74 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.388 0 C-N-CA 122.731 0.412 . . . . 62.13 109.899 178.782 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . 0.572 ' HA ' ' HB ' ' A' ' 71' ' ' THR . . . -58.63 -43.71 89.8 Favored 'General case' 0 N--CA 1.486 1.343 0 C-N-CA 123.888 0.875 . . . . 60.54 111.824 -179.53 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 96.4 mt -81.83 -34.55 30.13 Favored 'General case' 0 N--CA 1.483 1.176 0 CA-C-N 114.613 -1.176 . . . . 55.42 111.112 -173.591 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.475 ' O ' ' HG ' ' A' ' 21' ' ' LEU . 25.3 mt -65.18 -51.76 59.06 Favored 'General case' 0 N--CA 1.486 1.352 0 N-CA-C 109.589 -0.523 . . . . 75.23 109.589 176.0 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 80.9 p -63.6 -37.32 86.9 Favored 'General case' 0 N--CA 1.48 1.028 0 C-N-CA 123.389 0.675 . . . . 70.33 111.557 -179.484 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 6.4 tp-100 -58.58 -50.14 74.91 Favored 'General case' 0 N--CA 1.476 0.866 0 O-C-N 123.613 0.57 . . . . 75.42 110.582 173.685 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 70.9 m -58.0 -49.91 75.21 Favored 'General case' 0 C--O 1.207 -1.161 0 CA-C-N 115.167 -0.924 . . . . 63.33 110.18 176.923 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . 0.595 HD22 ' HA ' ' A' ' 33' ' ' LEU . 92.4 mt -63.21 -29.88 71.14 Favored 'General case' 0 N--CA 1.474 0.772 0 C-N-CA 123.783 0.833 . . . . 73.05 111.393 -175.627 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.575 ' HA ' HD21 ' A' ' 78' ' ' LEU . 58.9 tp -68.56 -53.95 19.69 Favored 'General case' 0 C--O 1.252 1.19 0 C-N-CA 123.063 0.545 . . . . 62.03 110.221 176.903 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . 0.585 ' HB3' ' HE ' ' A' ' 27' ' ' ARG . 46.1 mt-10 -55.37 -51.2 67.58 Favored 'General case' 0 N--CA 1.475 0.798 0 CA-C-N 114.775 -1.102 . . . . 75.33 110.024 177.749 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.425 HD22 HD12 ' A' ' 32' ' ' LEU . 95.4 mt -60.6 -39.73 89.21 Favored 'General case' 0 N--CA 1.476 0.873 0 C-N-CA 125.382 1.473 . . . . 72.1 111.589 -176.683 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . 0.58 ' HB2' HD21 ' A' ' 33' ' ' LEU . . . -59.76 -48.87 79.95 Favored 'General case' 0 N--CA 1.481 1.106 0 C-N-CA 123.097 0.559 . . . . 43.54 110.823 176.168 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 95.6 mt-30 -66.63 -30.38 70.64 Favored 'General case' 0 CA--C 1.552 1.049 0 CA-C-N 114.901 -1.045 . . . . 65.4 111.633 178.919 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . 0.585 ' HE ' ' HB3' ' A' ' 23' ' ' GLU . 44.5 mtt-85 -76.28 -25.45 54.92 Favored 'General case' 0 N--CA 1.488 1.448 0 C-N-CA 123.473 0.709 . . . . 74.22 110.846 176.856 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 98.18 9.54 53.49 Favored Glycine 0 C--N 1.348 1.221 0 CA-C-N 116.364 -0.38 . . . . 54.42 113.244 -177.825 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . 0.415 ' HB2' ' HB3' ' A' ' 24' ' ' LEU . 12.8 mm-40 -80.13 57.41 2.69 Favored 'General case' 0 CA--C 1.55 0.976 0 C-N-CA 124.508 1.123 . . . . 72.42 110.482 174.985 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 30' ' ' TRP . . . . . 0.447 ' O ' ' HG ' ' A' ' 34' ' ' LEU . 89.2 m95 -62.0 -35.29 78.08 Favored 'General case' 0 N--CA 1.482 1.169 0 C-N-CA 124.218 1.007 . . . . 73.25 111.51 -175.892 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 6.2 m-20 -54.23 -40.01 67.28 Favored 'General case' 0 N--CA 1.476 0.871 0 C-N-CA 124.766 1.226 . . . . 71.43 111.51 179.619 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.425 HD12 HD22 ' A' ' 24' ' ' LEU . 87.9 mt -69.1 -31.23 69.8 Favored 'General case' 0 CA--C 1.543 0.685 0 CA-C-N 115.096 -0.956 . . . . 51.34 110.981 179.112 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . 0.595 ' HA ' HD22 ' A' ' 21' ' ' LEU . 8.5 mp -70.48 -40.3 73.72 Favored 'General case' 0 N--CA 1.491 1.604 0 C-N-CA 122.252 0.221 . . . . 64.53 110.57 173.051 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.447 ' HG ' ' O ' ' A' ' 30' ' ' TRP . 82.6 mt -65.1 -40.65 94.87 Favored 'General case' 0 N--CA 1.479 0.986 0 C-N-CA 123.648 0.779 . . . . 52.4 111.364 -176.916 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 1.6 mp0 -80.32 -55.76 4.67 Favored 'General case' 0 N--CA 1.473 0.72 0 C-N-CA 123.429 0.692 . . . . 70.31 111.197 178.541 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 36' ' ' GLN . . . . . 0.435 ' HB2' HD21 ' A' ' 21' ' ' LEU . 84.1 mm-40 -64.44 -13.08 49.55 Favored 'General case' 0 N--CA 1.494 1.768 0 N-CA-C 113.088 0.773 . . . . 71.54 113.088 -178.935 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . 0.471 ' O ' ' HG ' ' A' ' 41' ' ' LEU . 43.4 tt0 -47.55 -49.43 26.42 Favored 'General case' 0 N--CA 1.478 0.952 0 C-N-CA 122.914 0.486 . . . . 73.02 110.454 169.296 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 40.9 t -57.1 -53.75 39.18 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.088 0 O-C-N 124.061 0.851 . . . . 74.44 111.897 -176.906 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 46.4 p -69.09 -34.17 74.67 Favored 'General case' 0 N--CA 1.483 1.179 0 C-N-CA 122.801 0.44 . . . . 71.34 111.926 -177.399 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 40.9 t80 -64.9 -42.88 94.4 Favored 'General case' 0 N--CA 1.475 0.815 0 C-N-CA 123.513 0.725 . . . . 73.34 110.064 176.836 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . 0.471 ' HG ' ' O ' ' A' ' 37' ' ' GLU . 96.6 mt -60.81 -44.35 96.97 Favored 'General case' 0 C--N 1.35 0.627 0 O-C-N 124.192 0.932 . . . . 64.51 109.856 175.117 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 47.6 tt0 -63.86 -42.6 97.5 Favored 'General case' 0 N--CA 1.473 0.724 0 O-C-N 123.269 0.356 . . . . 74.02 110.761 -179.246 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 30.9 m -59.82 -53.76 54.2 Favored 'General case' 0 N--CA 1.482 1.156 0 C-N-CA 123.157 0.583 . . . . 61.45 111.355 -179.047 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 11.5 tt -66.1 -33.99 67.27 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.054 0 CA-C-N 115.072 -0.967 . . . . 63.44 111.054 -176.706 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 10.1 mm-40 -64.15 -44.93 90.64 Favored 'General case' 0 N--CA 1.484 1.251 0 C-N-CA 123.119 0.568 . . . . 73.13 111.307 172.774 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 46' ' ' THR . . . . . 0.422 ' O ' ' HB2' ' A' ' 50' ' ' LYS . 67.7 m -62.8 -34.06 76.49 Favored 'General case' 0 N--CA 1.478 0.932 0 C-N-CA 122.65 0.38 . . . . 75.42 110.969 -177.882 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 47' ' ' VAL . . . . . . . . . . . . . 58.3 t -71.46 -51.82 30.68 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.021 0 N-CA-C 111.615 0.228 . . . . 64.24 111.615 175.518 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 48' ' ' MET . . . . . . . . . . . . . 75.6 mtm -67.85 -32.84 73.64 Favored 'General case' 0 N--CA 1.488 1.473 0 N-CA-C 112.899 0.703 . . . . 72.42 112.899 -172.777 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 49.6 mt-10 -84.02 -34.42 24.29 Favored 'General case' 0 N--CA 1.483 1.198 0 C-N-CA 123.371 0.668 . . . . 64.51 111.626 -178.632 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . 0.422 ' HB2' ' O ' ' A' ' 46' ' ' THR . 13.8 mptt -79.86 164.08 23.86 Favored 'General case' 0 N--CA 1.483 1.186 0 CA-C-O 121.181 0.515 . . . . 75.25 110.699 -179.677 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 8.9 tt0 -82.83 138.39 33.97 Favored 'General case' 0 C--O 1.241 0.61 0 CA-C-N 115.046 -0.979 . . . . 42.32 110.65 -172.361 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 52' ' ' THR . . . . . 0.693 HG21 ' HB3' ' A' ' 114' ' ' LEU . 39.1 m -72.29 123.59 89.69 Favored Pre-proline 0 CA--C 1.556 1.187 0 N-CA-C 109.178 -0.675 . . . . 61.12 109.178 171.914 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 53' ' ' PRO . . . . . 0.53 ' HG3' ' HA ' ' A' ' 4' ' ' THR . 61.7 Cg_endo -69.3 155.46 67.39 Favored 'Trans proline' 0 C--N 1.376 2.01 0 C-N-CA 123.162 2.575 . . . . 74.53 112.675 -176.664 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 43.9 Cg_endo -67.98 -47.29 1.86 Allowed 'Trans proline' 0 C--N 1.377 2.063 0 C-N-CA 122.367 2.045 . . . . 72.4 112.258 175.004 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . -69.97 80.1 0.36 Allowed Glycine 0 C--N 1.352 1.46 0 O-C-N 123.566 0.541 . . . . 60.41 113.656 -175.796 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 77.7 mt -125.86 98.4 4.96 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.526 0 N-CA-C 107.91 -1.144 . . . . 65.04 107.91 175.085 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 57' ' ' THR . . . . . 0.401 ' H ' HD12 ' A' ' 60' ' ' ILE . 78.5 p -74.45 -179.65 4.12 Favored 'General case' 0 N--CA 1.473 0.712 0 C-N-CA 122.867 0.467 . . . . 72.4 109.917 175.373 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 21.1 tpt180 -64.99 -40.03 94.35 Favored 'General case' 0 N--CA 1.476 0.828 0 N-CA-C 110.371 -0.233 . . . . 64.14 110.371 177.79 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 51.9 m -60.25 -45.24 93.94 Favored 'General case' 0 N--CA 1.478 0.953 0 C-N-CA 123.309 0.644 . . . . 62.1 111.4 177.005 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 60' ' ' ILE . . . . . 0.432 HG23 HD11 ' A' ' 8' ' ' ILE . 80.1 mt -64.8 -39.13 84.61 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.971 0 CA-C-N 115.479 -0.782 . . . . 61.44 110.377 177.272 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 63.2 tt0 -63.18 -41.95 99.28 Favored 'General case' 0 N--CA 1.482 1.143 0 C-N-CA 124.012 0.925 . . . . 73.11 111.131 179.525 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 52.3 m-20 -69.4 -41.54 76.28 Favored 'General case' 0 N--CA 1.477 0.91 0 C-N-CA 123.163 0.585 . . . . 73.42 111.503 179.78 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 63' ' ' MET . . . . . . . . . . . . . 64.9 mtm -65.88 -52.3 51.41 Favored 'General case' 0 N--CA 1.485 1.295 0 C-N-CA 122.351 0.26 . . . . 73.54 111.311 178.477 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 64' ' ' VAL . . . . . 0.533 ' O ' HG13 ' A' ' 68' ' ' ILE . 71.4 t -60.99 -55.84 21.99 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.998 0 C-N-CA 123.456 0.702 . . . . 70.53 110.563 -178.957 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . 0.555 ' HB2' HD23 ' A' ' 109' ' ' LEU . . . -61.33 -37.8 84.61 Favored 'General case' 0 N--CA 1.488 1.455 0 O-C-N 123.478 0.486 . . . . 54.5 111.406 179.715 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -60.98 -37.17 93.41 Favored Glycine 0 C--N 1.346 1.109 0 CA-C-N 116.413 -0.358 . . . . 74.13 112.383 176.521 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 19.3 m-30 -75.86 -34.23 60.04 Favored 'General case' 0 N--CA 1.476 0.846 0 C-N-CA 123.137 0.575 . . . . 72.43 111.622 177.018 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 68' ' ' ILE . . . . . 0.533 HG13 ' O ' ' A' ' 64' ' ' VAL . 61.5 mt -59.69 -53.57 46.48 Favored 'Isoleucine or valine' 0 C--N 1.357 0.923 0 N-CA-C 108.808 -0.812 . . . . 63.51 108.808 175.812 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 69' ' ' LYS . . . . . 0.535 ' HB2' ' HE2' ' A' ' 106' ' ' TYR . 0.6 OUTLIER -59.77 -46.28 89.67 Favored 'General case' 0 C--N 1.348 0.507 0 CA-C-N 115.359 -0.837 . . . . 74.23 110.274 179.919 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 63.3 tt0 -57.08 -45.86 82.98 Favored 'General case' 0 C--N 1.352 0.675 0 O-C-N 124.564 1.165 . . . . 65.12 111.398 -178.589 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 71' ' ' THR . . . . . 0.572 ' HB ' ' HA ' ' A' ' 15' ' ' ALA . 15.1 t -79.66 -21.94 44.13 Favored 'General case' 0 C--O 1.216 -0.684 0 CA-C-O 119.188 -0.434 . . . . 71.44 110.559 -174.657 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 72' ' ' LEU . . . . . 0.524 ' HG ' ' O ' ' A' ' 68' ' ' ILE . 44.0 mt -74.62 -31.84 62.12 Favored 'General case' 0 N--CA 1.483 1.207 0 O-C-N 123.321 0.388 . . . . 72.21 110.521 172.122 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 73' ' ' ASP . . . . . 0.429 ' O ' ' HG ' ' A' ' 77' ' ' LEU . 48.5 m-20 -64.1 -60.17 3.55 Favored 'General case' 0 C--N 1.351 0.654 0 N-CA-C 108.627 -0.879 . . . . 74.35 108.627 172.702 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 48.4 m-20 -55.48 -41.35 72.86 Favored 'General case' 0 N--CA 1.483 1.21 0 C-N-CA 124.354 1.062 . . . . 74.5 111.335 -178.309 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . 0.543 ' O ' ' HG2' ' A' ' 79' ' ' LYS . 5.3 tp10 -58.88 -59.03 6.1 Favored 'General case' 0 N--CA 1.476 0.851 0 C-N-CA 124.348 1.059 . . . . 71.3 109.879 178.447 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 9.4 tt0 -72.45 -26.1 61.7 Favored 'General case' 0 CA--C 1.548 0.891 0 O-C-N 124.128 0.892 . . . . 75.21 111.851 -171.999 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . 0.429 ' HG ' ' O ' ' A' ' 73' ' ' ASP . 97.4 mt -67.61 -43.25 80.9 Favored 'General case' 0 N--CA 1.481 1.08 0 N-CA-C 109.246 -0.65 . . . . 72.03 109.246 174.165 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . 0.575 HD21 ' HA ' ' A' ' 22' ' ' LEU . 28.9 mt -57.3 -46.05 83.54 Favored 'General case' 0 N--CA 1.48 1.032 0 O-C-N 123.726 0.641 . . . . 74.21 111.196 169.55 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 79' ' ' LYS . . . . . 0.544 ' HB3' ' HA ' ' A' ' 85' ' ' ARG . 36.2 mmtm -64.67 -38.13 89.93 Favored 'General case' 0 N--CA 1.478 0.955 0 C-N-CA 123.408 0.683 . . . . 61.31 112.316 -175.764 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -71.25 -30.6 67.05 Favored Glycine 0 C--N 1.342 0.906 0 CA-C-N 115.936 -0.574 . . . . 63.31 112.002 174.534 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 4.8 tt -68.8 -43.83 74.8 Favored 'General case' 0 CA--C 1.557 1.225 0 C-N-CA 123.488 0.715 . . . . 70.41 109.728 173.302 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 82' ' ' LEU . . . . . 0.495 HD13 ' HG2' ' A' ' 88' ' ' GLU . 57.7 mt -71.93 -65.98 0.7 Allowed 'General case' 0 N--CA 1.478 0.947 0 C-N-CA 123.413 0.685 . . . . 74.24 110.201 -170.652 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 22.6 tp60 -179.9 -53.68 0.01 OUTLIER 'General case' 0 N--CA 1.483 1.193 0 C-N-CA 123.386 0.675 . . . . 75.14 110.322 177.578 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 48.5 mt-30 -119.95 158.08 27.47 Favored 'General case' 0 N--CA 1.484 1.239 0 C-N-CA 123.765 0.826 . . . . 71.01 109.931 -174.314 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 85' ' ' ARG . . . . . 0.544 ' HA ' ' HB3' ' A' ' 79' ' ' LYS . 76.6 mtp180 -64.77 -16.77 63.47 Favored 'General case' 0 N--CA 1.485 1.306 0 O-C-N 123.843 0.714 . . . . 65.24 112.141 177.176 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 62.4 mt -140.72 -161.76 1.26 Allowed 'General case' 0 C--O 1.243 0.746 0 C-N-CA 125.356 1.462 . . . . 54.2 108.577 179.229 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 11.4 t70 61.86 62.61 1.23 Allowed 'General case' 0 N--CA 1.483 1.208 0 C-N-CA 124.013 0.925 . . . . 75.55 111.441 167.635 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 88' ' ' GLU . . . . . 0.495 ' HG2' HD13 ' A' ' 82' ' ' LEU . 12.5 tp10 -174.44 -75.35 0.01 OUTLIER 'General case' 0 N--CA 1.474 0.747 0 C-N-CA 123.799 0.839 . . . . 63.44 108.901 177.427 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . 0.445 HD12 ' NZ ' ' A' ' 79' ' ' LYS . 89.3 mt -90.6 24.14 2.77 Favored 'General case' 0 N--CA 1.476 0.875 0 C-N-CA 123.272 0.629 . . . . 74.12 110.438 -177.863 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 10.9 p -116.82 87.32 2.67 Favored 'General case' 0 CA--C 1.55 0.965 0 C-N-CA 123.579 0.752 . . . . 52.4 112.317 -169.715 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 91' ' ' SER . . . . . 0.452 ' HB2' HD13 ' A' ' 41' ' ' LEU . 49.3 m -127.44 91.03 3.23 Favored 'General case' 0 N--CA 1.476 0.862 0 N-CA-C 107.373 -1.343 . . . . 62.25 107.373 164.632 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 64.4 mt -129.56 -155.38 0.69 Allowed 'General case' 0 N--CA 1.481 1.121 0 C-N-CA 124.103 0.961 . . . . 73.25 110.93 -170.066 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 76.4 mt -41.31 -41.05 0.68 Allowed 'Isoleucine or valine' 0 N--CA 1.488 1.467 0 C-N-CA 125.224 1.41 . . . . 72.23 111.018 167.967 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -163.31 -151.67 6.53 Favored Glycine 0 C--O 1.242 0.641 0 N-CA-C 110.497 -1.041 . . . . 64.5 110.497 169.049 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 3.9 pt20 -73.92 167.32 21.71 Favored 'General case' 0 CA--C 1.547 0.828 0 N-CA-C 109.128 -0.693 . . . . 73.15 109.128 168.825 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 78.1 p 49.98 -88.21 0.01 OUTLIER 'General case' 0 CA--C 1.555 1.142 0 C-N-CA 125.051 1.34 . . . . 73.03 111.842 -170.469 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 28.2 m 55.64 -78.38 0.01 OUTLIER 'General case' 0 CA--C 1.559 1.303 0 C-N-CA 125.379 1.472 . . . . 73.45 113.27 176.652 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 4.9 ptm180 -45.98 -48.63 16.48 Favored 'General case' 0 N--CA 1.485 1.293 0 C-N-CA 125.699 1.599 . . . . 71.32 114.665 -169.274 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 60.2 tp60 -67.99 -52.02 40.58 Favored 'General case' 0 N--CA 1.471 0.602 0 N-CA-C 109.842 -0.429 . . . . 64.52 109.842 -176.976 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 87.3 tttt -60.68 -45.41 94.28 Favored 'General case' 0 N--CA 1.475 0.791 0 CA-C-N 115.797 -0.638 . . . . 74.34 111.3 -179.231 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 23.0 t -73.63 -46.83 44.5 Favored 'General case' 0 N--CA 1.468 0.432 0 C-N-CA 124.058 0.943 . . . . 73.04 110.983 -168.835 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 102' ' ' LEU . . . . . 0.514 ' HG ' ' HH2' ' A' ' 11' ' ' TRP . 9.4 mp -78.29 -35.51 47.86 Favored 'General case' 0 N--CA 1.473 0.718 0 O-C-N 123.347 0.404 . . . . 63.35 111.427 -176.538 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 60.6 t30 -70.85 -35.73 72.54 Favored 'General case' 0 N--CA 1.488 1.466 0 N-CA-C 109.732 -0.47 . . . . 72.14 109.732 177.874 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 104' ' ' ASN . . . . . 0.441 ' O ' ' HG2' ' A' ' 108' ' ' ARG . 24.4 t-20 -67.0 -43.68 82.29 Favored 'General case' 0 N--CA 1.479 0.998 0 N-CA-C 109.423 -0.584 . . . . 74.43 109.423 172.57 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -60.49 -34.88 74.69 Favored 'General case' 0 N--CA 1.484 1.236 0 C-N-CA 123.407 0.683 . . . . 73.3 111.698 178.703 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 106' ' ' TYR . . . . . 0.535 ' HE2' ' HB2' ' A' ' 69' ' ' LYS . 13.6 t80 -65.56 -52.89 48.97 Favored 'General case' 0 CA--C 1.539 0.536 0 N-CA-C 109.03 -0.729 . . . . 73.41 109.03 175.699 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -62.3 -35.69 91.99 Favored Glycine 0 C--N 1.353 1.508 0 O-C-N 124.095 0.872 . . . . 73.03 112.673 -177.78 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 108' ' ' ARG . . . . . 0.441 ' HG2' ' O ' ' A' ' 104' ' ' ASN . 21.4 mmt180 -75.21 -34.59 61.5 Favored 'General case' 0 N--CA 1.468 0.446 0 C-N-CA 122.879 0.471 . . . . 72.44 110.544 179.16 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 109' ' ' LEU . . . . . 0.555 HD23 ' HB2' ' A' ' 65' ' ' ALA . 41.9 tp -67.13 -41.71 85.67 Favored 'General case' 0 N--CA 1.487 1.412 0 CA-C-O 121.311 0.577 . . . . 70.34 109.857 177.447 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 33.2 t -68.12 -38.76 82.58 Favored 'General case' 0 CA--C 1.545 0.774 0 CA-C-N 114.17 -1.377 . . . . 75.11 109.81 -179.775 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . -89.8 -64.8 1.25 Allowed Glycine 0 C--N 1.355 1.608 0 C-N-CA 121.153 -0.546 . . . . 73.33 113.674 -178.165 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 112' ' ' MET . . . . . 0.578 ' SD ' ' HB2' ' A' ' 113' ' ' LEU . 0.2 OUTLIER -93.8 -71.43 0.66 Allowed 'General case' 0 N--CA 1.481 1.093 0 CA-C-N 117.853 0.826 . . . . 73.12 111.389 -175.793 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 113' ' ' LEU . . . . . 0.578 ' HB2' ' SD ' ' A' ' 112' ' ' MET . 6.1 mt 170.12 35.57 0.0 OUTLIER 'General case' 0 N--CA 1.507 2.409 0 C-N-CA 125.649 1.579 . . . . 63.21 110.342 -178.47 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 114' ' ' LEU . . . . . 0.693 ' HB3' HG21 ' A' ' 52' ' ' THR . 1.9 tt 83.09 -20.39 0.34 Allowed 'General case' 0 N--CA 1.506 2.357 0 C-N-CA 127.03 2.132 . . . . 75.3 111.722 176.843 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 115' ' ' VAL . . . . . 0.443 HG22 ' SD ' ' A' ' 112' ' ' MET . 16.3 m -84.56 152.89 61.11 Favored Pre-proline 0 CA--C 1.553 1.088 0 N-CA-C 108.967 -0.753 . . . . 73.1 108.967 175.369 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 33.4 Cg_endo -62.01 140.83 86.63 Favored 'Trans proline' 0 C--N 1.366 1.458 0 C-N-CA 122.32 2.013 . . . . 74.5 112.174 177.962 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 4.2 m-20 -71.02 -30.25 66.41 Favored 'General case' 0 N--CA 1.482 1.149 0 C-N-CA 123.887 0.875 . . . . 53.23 111.18 -179.049 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . 55.84 62.69 6.83 Favored Pre-proline 0 N--CA 1.481 1.122 0 C-N-CA 123.843 0.857 . . . . 62.21 110.389 -167.789 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 119' ' ' PRO . . . . . . . . . . . . . 65.5 Cg_endo -71.26 144.45 46.24 Favored 'Trans proline' 0 C--N 1.374 1.882 0 C-N-CA 122.722 2.281 . . . . 72.1 112.268 -172.289 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . -82.02 123.0 5.89 Favored Glycine 0 CA--C 1.532 1.152 0 CA-C-N 116.148 -0.478 . . . . 64.22 112.139 178.213 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . -90.5 126.61 35.98 Favored 'General case' 0 N--CA 1.481 1.094 0 C-N-CA 123.728 0.811 . . . . 61.42 110.204 -179.578 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 122' ' ' SER . . . . . . . . . . . . . 41.9 m . . . . . 0 CA--C 1.555 1.167 0 C-N-CA 123.563 0.745 . . . . 72.43 110.583 -179.109 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 25.2 ttt . . . . . 0 N--CA 1.487 1.375 0 CA-C-O 119.672 -0.204 . . . . 72.43 110.856 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 2' ' ' THR . . . . . 0.421 ' O ' ' HG2' ' A' ' 6' ' ' GLU . 41.6 m -49.47 -49.4 45.61 Favored 'General case' 0 N--CA 1.487 1.398 0 C-N-CA 123.65 0.78 . . . . 73.1 112.798 -173.547 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 68.8 p -60.72 -41.16 94.73 Favored 'General case' 0 N--CA 1.482 1.173 0 C-N-CA 123.609 0.764 . . . . 71.42 112.033 -178.392 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 30.4 m -69.1 -40.69 78.23 Favored 'General case' 0 N--CA 1.48 1.045 0 C-N-CA 123.261 0.625 . . . . 72.44 111.347 179.748 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 99.4 t -65.04 -46.08 92.5 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.922 0 C-N-CA 123.029 0.532 . . . . 73.13 109.885 178.942 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . 0.421 ' HG2' ' O ' ' A' ' 2' ' ' THR . 63.0 mm-40 -59.02 -44.69 91.75 Favored 'General case' 0 N--CA 1.476 0.844 0 C-N-CA 123.367 0.667 . . . . 64.44 110.328 174.854 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 39.2 t80 -57.49 -55.62 32.4 Favored 'General case' 0 N--CA 1.479 0.979 0 C-N-CA 124.451 1.1 . . . . 70.52 110.542 -176.036 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 45.3 mt -66.18 -37.36 79.57 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.986 0 C-N-CA 123.518 0.727 . . . . 64.54 110.322 -178.452 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 2.7 t-20 -72.28 -26.7 62.08 Favored 'General case' 0 N--CA 1.488 1.469 0 C-N-CA 123.298 0.639 . . . . 62.15 111.147 -177.442 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . 0.667 ' HB3' HG22 ' A' ' 47' ' ' VAL . 82.0 mtt180 -78.03 -35.47 49.77 Favored 'General case' 0 CA--C 1.536 0.421 0 C-N-CA 123.437 0.695 . . . . 74.4 109.648 174.688 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 11' ' ' TRP . . . . . 0.419 ' CZ3' HG12 ' A' ' 68' ' ' ILE . 73.4 m95 -67.67 -34.16 76.37 Favored 'General case' 0 N--CA 1.479 1.02 0 O-C-N 123.096 0.248 . . . . 74.45 110.381 172.028 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 54.4 mt-30 -60.0 -48.42 81.8 Favored 'General case' 0 C--N 1.359 0.993 0 N-CA-C 108.248 -1.019 . . . . 75.54 108.248 171.1 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 32.2 tpt180 -58.8 -46.81 86.75 Favored 'General case' 0 CA--C 1.552 1.045 0 CA-C-N 115.158 -0.928 . . . . 75.2 111.503 -175.754 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 14' ' ' ILE . . . . . 0.713 HD11 HG21 ' A' ' 47' ' ' VAL . 31.7 mt -67.05 -45.36 87.06 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.439 0 C-N-CA 122.665 0.386 . . . . 75.31 110.163 -179.652 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . 0.419 ' HB1' ' OE1' ' A' ' 70' ' ' GLN . . . -62.15 -42.79 99.6 Favored 'General case' 0 N--CA 1.483 1.193 0 C-N-CA 124.339 1.055 . . . . 73.31 111.792 -177.894 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 95.2 mt -75.51 -39.35 58.59 Favored 'General case' 0 N--CA 1.484 1.249 0 CA-C-N 114.593 -1.185 . . . . 74.31 110.247 -175.694 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.533 ' O ' ' HG ' ' A' ' 21' ' ' LEU . 44.2 mt -63.9 -49.14 73.84 Favored 'General case' 0 C--O 1.211 -0.948 0 O-C-N 123.565 0.54 . . . . 74.51 109.99 176.48 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 83.3 p -65.42 -30.55 71.37 Favored 'General case' 0 N--CA 1.484 1.265 0 C-N-CA 122.821 0.448 . . . . 64.1 111.515 -179.54 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 19' ' ' GLN . . . . . 0.578 ' HA ' HD22 ' A' ' 74' ' ' ASN . 5.6 tp-100 -63.42 -47.69 80.91 Favored 'General case' 0 N--CA 1.481 1.115 0 CA-C-O 121.546 0.688 . . . . 72.03 110.124 173.037 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 55.0 m -61.39 -48.12 82.68 Favored 'General case' 0 CA--C 1.538 0.502 0 CA-C-N 114.321 -1.309 . . . . 42.33 110.394 178.488 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . 0.533 ' HG ' ' O ' ' A' ' 17' ' ' LEU . 95.6 mt -60.46 -38.42 84.15 Favored 'General case' 0 N--CA 1.473 0.679 0 C-N-CA 124.218 1.007 . . . . 75.12 110.136 -178.117 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.824 ' HA ' HD21 ' A' ' 78' ' ' LEU . 35.9 tp -61.09 -55.72 29.24 Favored 'General case' 0 C--O 1.253 1.276 0 C-N-CA 123.539 0.736 . . . . 71.1 110.733 178.812 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . 0.506 ' O ' ' HG3' ' A' ' 27' ' ' ARG . 56.0 mt-10 -59.19 -55.48 34.46 Favored 'General case' 0 CA--C 1.543 0.699 0 CA-C-N 114.917 -1.038 . . . . 71.32 111.678 -178.743 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.482 HD22 HD12 ' A' ' 32' ' ' LEU . 78.5 mt -58.42 -38.68 77.9 Favored 'General case' 0 N--CA 1.478 0.973 0 C-N-CA 124.714 1.206 . . . . 74.0 111.776 -175.952 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . 0.514 ' HB2' HD21 ' A' ' 33' ' ' LEU . . . -62.13 -45.16 94.67 Favored 'General case' 0 N--CA 1.478 0.934 0 C-N-CA 123.247 0.619 . . . . 74.01 111.727 176.033 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 92.6 mt-30 -73.17 -14.82 61.43 Favored 'General case' 0 CA--C 1.557 1.217 0 CA-C-N 115.42 -0.809 . . . . 74.3 111.564 177.48 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . 0.506 ' HG3' ' O ' ' A' ' 23' ' ' GLU . 72.7 mtt-85 -87.84 -2.15 58.43 Favored 'General case' 0 N--CA 1.491 1.616 0 C-N-CA 123.58 0.752 . . . . 72.5 111.489 170.979 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 85.45 0.02 88.32 Favored Glycine 0 N--CA 1.48 1.591 0 N-CA-C 113.9 0.32 . . . . 53.13 113.9 -179.311 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 24.2 mm-40 -85.2 68.2 10.43 Favored 'General case' 0 N--CA 1.473 0.695 0 C-N-CA 124.696 1.199 . . . . 74.32 111.287 -176.692 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 30' ' ' TRP . . . . . 0.44 ' O ' ' HG ' ' A' ' 34' ' ' LEU . 69.2 m95 -67.84 -28.7 67.78 Favored 'General case' 0 N--CA 1.48 1.046 0 CA-C-N 115.712 -0.677 . . . . 75.31 110.386 178.292 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 10.4 m-20 -53.13 -46.67 68.88 Favored 'General case' 0 N--CA 1.479 1.017 0 C-N-CA 124.738 1.215 . . . . 72.33 111.576 176.022 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.482 HD12 HD22 ' A' ' 24' ' ' LEU . 70.7 mt -70.44 -26.53 63.7 Favored 'General case' 0 CA--C 1.544 0.749 0 CA-C-N 114.856 -1.065 . . . . 64.55 110.758 -175.82 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . 0.514 HD21 ' HB2' ' A' ' 25' ' ' ALA . 11.0 mp -70.04 -42.86 72.34 Favored 'General case' 0 N--CA 1.485 1.325 0 C-N-CA 122.937 0.495 . . . . 74.43 110.418 172.45 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.44 ' HG ' ' O ' ' A' ' 30' ' ' TRP . 77.0 mt -65.02 -33.97 77.32 Favored 'General case' 0 N--CA 1.484 1.263 0 C-N-CA 123.495 0.718 . . . . 73.01 111.292 -179.776 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 96.5 mt-30 -71.47 -52.16 19.93 Favored 'General case' 0 N--CA 1.477 0.915 0 C-N-CA 123.446 0.698 . . . . 73.4 110.658 176.716 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 84.8 mm-40 -74.5 -12.74 60.56 Favored 'General case' 0 N--CA 1.481 1.081 0 C-N-CA 123.743 0.817 . . . . 71.32 112.594 -177.571 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . 0.43 ' O ' ' HG ' ' A' ' 41' ' ' LEU . 38.4 tt0 -52.86 -53.84 43.08 Favored 'General case' 0 N--CA 1.48 1.051 0 C-N-CA 124.066 0.947 . . . . 75.23 111.577 178.456 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 83.8 t -60.42 -39.53 81.34 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.258 0 C-N-CA 123.241 0.616 . . . . 71.43 110.901 -178.239 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 36.4 m -63.72 -43.63 95.98 Favored 'General case' 0 CA--C 1.551 0.987 0 CA-C-N 115.458 -0.792 . . . . 72.55 111.03 177.246 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 59.5 t80 -65.04 -52.66 54.61 Favored 'General case' 0 N--CA 1.479 0.977 0 C-N-CA 124.778 1.231 . . . . 70.41 110.242 -175.888 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . 0.43 ' HG ' ' O ' ' A' ' 37' ' ' GLU . 69.6 mt -63.01 -44.74 95.13 Favored 'General case' 0 C--N 1.35 0.609 0 CA-C-N 114.729 -1.123 . . . . 63.31 110.95 -177.64 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 50.9 tt0 -61.04 -47.9 84.24 Favored 'General case' 0 N--CA 1.481 1.08 0 C-N-CA 122.797 0.439 . . . . 74.1 111.009 179.709 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . 0.503 ' O ' HG23 ' A' ' 47' ' ' VAL . 63.2 m -57.76 -53.76 54.52 Favored 'General case' 0 N--CA 1.481 1.124 0 C-N-CA 123.381 0.672 . . . . 72.51 111.407 -178.968 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 20.8 tt -69.37 -28.67 39.23 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.864 0 CA-C-N 115.54 -0.754 . . . . 73.2 112.045 -174.037 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 14.0 mm-40 -62.52 -47.42 84.0 Favored 'General case' 0 N--CA 1.479 0.982 0 C-N-CA 122.709 0.404 . . . . 50.32 110.151 169.374 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 19.2 m -61.96 -27.67 69.01 Favored 'General case' 0 N--CA 1.481 1.082 0 O-C-N 123.906 0.754 . . . . 72.03 111.139 179.987 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 47' ' ' VAL . . . . . 0.713 HG21 HD11 ' A' ' 14' ' ' ILE . 21.1 t -75.4 -50.98 22.27 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.213 0 O-C-N 122.26 -0.275 . . . . 74.23 111.602 175.086 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 48' ' ' MET . . . . . . . . . . . . . 73.9 mtm -73.4 -20.87 60.64 Favored 'General case' 0 N--CA 1.492 1.648 0 N-CA-C 112.818 0.673 . . . . 52.14 112.818 -172.35 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 16.1 pt-20 -85.05 -11.51 55.16 Favored 'General case' 0 N--CA 1.48 1.045 0 C-N-CA 122.598 0.359 . . . . 74.21 111.134 175.047 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 11.9 mptt -94.62 155.88 16.68 Favored 'General case' 0 N--CA 1.485 1.294 0 C-N-CA 124.213 1.005 . . . . 54.0 110.852 -178.567 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 8.8 tt0 -87.07 142.23 28.08 Favored 'General case' 0 CA--C 1.545 0.773 0 CA-C-N 114.901 -1.045 . . . . 75.42 110.218 -179.396 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 95.7 m -68.74 131.59 91.17 Favored Pre-proline 0 CA--C 1.555 1.173 0 C-N-CA 123.868 0.867 . . . . 53.02 110.128 174.48 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 26.9 Cg_exo -66.79 151.91 81.52 Favored 'Trans proline' 0 C--N 1.381 2.285 0 C-N-CA 122.388 2.059 . . . . 72.13 112.475 172.891 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 17.0 Cg_exo -71.4 -46.88 0.57 Allowed 'Trans proline' 0 C--N 1.373 1.824 0 C-N-CA 122.898 2.398 . . . . 75.02 112.339 174.916 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . -81.98 48.92 4.0 Favored Glycine 0 C--N 1.351 1.383 0 CA-C-N 115.792 -0.64 . . . . 73.2 114.636 -172.742 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 56' ' ' ILE . . . . . 0.507 ' HB ' HD21 ' A' ' 113' ' ' LEU . 44.2 mt -81.71 109.1 15.52 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.598 0 N-CA-C 108.331 -0.988 . . . . 62.22 108.331 170.89 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 57' ' ' THR . . . . . 0.417 ' H ' HD12 ' A' ' 60' ' ' ILE . 67.6 p -75.76 -178.36 4.2 Favored 'General case' 0 N--CA 1.476 0.84 0 C-N-CA 123.434 0.694 . . . . 72.52 110.729 -179.687 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 47.4 tpt85 -60.1 -48.44 81.72 Favored 'General case' 0 CA--C 1.546 0.811 0 C-N-CA 123.331 0.653 . . . . 63.13 109.638 174.48 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 14.9 m -59.33 -44.59 92.59 Favored 'General case' 0 C--O 1.248 0.982 0 C-N-CA 124.502 1.121 . . . . 51.43 111.625 179.754 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 60' ' ' ILE . . . . . 0.417 HD12 ' H ' ' A' ' 57' ' ' THR . 87.5 mt -66.07 -38.35 81.82 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.652 0 CA-C-N 114.87 -1.059 . . . . 74.32 110.38 179.812 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 51.9 tt0 -64.27 -40.28 95.67 Favored 'General case' 0 N--CA 1.48 1.071 0 C-N-CA 123.028 0.531 . . . . 71.23 110.655 177.642 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 40.2 m-20 -60.92 -50.34 73.81 Favored 'General case' 0 N--CA 1.479 0.993 0 C-N-CA 123.11 0.564 . . . . 64.02 110.811 178.259 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 63' ' ' MET . . . . . . . . . . . . . 71.4 mtm -63.41 -57.83 9.02 Favored 'General case' 0 N--CA 1.478 0.971 0 CA-C-N 115.856 -0.611 . . . . 75.14 110.787 -178.902 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 64' ' ' VAL . . . . . 0.493 ' O ' HG13 ' A' ' 68' ' ' ILE . 55.7 t -54.72 -57.89 5.42 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.146 0 C-N-CA 124.04 0.936 . . . . 70.31 111.412 -177.495 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . 0.48 ' HB2' HD23 ' A' ' 109' ' ' LEU . . . -63.76 -41.91 97.92 Favored 'General case' 0 N--CA 1.488 1.427 0 C-N-CA 122.393 0.277 . . . . 74.13 111.5 -178.072 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -58.26 -37.35 86.69 Favored Glycine 0 C--N 1.351 1.375 0 O-C-N 123.192 0.307 . . . . 42.24 112.446 177.813 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 67' ' ' TYR . . . . . 0.514 ' O ' HG22 ' A' ' 71' ' ' THR . 18.1 m-30 -71.67 -38.73 70.62 Favored 'General case' 0 N--CA 1.472 0.671 0 C-N-CA 123.422 0.689 . . . . 73.45 111.48 177.028 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 68' ' ' ILE . . . . . 0.507 ' O ' ' HG ' ' A' ' 72' ' ' LEU . 69.8 mt -57.93 -53.39 45.93 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.05 0 O-C-N 123.904 0.752 . . . . 61.13 109.232 177.363 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 69' ' ' LYS . . . . . 0.496 ' HB2' ' CE2' ' A' ' 106' ' ' TYR . 23.0 tptm -61.02 -38.24 85.4 Favored 'General case' 0 N--CA 1.474 0.767 0 C-N-CA 123.262 0.625 . . . . 65.32 110.93 179.109 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 70' ' ' GLN . . . . . 0.419 ' OE1' ' HB1' ' A' ' 15' ' ' ALA . 64.3 tt0 -59.67 -47.04 87.19 Favored 'General case' 0 C--N 1.349 0.586 0 O-C-N 123.746 0.654 . . . . 70.12 110.715 179.737 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 71' ' ' THR . . . . . 0.514 HG22 ' O ' ' A' ' 67' ' ' TYR . 2.2 t -77.51 -26.97 51.6 Favored 'General case' 0 C--N 1.354 0.78 0 O-C-N 122.341 -0.224 . . . . 71.44 111.601 -177.169 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 72' ' ' LEU . . . . . 0.513 HD21 ' HB2' ' A' ' 102' ' ' LEU . 41.7 mt -69.97 -41.36 74.58 Favored 'General case' 0 N--CA 1.483 1.183 0 C-N-CA 122.153 0.181 . . . . 62.23 110.892 175.853 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 73' ' ' ASP . . . . . 0.424 ' O ' ' HG ' ' A' ' 77' ' ' LEU . 18.8 t70 -78.08 -42.12 33.19 Favored 'General case' 0 N--CA 1.477 0.9 0 O-C-N 123.952 0.782 . . . . 60.13 110.517 -175.717 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 74' ' ' ASN . . . . . 0.578 HD22 ' HA ' ' A' ' 19' ' ' GLN . 3.7 m-20 -63.43 -45.15 92.25 Favored 'General case' 0 N--CA 1.482 1.151 0 C-N-CA 122.986 0.514 . . . . 62.52 110.448 176.976 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 27.2 tt0 -66.07 -36.69 83.87 Favored 'General case' 0 C--O 1.206 -1.192 0 O-C-N 123.427 0.454 . . . . 64.12 110.093 175.934 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 7.7 tt0 -56.98 -44.34 82.6 Favored 'General case' 0 N--CA 1.494 1.734 0 C-N-CA 123.818 0.847 . . . . 73.45 110.83 178.518 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . 0.424 ' HG ' ' O ' ' A' ' 73' ' ' ASP . 94.8 mt -67.67 -46.41 72.44 Favored 'General case' 0 N--CA 1.478 0.958 0 CA-C-N 114.829 -1.078 . . . . 75.23 110.983 179.59 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . 0.824 HD21 ' HA ' ' A' ' 22' ' ' LEU . 71.3 mt -61.0 -52.85 63.24 Favored 'General case' 0 N--CA 1.488 1.427 0 C-N-CA 124.219 1.008 . . . . 74.41 112.802 178.43 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 79' ' ' LYS . . . . . 0.536 ' HD3' ' HA ' ' A' ' 86' ' ' LEU . 36.6 ttmt -68.19 -30.31 69.38 Favored 'General case' 0 C--N 1.315 -0.894 0 C-N-CA 125.409 1.484 . . . . 72.45 110.395 -175.328 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -71.11 -37.67 63.79 Favored Glycine 0 CA--C 1.536 1.364 0 CA-C-N 115.798 -0.637 . . . . 51.34 112.571 170.062 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 4.2 tt -63.88 -53.79 44.99 Favored 'General case' 0 N--CA 1.491 1.597 0 C-N-CA 124.043 0.937 . . . . 62.51 108.979 179.951 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 76.3 mt -60.6 -46.34 90.63 Favored 'General case' 0 CA--C 1.54 0.559 0 C-N-CA 124.705 1.202 . . . . 65.34 110.048 178.788 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 7.4 tt0 64.51 26.34 13.36 Favored 'General case' 0 CA--C 1.556 1.185 0 CA-C-N 114.582 -1.19 . . . . 74.22 111.512 171.862 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 21.8 mt-30 -83.69 -76.99 0.27 Allowed 'General case' 0 N--CA 1.478 0.946 0 N-CA-C 109.995 -0.372 . . . . 70.44 109.995 -178.436 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 85' ' ' ARG . . . . . . . . . . . . . 30.9 ttm180 -173.2 143.3 1.1 Allowed 'General case' 0 N--CA 1.492 1.65 0 C-N-CA 123.852 0.861 . . . . 75.23 109.279 -177.379 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 86' ' ' LEU . . . . . 0.536 ' HA ' ' HD3' ' A' ' 79' ' ' LYS . 79.4 mt -47.41 -25.6 1.09 Allowed 'General case' 0 N--CA 1.494 1.727 0 N-CA-C 114.836 1.421 . . . . 64.41 114.836 -168.534 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 2.3 m-20 -77.4 -12.01 59.91 Favored 'General case' 0 N--CA 1.489 1.523 0 N-CA-C 113.305 0.854 . . . . 71.34 113.305 -174.734 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 88' ' ' GLU . . . . . 0.55 ' HG3' ' HG ' ' A' ' 89' ' ' LEU . 12.1 pt-20 -58.22 -40.72 82.39 Favored 'General case' 0 N--CA 1.484 1.251 0 C-N-CA 124.442 1.097 . . . . 73.34 112.82 -174.969 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . 0.55 ' HG ' ' HG3' ' A' ' 88' ' ' GLU . 74.5 mt -114.51 13.95 17.67 Favored 'General case' 0 N--CA 1.484 1.269 0 C-N-CA 123.507 0.723 . . . . 72.22 110.511 -179.136 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 35.1 m -132.56 -95.87 0.32 Allowed 'General case' 0 CA--C 1.557 1.222 0 C-N-CA 123.466 0.706 . . . . 62.12 110.372 -177.721 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 22.8 t 54.45 29.14 10.58 Favored 'General case' 0 N--CA 1.495 1.775 0 C-N-CA 123.909 0.884 . . . . 73.3 112.391 -177.859 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 76.3 mt -81.83 -83.08 0.12 Allowed 'General case' 0 N--CA 1.48 1.055 0 N-CA-C 112.574 0.583 . . . . 62.51 112.574 -166.981 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 36.7 mt -82.28 75.03 0.93 Allowed 'Isoleucine or valine' 0 N--CA 1.475 0.811 0 N-CA-C 108.144 -1.058 . . . . 44.22 108.144 -177.193 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 75.32 -77.04 1.23 Allowed Glycine 0 C--N 1.347 1.146 0 CA-C-N 114.61 -1.177 . . . . 52.25 111.098 -169.092 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 84.4 mt-30 -104.59 -159.96 0.74 Allowed 'General case' 0 CA--C 1.549 0.922 0 C-N-CA 124.187 0.995 . . . . 71.13 110.593 -178.259 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 20.4 p -76.87 44.83 0.4 Allowed 'General case' 0 N--CA 1.478 0.97 0 C-N-CA 125.142 1.377 . . . . 70.23 113.159 176.334 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 28.5 m -62.21 -18.56 61.44 Favored 'General case' 0 CA--C 1.555 1.17 0 C-N-CA 124.785 1.234 . . . . 73.25 111.915 177.782 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 12.7 ttp85 -52.48 -55.38 22.34 Favored 'General case' 0 C--N 1.363 1.182 0 C-N-CA 124.435 1.094 . . . . 63.3 113.511 -172.278 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 7.3 tp60 -60.36 -44.41 95.61 Favored 'General case' 0 N--CA 1.478 0.935 0 O-C-N 123.916 0.76 . . . . 52.01 109.71 -173.824 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 27.0 mtpp -64.59 -40.75 96.09 Favored 'General case' 0 N--CA 1.477 0.879 0 CA-C-N 114.716 -1.129 . . . . 75.12 111.682 178.136 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 45.0 t -67.77 -47.73 68.35 Favored 'General case' 0 N--CA 1.478 0.941 0 C-N-CA 124.245 1.018 . . . . 73.4 110.752 -172.4 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 102' ' ' LEU . . . . . 0.513 ' HB2' HD21 ' A' ' 72' ' ' LEU . 10.2 mp -77.52 -30.26 52.79 Favored 'General case' 0 N--CA 1.472 0.652 0 CA-C-N 115.856 -0.611 . . . . 61.05 111.16 -179.236 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -64.28 -46.14 84.97 Favored 'General case' 0 N--CA 1.484 1.267 0 N-CA-C 109.064 -0.717 . . . . 63.34 109.064 176.492 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 104' ' ' ASN . . . . . 0.419 ' O ' ' HG2' ' A' ' 108' ' ' ARG . 6.1 t-20 -63.7 -46.27 86.26 Favored 'General case' 0 CA--C 1.539 0.525 0 CA-C-N 115.248 -0.887 . . . . 73.42 109.895 176.35 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -58.03 -37.49 74.45 Favored 'General case' 0 N--CA 1.482 1.146 0 C-N-CA 124.03 0.932 . . . . 73.35 111.438 179.348 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 106' ' ' TYR . . . . . 0.496 ' CE2' ' HB2' ' A' ' 69' ' ' LYS . 12.0 t80 -65.23 -50.37 66.1 Favored 'General case' 0 N--CA 1.475 0.793 0 C-N-CA 123.707 0.803 . . . . 72.52 109.394 177.324 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -60.95 -40.01 97.8 Favored Glycine 0 C--N 1.351 1.362 0 O-C-N 124.01 0.819 . . . . 74.3 112.966 -177.513 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 108' ' ' ARG . . . . . 0.419 ' HG2' ' O ' ' A' ' 104' ' ' ASN . 26.7 mmt180 -75.08 -29.38 60.65 Favored 'General case' 0 CA--C 1.548 0.881 0 C-N-CA 122.764 0.425 . . . . 54.31 110.244 179.307 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 109' ' ' LEU . . . . . 0.498 ' HA ' ' H ' ' A' ' 114' ' ' LEU . 45.6 tp -71.05 -36.63 72.39 Favored 'General case' 0 N--CA 1.492 1.657 0 C-N-CA 123.221 0.608 . . . . 64.42 110.475 176.361 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 45.3 t -69.85 -41.23 75.16 Favored 'General case' 0 CA--C 1.54 0.587 0 CA-C-N 115.019 -0.991 . . . . 63.0 109.604 177.758 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . -89.58 -63.68 1.28 Allowed Glycine 0 C--N 1.359 1.819 0 CA-C-O 119.42 -0.656 . . . . 53.32 114.438 -175.075 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 112' ' ' MET . . . . . . . . . . . . . 1.1 tmm? -96.26 -67.53 0.84 Allowed 'General case' 0 N--CA 1.493 1.721 0 CA-C-N 118.38 1.09 . . . . 73.11 112.366 -175.125 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 113' ' ' LEU . . . . . 0.507 HD21 ' HB ' ' A' ' 56' ' ' ILE . 1.4 tt 165.77 48.72 0.0 OUTLIER 'General case' 0 N--CA 1.508 2.458 0 C-N-CA 125.704 1.602 . . . . 73.21 107.878 179.755 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 114' ' ' LEU . . . . . 0.498 ' H ' ' HA ' ' A' ' 109' ' ' LEU . 1.3 tt 78.35 -25.3 0.2 Allowed 'General case' 0 N--CA 1.496 1.837 0 C-N-CA 126.76 2.024 . . . . 74.53 111.281 177.171 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 115' ' ' VAL . . . . . . . . . . . . . 18.6 m -88.59 132.92 37.33 Favored Pre-proline 0 CA--C 1.558 1.264 0 N-CA-C 108.698 -0.853 . . . . 73.43 108.698 174.546 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 65.6 Cg_endo -72.33 132.34 19.13 Favored 'Trans proline' 0 C--N 1.369 1.612 0 C-N-CA 122.926 2.417 . . . . 72.32 113.401 -178.25 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 21.5 t70 -81.08 -75.73 0.27 Allowed 'General case' 0 CA--C 1.544 0.738 0 N-CA-C 108.701 -0.852 . . . . 61.12 108.701 170.825 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 118' ' ' ALA . . . . . 0.404 ' HA ' ' HD3' ' A' ' 119' ' ' PRO . . . -171.59 141.52 1.28 Allowed Pre-proline 0 CA--C 1.551 1.004 0 C-N-CA 124.27 1.028 . . . . 52.54 109.433 -178.578 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 119' ' ' PRO . . . . . 0.404 ' HD3' ' HA ' ' A' ' 118' ' ' ALA . 13.0 Cg_exo -70.79 158.07 56.63 Favored 'Trans proline' 0 C--N 1.376 2.012 0 C-N-CA 123.122 2.548 . . . . 64.22 112.847 179.133 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . -77.12 87.31 0.99 Allowed Glycine 0 C--N 1.343 0.932 0 N-CA-C 110.945 -0.862 . . . . 23.25 110.945 173.109 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . -74.13 92.28 2.17 Favored 'General case' 0 CA--C 1.543 0.7 0 C-N-CA 123.318 0.647 . . . . 74.42 110.076 178.334 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 122' ' ' SER . . . . . . . . . . . . . 13.7 p . . . . . 0 C--O 1.256 1.42 0 C-N-CA 124.424 1.089 . . . . 64.23 110.696 -178.296 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . 0.501 ' HG2' ' HB ' ' A' ' 4' ' ' THR . 38.6 ttp . . . . . 0 N--CA 1.483 1.219 0 N-CA-C 109.253 -0.647 . . . . 52.24 109.253 . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 42.5 m -50.25 -50.55 49.65 Favored 'General case' 0 N--CA 1.478 0.958 0 C-N-CA 124.85 1.26 . . . . 75.31 113.405 -170.118 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 37.0 m -56.25 -47.99 77.41 Favored 'General case' 0 N--CA 1.48 1.042 0 C-N-CA 123.249 0.619 . . . . 74.13 111.628 -176.688 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . 0.508 HG21 HD13 ' A' ' 60' ' ' ILE . 40.9 m -68.66 -44.71 73.53 Favored 'General case' 0 C--N 1.35 0.625 0 CA-C-N 115.614 -0.721 . . . . 63.42 110.979 -179.29 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 83.9 t -62.33 -40.12 86.71 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.939 0 C-N-CA 123.115 0.566 . . . . 73.23 110.88 -177.789 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . 0.412 ' O ' ' HG3' ' A' ' 10' ' ' ARG . 34.2 mm-40 -69.21 -39.97 78.29 Favored 'General case' 0 N--CA 1.47 0.561 0 O-C-N 123.554 0.534 . . . . 62.11 110.591 177.226 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 30.4 t80 -65.38 -40.01 92.97 Favored 'General case' 0 CA--C 1.554 1.13 0 C-N-CA 122.67 0.388 . . . . 74.34 110.568 -179.545 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . 0.586 HD11 HG23 ' A' ' 60' ' ' ILE . 81.0 mt -68.06 -37.03 77.59 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.161 0 C-N-CA 123.876 0.87 . . . . 54.32 109.723 173.984 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 26.6 t-20 -64.45 -28.7 69.85 Favored 'General case' 0 N--CA 1.483 1.207 0 C-N-CA 124.001 0.92 . . . . 74.31 110.896 176.384 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . 0.636 ' HB3' HG22 ' A' ' 47' ' ' VAL . 91.5 mtt180 -82.11 -28.8 32.08 Favored 'General case' 0 CA--C 1.539 0.552 0 C-N-CA 123.474 0.71 . . . . 73.34 110.407 177.135 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 11' ' ' TRP . . . . . . . . . . . . . 53.4 m95 -70.92 -33.54 70.63 Favored 'General case' 0 N--CA 1.48 1.034 0 CA-C-O 119.745 -0.169 . . . . 72.11 110.632 167.608 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . 0.44 ' HG2' ' CE2' ' A' ' 67' ' ' TYR . 53.0 mt-30 -60.65 -49.19 78.52 Favored 'General case' 0 C--N 1.361 1.092 0 N-CA-C 107.874 -1.158 . . . . 55.23 107.874 171.838 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 28.5 tpt180 -53.19 -54.16 39.96 Favored 'General case' 0 CA--C 1.551 1.001 0 CA-C-N 114.267 -1.333 . . . . 73.25 111.345 -177.834 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 14' ' ' ILE . . . . . 0.406 HG13 ' O ' ' A' ' 10' ' ' ARG . 52.7 mt -62.38 -49.14 85.14 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.263 0 C-N-CA 122.501 0.321 . . . . 62.42 110.304 179.704 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . 0.527 ' HA ' ' HB ' ' A' ' 71' ' ' THR . . . -58.94 -44.15 91.34 Favored 'General case' 0 N--CA 1.485 1.288 0 C-N-CA 124.08 0.952 . . . . 62.2 112.319 -176.004 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 91.1 mt -74.47 -45.27 47.31 Favored 'General case' 0 N--CA 1.479 1.023 0 CA-C-N 114.956 -1.02 . . . . 73.43 110.632 -173.741 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.536 ' O ' ' HG ' ' A' ' 21' ' ' LEU . 90.2 mt -59.8 -51.21 70.72 Favored 'General case' 0 N--CA 1.474 0.748 0 O-C-N 123.588 0.555 . . . . 43.41 110.201 179.041 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 78.1 p -66.01 -37.1 85.06 Favored 'General case' 0 N--CA 1.479 0.993 0 O-C-N 123.698 0.623 . . . . 71.13 111.97 -177.088 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 6.8 tp-100 -63.26 -44.24 95.73 Favored 'General case' 0 C--O 1.25 1.1 0 CA-C-O 121.281 0.563 . . . . 75.43 110.753 178.022 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 35.9 m -59.48 -46.02 90.01 Favored 'General case' 0 CA--C 1.535 0.372 0 CA-C-N 114.978 -1.01 . . . . 74.02 109.823 174.255 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . 0.687 HD22 ' HA ' ' A' ' 33' ' ' LEU . 47.9 mt -63.95 -29.27 70.45 Favored 'General case' 0 N--CA 1.473 0.712 0 C-N-CA 123.142 0.577 . . . . 62.13 111.392 -178.836 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.651 ' HA ' HD21 ' A' ' 78' ' ' LEU . 36.5 tp -70.48 -50.99 32.25 Favored 'General case' 0 C--O 1.245 0.818 0 O-C-N 123.332 0.395 . . . . 72.25 110.043 178.842 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 23.8 mt-10 -60.96 -43.14 99.16 Favored 'General case' 0 N--CA 1.483 1.22 0 O-C-N 123.361 0.413 . . . . 74.13 111.435 177.063 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 96.5 mt -63.46 -39.64 94.99 Favored 'General case' 0 N--CA 1.475 0.782 0 C-N-CA 123.604 0.762 . . . . 64.44 110.767 -179.658 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . 0.515 ' HB2' HD21 ' A' ' 33' ' ' LEU . . . -63.75 -40.53 96.95 Favored 'General case' 0 N--CA 1.481 1.117 0 C-N-CA 123.246 0.618 . . . . 74.34 111.573 178.004 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . 0.455 HE21 ' HG ' ' A' ' 22' ' ' LEU . 66.9 mt-30 -59.87 -39.54 85.6 Favored 'General case' 0 N--CA 1.484 1.256 0 C-N-CA 123.527 0.731 . . . . 75.55 110.785 173.209 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 47.8 mtt180 -81.61 -5.42 58.02 Favored 'General case' 0 N--CA 1.484 1.254 0 C-N-CA 123.63 0.772 . . . . 73.12 112.155 -179.613 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 79.12 15.97 79.46 Favored Glycine 0 C--N 1.35 1.313 0 O-C-N 123.126 0.266 . . . . 40.22 113.671 177.852 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 18.7 mm-40 -83.41 51.31 1.96 Allowed 'General case' 0 N--CA 1.476 0.859 0 C-N-CA 124.805 1.242 . . . . 53.13 111.248 177.273 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 30' ' ' TRP . . . . . 0.489 ' O ' ' HG ' ' A' ' 34' ' ' LEU . 88.5 m95 -62.33 -27.0 68.75 Favored 'General case' 0 N--CA 1.475 0.808 0 C-N-CA 123.457 0.703 . . . . 72.32 111.369 -177.309 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 11.2 m-20 -51.89 -54.74 25.8 Favored 'General case' 0 N--CA 1.478 0.928 0 O-C-N 123.933 0.771 . . . . 74.04 109.816 171.242 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 93.6 mt -63.18 -28.79 70.29 Favored 'General case' 0 N--CA 1.471 0.586 0 CA-C-N 114.862 -1.063 . . . . 70.34 111.417 -177.335 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . 0.687 ' HA ' HD22 ' A' ' 21' ' ' LEU . 8.4 mp -66.62 -42.8 86.24 Favored 'General case' 0 N--CA 1.479 0.977 0 O-C-N 123.151 0.282 . . . . 75.22 110.849 172.206 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.489 ' HG ' ' O ' ' A' ' 30' ' ' TRP . 77.0 mt -68.81 -35.87 77.52 Favored 'General case' 0 N--CA 1.483 1.178 0 O-C-N 123.621 0.575 . . . . 64.34 111.792 -176.826 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 1.3 mp0 -73.51 -55.33 6.47 Favored 'General case' 0 N--CA 1.483 1.21 0 N-CA-C 110.134 -0.321 . . . . 74.11 110.134 176.636 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 36' ' ' GLN . . . . . 0.483 ' HB2' HD21 ' A' ' 21' ' ' LEU . 82.6 mm-40 -65.63 -14.87 62.06 Favored 'General case' 0 N--CA 1.487 1.381 0 C-N-CA 123.516 0.726 . . . . 74.45 112.524 179.775 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . 0.522 ' O ' ' HG ' ' A' ' 41' ' ' LEU . 29.8 tt0 -50.36 -53.62 27.76 Favored 'General case' 0 C--O 1.217 -0.657 0 O-C-N 124.228 0.955 . . . . 74.35 110.591 173.386 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 60.7 t -55.58 -43.9 74.52 Favored 'Isoleucine or valine' 0 C--O 1.249 1.052 0 C-N-CA 123.981 0.913 . . . . 55.14 111.361 -175.632 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 19.6 m -61.34 -49.15 78.13 Favored 'General case' 0 N--CA 1.476 0.86 0 CA-C-N 115.517 -0.765 . . . . 53.03 110.398 175.324 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 40.2 t80 -60.38 -40.43 90.81 Favored 'General case' 0 N--CA 1.474 0.745 0 C-N-CA 124.434 1.094 . . . . 74.2 111.448 -176.932 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . 0.522 ' HG ' ' O ' ' A' ' 37' ' ' GLU . 71.7 mt -70.69 -46.56 62.93 Favored 'General case' 0 C--N 1.349 0.57 0 C-N-CA 123.62 0.768 . . . . 73.13 110.26 -176.62 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 53.3 tt0 -58.2 -42.39 86.03 Favored 'General case' 0 N--CA 1.474 0.748 0 O-C-N 123.503 0.502 . . . . 75.21 110.638 177.304 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . 0.468 ' O ' HG23 ' A' ' 47' ' ' VAL . 49.6 m -63.71 -57.01 11.34 Favored 'General case' 0 CA--C 1.542 0.641 0 CA-C-N 115.514 -0.766 . . . . 74.22 112.007 -177.973 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 15.9 tt -63.06 -34.15 64.93 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.88 0 C-N-CA 123.391 0.676 . . . . 72.2 111.115 -174.959 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . 0.591 ' HG2' HD22 ' A' ' 92' ' ' LEU . 23.7 mm-40 -61.02 -53.6 55.22 Favored 'General case' 0 C--N 1.359 0.992 0 O-C-N 123.252 0.345 . . . . 70.21 110.594 169.819 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 46' ' ' THR . . . . . 0.43 ' O ' ' HB2' ' A' ' 50' ' ' LYS . 96.0 m -53.26 -34.43 57.21 Favored 'General case' 0 N--CA 1.482 1.155 0 C-N-CA 123.532 0.733 . . . . 73.34 111.664 -176.976 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 47' ' ' VAL . . . . . 0.636 HG22 ' HB3' ' A' ' 10' ' ' ARG . 41.2 t -75.64 -48.57 29.64 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.938 0 C-N-CA 123.189 0.595 . . . . 73.25 111.782 179.019 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 48' ' ' MET . . . . . . . . . . . . . 76.2 mtm -68.78 -30.53 69.15 Favored 'General case' 0 N--CA 1.489 1.485 0 C-N-CA 122.611 0.365 . . . . 74.34 111.736 -177.736 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 51.2 mt-10 -75.64 -18.48 59.66 Favored 'General case' 0 N--CA 1.48 1.063 0 C-N-CA 124.121 0.968 . . . . 71.43 110.867 175.845 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . 0.447 ' HE2' HH12 ' A' ' 10' ' ' ARG . 0.1 OUTLIER -93.36 142.52 27.23 Favored 'General case' 0 C--O 1.237 0.409 0 C-N-CA 122.936 0.494 . . . . 71.4 110.056 -175.738 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 36.8 tt0 -79.46 141.41 36.8 Favored 'General case' 0 C--O 1.244 0.814 0 N-CA-C 108.954 -0.758 . . . . 71.54 108.954 173.628 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 52' ' ' THR . . . . . 0.685 HG21 ' HB3' ' A' ' 114' ' ' LEU . 32.1 m -73.78 131.29 82.04 Favored Pre-proline 0 CA--C 1.552 1.033 0 O-C-N 123.624 0.578 . . . . 73.05 110.263 177.255 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 53' ' ' PRO . . . . . 0.413 ' HG2' ' HA ' ' A' ' 4' ' ' THR . 25.5 Cg_exo -65.29 155.12 70.3 Favored 'Trans proline' 0 C--N 1.371 1.743 0 C-N-CA 122.94 2.427 . . . . 74.53 112.814 174.784 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 32.8 Cg_exo -61.49 -47.7 11.05 Favored 'Trans proline' 0 C--N 1.376 1.999 0 C-N-CA 123.603 2.869 . . . . 53.34 112.812 179.268 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . -65.52 84.85 0.08 OUTLIER Glycine 0 C--N 1.347 1.148 0 CA-C-N 115.156 -0.929 . . . . 72.13 113.932 -173.553 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 62.6 mt -121.15 103.99 14.53 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.467 0 N-CA-C 107.932 -1.136 . . . . 73.21 107.932 173.75 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 57' ' ' THR . . . . . 0.444 ' H ' HD12 ' A' ' 60' ' ' ILE . 58.0 p -91.97 -174.36 3.77 Favored 'General case' 0 CA--C 1.544 0.743 0 C-N-CA 123.476 0.711 . . . . 75.01 109.668 175.175 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 3.6 tmt_? -60.52 -52.31 65.72 Favored 'General case' 0 CA--C 1.545 0.774 0 C-N-CA 123.949 0.9 . . . . 73.42 110.905 178.727 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 57.6 p -62.7 -39.11 92.96 Favored 'General case' 0 N--CA 1.481 1.085 0 C-N-CA 123.373 0.669 . . . . 71.44 111.635 -179.563 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 60' ' ' ILE . . . . . 0.586 HG23 HD11 ' A' ' 8' ' ' ILE . 87.0 mt -63.13 -47.98 89.91 Favored 'Isoleucine or valine' 0 C--N 1.349 0.55 0 CA-C-N 115.108 -0.951 . . . . 71.21 110.795 179.065 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 27.9 pt20 -70.97 -25.13 62.58 Favored 'General case' 0 N--CA 1.481 1.104 0 CA-C-N 117.491 0.132 . . . . 74.34 110.997 -177.885 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 53.8 m-20 -65.58 -48.56 71.93 Favored 'General case' 0 N--CA 1.482 1.132 0 C-N-CA 122.268 0.227 . . . . 71.53 111.256 172.647 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 63' ' ' MET . . . . . . . . . . . . . 73.4 mtm -65.87 -45.03 83.59 Favored 'General case' 0 N--CA 1.478 0.953 0 O-C-N 123.448 0.467 . . . . 64.54 111.061 178.29 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 64' ' ' VAL . . . . . 0.45 ' O ' HG13 ' A' ' 68' ' ' ILE . 55.6 t -64.49 -64.59 0.66 Allowed 'Isoleucine or valine' 0 N--CA 1.475 0.796 0 C-N-CA 123.337 0.655 . . . . 62.34 110.389 -178.921 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -63.48 -29.81 71.03 Favored 'General case' 0 N--CA 1.482 1.134 0 C-N-CA 123.053 0.541 . . . . 54.11 111.534 -177.149 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -60.24 -54.01 40.89 Favored Glycine 0 C--N 1.35 1.333 0 O-C-N 123.871 0.732 . . . . 74.21 111.378 174.71 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 67' ' ' TYR . . . . . 0.44 ' CE2' ' HG2' ' A' ' 12' ' ' GLN . 12.1 m-85 -66.44 -33.9 76.73 Favored 'General case' 0 N--CA 1.469 0.513 0 C-N-CA 122.999 0.52 . . . . 73.01 112.109 179.99 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 68' ' ' ILE . . . . . 0.521 ' O ' ' HG ' ' A' ' 72' ' ' LEU . 70.0 mt -59.97 -56.13 19.49 Favored 'Isoleucine or valine' 0 C--N 1.357 0.924 0 N-CA-C 108.982 -0.747 . . . . 71.24 108.982 175.958 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 54.7 tptt -54.42 -48.31 71.8 Favored 'General case' 0 N--CA 1.475 0.777 0 O-C-N 123.994 0.809 . . . . 62.35 110.927 -179.366 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 56.6 mt-30 -57.76 -46.41 84.58 Favored 'General case' 0 N--CA 1.474 0.767 0 O-C-N 124.021 0.825 . . . . 70.13 111.272 179.836 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 71' ' ' THR . . . . . 0.527 ' HB ' ' HA ' ' A' ' 15' ' ' ALA . 14.0 t -79.29 -18.96 51.63 Favored 'General case' 0 C--N 1.353 0.745 0 CA-C-O 118.981 -0.533 . . . . 64.51 111.233 -175.749 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 72' ' ' LEU . . . . . 0.521 ' HG ' ' O ' ' A' ' 68' ' ' ILE . 39.8 mt -70.67 -41.31 72.25 Favored 'General case' 0 N--CA 1.485 1.278 0 N-CA-C 109.627 -0.508 . . . . 64.51 109.627 171.918 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 6.2 m-20 -62.22 -50.17 72.83 Favored 'General case' 0 N--CA 1.474 0.762 0 O-C-N 123.676 0.61 . . . . 73.43 110.187 174.007 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 71.5 m-20 -59.47 -52.0 67.45 Favored 'General case' 0 N--CA 1.481 1.109 0 C-N-CA 122.975 0.51 . . . . 63.31 110.557 -178.712 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . 0.416 ' O ' ' HG2' ' A' ' 79' ' ' LYS . 40.1 tp10 -52.75 -56.21 17.28 Favored 'General case' 0 N--CA 1.485 1.286 0 C-N-CA 125.109 1.364 . . . . 74.5 111.455 178.547 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 10.0 tt0 -70.56 -42.14 71.52 Favored 'General case' 0 N--CA 1.473 0.724 0 C-N-CA 123.088 0.555 . . . . 73.41 111.51 -171.336 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 84.4 mt -62.11 -38.4 88.76 Favored 'General case' 0 N--CA 1.483 1.217 0 O-C-N 123.397 0.436 . . . . 44.4 110.677 178.207 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . 0.651 HD21 ' HA ' ' A' ' 22' ' ' LEU . 46.0 mt -63.35 -49.1 75.22 Favored 'General case' 0 N--CA 1.476 0.845 0 O-C-N 123.452 0.47 . . . . 54.32 111.396 174.525 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 79' ' ' LYS . . . . . 0.416 ' HG2' ' O ' ' A' ' 75' ' ' GLU . 46.6 mmtm -62.87 -34.03 76.52 Favored 'General case' 0 N--CA 1.485 1.291 0 C-N-CA 122.978 0.511 . . . . 74.54 111.635 -177.766 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -75.28 -35.78 47.23 Favored Glycine 0 C--N 1.346 1.113 0 CA-C-N 115.197 -0.911 . . . . 54.43 112.408 177.125 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 1.5 tt -67.28 -37.37 83.32 Favored 'General case' 0 N--CA 1.477 0.877 0 C-N-CA 123.786 0.834 . . . . 71.3 109.03 178.172 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 82' ' ' LEU . . . . . 0.483 ' HG ' ' O ' ' A' ' 78' ' ' LEU . 60.1 mt -56.77 -43.0 80.39 Favored 'General case' 0 C--N 1.352 0.697 0 C-N-CA 123.768 0.827 . . . . 74.52 111.565 179.683 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 35.7 tt0 68.37 2.75 3.44 Favored 'General case' 0 CA--C 1.565 1.533 0 C-N-CA 124.375 1.07 . . . . 62.53 110.975 -173.019 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 14.9 mm100 -93.88 170.85 9.25 Favored 'General case' 0 N--CA 1.469 0.524 0 C-N-CA 124.284 1.033 . . . . 64.0 110.302 -173.839 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 85' ' ' ARG . . . . . . . . . . . . . 36.3 mmt180 -67.26 156.54 36.08 Favored 'General case' 0 C--O 1.246 0.886 0 CA-C-N 115.474 -0.784 . . . . 71.33 109.467 171.378 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 86' ' ' LEU . . . . . 0.402 ' HB3' ' NH2' ' A' ' 98' ' ' ARG . 94.1 mt -78.35 75.62 4.87 Favored 'General case' 0 CA--C 1.548 0.873 0 CA-C-O 121.612 0.72 . . . . 75.02 110.507 -176.149 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 6.6 p-10 -142.87 -43.63 0.3 Allowed 'General case' 0 N--CA 1.474 0.756 0 C-N-CA 124.55 1.14 . . . . 72.32 108.416 174.331 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 37.3 mt-10 -69.42 122.73 19.54 Favored 'General case' 0 C--N 1.352 0.691 0 C-N-CA 123.465 0.706 . . . . 74.25 109.918 174.971 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 74.4 mt 64.02 11.25 5.98 Favored 'General case' 0 N--CA 1.487 1.388 0 C-N-CA 124.83 1.252 . . . . 73.54 111.906 -175.281 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 90' ' ' SER . . . . . 0.584 ' O ' ' HG ' ' A' ' 92' ' ' LEU . 6.0 m -111.05 -79.98 0.58 Allowed 'General case' 0 C--O 1.217 -0.654 0 N-CA-C 107.927 -1.138 . . . . 64.34 107.927 -176.908 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 32.8 t 54.52 -116.32 1.04 Allowed 'General case' 0 CA--C 1.563 1.476 0 C-N-CA 124.009 0.924 . . . . 63.55 111.039 -176.496 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 92' ' ' LEU . . . . . 0.591 HD22 ' HG2' ' A' ' 45' ' ' GLU . 43.7 mt 48.74 -148.53 0.23 Allowed 'General case' 0 N--CA 1.492 1.647 0 C-N-CA 124.737 1.215 . . . . 71.24 112.629 172.956 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 49.4 mt -53.41 111.12 0.26 Allowed 'Isoleucine or valine' 0 CA--C 1.558 1.26 0 C-N-CA 123.892 0.877 . . . . 74.13 110.182 167.203 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -76.86 0.61 65.44 Favored Glycine 0 C--N 1.35 1.314 0 CA-C-N 115.82 -0.627 . . . . 71.43 114.114 -175.561 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 9.9 tt0 -69.69 -11.58 60.96 Favored 'General case' 0 N--CA 1.48 1.071 0 C-N-CA 123.858 0.863 . . . . 64.13 110.67 169.254 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 19.6 t 73.25 17.49 3.97 Favored 'General case' 0 C--N 1.358 0.973 0 C-N-CA 124.944 1.298 . . . . 71.41 111.453 176.856 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 13.5 t -86.57 16.7 4.41 Favored 'General case' 0 CA--C 1.553 1.067 0 C-N-CA 123.732 0.813 . . . . 45.53 111.571 -179.346 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 98' ' ' ARG . . . . . 0.402 ' NH2' ' HB3' ' A' ' 86' ' ' LEU . 14.3 mtm-85 -65.59 -58.13 6.49 Favored 'General case' 0 N--CA 1.489 1.515 0 C-N-CA 123.839 0.855 . . . . 74.34 112.554 -167.441 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 44.8 tt0 -63.4 -37.81 88.73 Favored 'General case' 0 CA--C 1.542 0.65 0 CA-C-N 115.296 -0.865 . . . . 72.14 109.675 178.344 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 51.5 tttm -68.17 -26.45 65.75 Favored 'General case' 0 CA--C 1.546 0.816 0 CA-C-N 114.794 -1.094 . . . . 72.22 111.357 177.766 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 47.2 t -73.23 -48.39 35.4 Favored 'General case' 0 N--CA 1.471 0.608 0 C-N-CA 123.502 0.721 . . . . 32.42 109.159 -178.509 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 9.5 mp -69.3 -30.1 68.1 Favored 'General case' 0 N--CA 1.484 1.266 0 O-C-N 123.498 0.499 . . . . 51.14 111.418 176.225 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 20.9 t-20 -71.01 -50.33 35.37 Favored 'General case' 0 N--CA 1.478 0.964 0 CA-C-O 121.055 0.455 . . . . 71.31 110.499 179.642 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 10.8 m120 -71.09 -18.9 62.52 Favored 'General case' 0 N--CA 1.479 1.016 0 C-N-CA 123.072 0.549 . . . . 50.1 111.091 176.449 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -64.91 -47.43 77.77 Favored 'General case' 0 C--N 1.349 0.572 0 O-C-N 123.626 0.579 . . . . 75.03 109.795 169.18 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 106' ' ' TYR . . . . . . . . . . . . . 1.1 t80 -58.11 -45.02 87.97 Favored 'General case' 0 N--CA 1.482 1.161 0 N-CA-C 109.482 -0.562 . . . . 73.53 109.482 174.225 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -58.79 -44.85 95.62 Favored Glycine 0 C--N 1.35 1.361 0 CA-C-N 115.778 -0.646 . . . . 54.31 113.345 -179.777 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 31.4 ptt180 -81.7 -14.53 56.44 Favored 'General case' 0 N--CA 1.476 0.828 0 C-N-CA 122.746 0.418 . . . . 73.22 111.051 -179.979 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 109' ' ' LEU . . . . . 0.567 HD13 ' HB2' ' A' ' 114' ' ' LEU . 36.4 tp -70.83 -43.37 68.7 Favored 'General case' 0 N--CA 1.486 1.373 0 N-CA-C 109.218 -0.66 . . . . 73.45 109.218 171.012 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 19.1 m -71.83 -36.44 70.2 Favored 'General case' 0 CA--C 1.547 0.837 0 CA-C-N 114.984 -1.007 . . . . 70.41 110.376 177.762 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . -91.02 -61.61 1.26 Allowed Glycine 0 C--N 1.358 1.789 0 N-CA-C 114.585 0.594 . . . . 65.22 114.585 -177.568 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 112' ' ' MET . . . . . . . . . . . . . 12.5 tpt -91.83 -69.72 0.73 Allowed 'General case' 0 N--CA 1.488 1.431 0 N-CA-C 112.961 0.726 . . . . 42.4 112.961 -172.377 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 18.8 tp 170.75 21.92 0.0 OUTLIER 'General case' 0 N--CA 1.493 1.721 0 C-N-CA 124.54 1.136 . . . . 70.34 110.593 -178.543 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 114' ' ' LEU . . . . . 0.685 ' HB3' HG21 ' A' ' 52' ' ' THR . 39.0 tp 72.68 -5.02 1.95 Allowed 'General case' 0 N--CA 1.499 1.999 0 C-N-CA 124.788 1.235 . . . . 74.05 111.698 -175.922 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 115' ' ' VAL . . . . . . . . . . . . . 30.2 m -83.2 141.93 43.5 Favored Pre-proline 0 CA--C 1.55 0.963 0 N-CA-C 108.804 -0.813 . . . . 75.34 108.804 173.552 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 29.5 Cg_endo -61.42 115.53 2.82 Favored 'Trans proline' 0 C--N 1.372 1.798 0 C-N-CA 122.789 2.326 . . . . 40.45 112.518 -177.164 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 32.9 t70 -155.42 -74.93 0.11 Allowed 'General case' 0 N--CA 1.474 0.743 0 C-N-CA 123.032 0.533 . . . . 71.33 109.6 176.993 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . 64.58 132.52 0.03 OUTLIER Pre-proline 0 CA--C 1.558 1.265 0 C-N-CA 124.768 1.227 . . . . 53.33 111.698 -176.675 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 119' ' ' PRO . . . . . . . . . . . . . 76.4 Cg_endo -81.41 -163.64 0.23 Allowed 'Trans proline' 0 C--N 1.371 1.722 0 C-N-CA 122.52 2.147 . . . . 55.5 111.195 177.663 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . -79.13 61.44 4.13 Favored Glycine 0 C--N 1.342 0.893 0 N-CA-C 111.546 -0.621 . . . . 72.33 111.546 171.182 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . -81.91 76.71 8.8 Favored 'General case' 0 C--N 1.35 0.624 0 C-N-CA 124.038 0.935 . . . . 71.43 109.808 -175.67 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 122' ' ' SER . . . . . . . . . . . . . 24.7 t . . . . . 0 C--O 1.255 1.371 0 C-N-CA 124.231 1.012 . . . . 43.44 110.116 -178.042 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 25.3 ttt . . . . . 0 CA--C 1.558 1.257 0 N-CA-C 110.369 -0.234 . . . . 54.1 110.369 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 74.1 p -55.63 -56.48 19.85 Favored 'General case' 0 N--CA 1.489 1.523 0 C-N-CA 123.957 0.903 . . . . 42.31 112.546 -171.971 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 34.1 t -65.23 -30.63 71.54 Favored 'General case' 0 N--CA 1.478 0.94 0 C-N-CA 123.208 0.603 . . . . 61.14 111.474 -177.178 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . 0.468 ' HA ' ' HG3' ' A' ' 53' ' ' PRO . 28.0 m -72.27 -43.03 64.88 Favored 'General case' 0 N--CA 1.471 0.624 0 C-N-CA 123.162 0.585 . . . . 70.31 111.214 179.078 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 76.6 t -63.59 -45.77 96.72 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.759 0 N-CA-C 109.2 -0.667 . . . . 62.14 109.2 179.29 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 24.1 mm-40 -56.66 -51.63 68.01 Favored 'General case' 0 N--CA 1.475 0.783 0 O-C-N 124.058 0.849 . . . . 74.51 110.627 174.226 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 34.0 t80 -58.11 -53.65 55.84 Favored 'General case' 0 N--CA 1.481 1.122 0 C-N-CA 124.195 0.998 . . . . 73.34 111.496 -173.577 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . 0.408 ' O ' ' HG3' ' A' ' 12' ' ' GLN . 72.1 mt -61.77 -45.32 98.94 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.967 0 C-N-CA 123.54 0.736 . . . . 61.15 110.151 178.776 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 26.2 t-20 -62.01 -32.86 73.38 Favored 'General case' 0 N--CA 1.488 1.436 0 C-N-CA 123.894 0.878 . . . . 74.24 111.954 -177.897 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . 0.412 ' O ' HG13 ' A' ' 14' ' ' ILE . 96.6 mtt180 -78.13 -34.75 49.75 Favored 'General case' 0 C--O 1.214 -0.773 0 CA-C-N 115.954 -0.566 . . . . 74.31 110.042 178.694 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 11' ' ' TRP . . . . . . . . . . . . . 53.0 m95 -67.28 -33.76 75.98 Favored 'General case' 0 N--CA 1.482 1.163 0 O-C-N 122.916 0.135 . . . . 74.22 111.131 172.037 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . 0.444 ' HG2' ' CE2' ' A' ' 67' ' ' TYR . 51.4 mt-30 -61.42 -48.41 81.31 Favored 'General case' 0 C--O 1.218 -0.562 0 N-CA-C 108.327 -0.99 . . . . 73.41 108.327 171.939 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 79.2 ttt180 -62.56 -48.59 78.83 Favored 'General case' 0 C--O 1.216 -0.687 0 O-C-N 124.638 1.211 . . . . 74.33 111.373 -175.799 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 14' ' ' ILE . . . . . 0.412 HG13 ' O ' ' A' ' 10' ' ' ARG . 90.9 mt -62.44 -43.12 97.93 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.002 0 C-N-CA 123.615 0.766 . . . . 61.41 109.69 -179.312 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . 0.619 ' HA ' ' HB ' ' A' ' 71' ' ' THR . . . -60.79 -44.3 97.0 Favored 'General case' 0 N--CA 1.482 1.139 0 C-N-CA 123.373 0.669 . . . . 73.32 111.799 176.645 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 87.8 mt -74.76 -35.58 62.58 Favored 'General case' 0 N--CA 1.485 1.301 0 CA-C-N 115.143 -0.935 . . . . 73.4 111.038 -175.027 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.508 ' O ' ' HG ' ' A' ' 21' ' ' LEU . 72.4 mt -72.05 -47.31 52.57 Favored 'General case' 0 N--CA 1.475 0.798 0 C-N-CA 122.912 0.485 . . . . 74.21 109.742 -177.721 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 79.3 p -65.1 -36.0 82.9 Favored 'General case' 0 N--CA 1.48 1.048 0 C-N-CA 123.04 0.536 . . . . 72.31 111.091 176.951 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 6.4 tp-100 -61.88 -45.57 93.16 Favored 'General case' 0 N--CA 1.475 0.79 0 C-N-CA 123.391 0.676 . . . . 74.12 110.189 174.971 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . 0.404 ' O ' ' HG ' ' A' ' 24' ' ' LEU . 66.5 m -58.79 -52.93 63.63 Favored 'General case' 0 C--O 1.202 -1.442 0 CA-C-N 114.929 -1.032 . . . . 75.24 109.584 174.7 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . 0.643 HD22 ' HA ' ' A' ' 33' ' ' LEU . 52.6 mt -62.22 -27.69 69.16 Favored 'General case' 0 N--CA 1.473 0.699 0 C-N-CA 123.676 0.79 . . . . 74.43 111.323 -175.963 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.673 ' HA ' HD21 ' A' ' 78' ' ' LEU . 56.8 tp -70.51 -54.09 13.59 Favored 'General case' 0 N--CA 1.472 0.651 0 C-N-CA 122.953 0.501 . . . . 74.12 109.894 176.691 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . 0.441 ' O ' ' HG3' ' A' ' 27' ' ' ARG . 44.6 mt-10 -59.12 -52.74 64.43 Favored 'General case' 0 CA--C 1.545 0.776 0 O-C-N 123.929 0.768 . . . . 74.44 110.246 179.506 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.461 ' HB3' ' HB2' ' A' ' 29' ' ' GLU . 92.2 mt -53.56 -42.56 67.65 Favored 'General case' 0 N--CA 1.479 1.007 0 C-N-CA 125.441 1.496 . . . . 75.11 112.174 176.578 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . 0.512 ' HB2' HD21 ' A' ' 33' ' ' LEU . . . -58.28 -47.68 82.87 Favored 'General case' 0 N--CA 1.484 1.237 0 C-N-CA 122.944 0.498 . . . . 74.02 110.901 176.918 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 90.8 mt-30 -66.59 -30.34 70.61 Favored 'General case' 0 CA--C 1.555 1.157 0 CA-C-N 114.99 -1.005 . . . . 73.33 111.141 178.721 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . 0.441 ' HG3' ' O ' ' A' ' 23' ' ' GLU . 94.9 mtt180 -78.38 -17.81 55.94 Favored 'General case' 0 N--CA 1.483 1.202 0 C-N-CA 123.857 0.863 . . . . 75.45 111.326 178.253 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 92.43 9.27 61.83 Favored Glycine 0 N--CA 1.475 1.283 0 C-N-CA 122.922 0.296 . . . . 51.13 113.564 -178.231 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . 0.461 ' HB2' ' HB3' ' A' ' 24' ' ' LEU . 5.4 mm-40 -82.58 53.72 2.42 Favored 'General case' 0 CA--C 1.55 0.973 0 C-N-CA 124.387 1.075 . . . . 72.21 111.014 178.09 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 30' ' ' TRP . . . . . . . . . . . . . 86.4 m95 -63.56 -28.89 70.25 Favored 'General case' 0 N--CA 1.483 1.187 0 C-N-CA 123.902 0.881 . . . . 73.11 111.717 -176.404 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 31' ' ' ASP . . . . . 0.485 ' O ' ' HG3' ' A' ' 35' ' ' GLN . 3.4 m-20 -53.23 -46.37 69.1 Favored 'General case' 0 N--CA 1.475 0.823 0 C-N-CA 123.603 0.761 . . . . 53.42 110.548 174.789 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.438 HD12 HD22 ' A' ' 24' ' ' LEU . 64.9 mt -67.14 -28.25 67.98 Favored 'General case' 0 CA--C 1.549 0.94 0 CA-C-N 115.501 -0.772 . . . . 74.22 111.34 -176.527 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . 0.643 ' HA ' HD22 ' A' ' 21' ' ' LEU . 9.6 mp -68.61 -43.81 75.6 Favored 'General case' 0 N--CA 1.486 1.36 0 C-N-CA 123.122 0.569 . . . . 72.42 110.116 173.365 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 79.3 mt -64.36 -36.97 85.86 Favored 'General case' 0 CA--C 1.551 0.986 0 CA-C-N 115.324 -0.853 . . . . 73.02 111.348 178.844 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 35' ' ' GLN . . . . . 0.485 ' HG3' ' O ' ' A' ' 31' ' ' ASP . 90.4 mt-30 -69.74 -51.55 33.23 Favored 'General case' 0 N--CA 1.481 1.119 0 C-N-CA 123.292 0.637 . . . . 72.12 110.312 177.608 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 36' ' ' GLN . . . . . 0.443 ' HB2' HD21 ' A' ' 21' ' ' LEU . 77.2 mm-40 -70.87 -14.25 62.33 Favored 'General case' 0 N--CA 1.477 0.888 0 CA-C-N 115.248 -0.887 . . . . 73.42 112.993 -177.73 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 38.3 tt0 -45.31 -51.38 11.07 Favored 'General case' 0 N--CA 1.487 1.377 0 CA-C-N 118.287 0.494 . . . . 73.12 111.373 174.241 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 81.4 t -61.12 -54.57 33.52 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.793 0 O-C-N 123.877 0.736 . . . . 72.51 110.74 -179.027 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 21.9 m -65.51 -52.09 55.21 Favored 'General case' 0 CA--C 1.551 1.006 0 C-N-CA 123.525 0.73 . . . . 71.44 112.507 -173.441 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 44.4 t80 -60.58 -51.53 69.01 Favored 'General case' 0 N--CA 1.478 0.951 0 C-N-CA 124.792 1.237 . . . . 71.34 111.904 -179.077 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . 0.54 ' HA ' HG22 ' A' ' 44' ' ' ILE . 64.4 mt -77.81 -23.35 49.1 Favored 'General case' 0 CA--C 1.546 0.793 0 CA-C-N 116.317 -0.401 . . . . 75.32 111.604 -174.688 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 51.8 tt0 -66.54 -44.49 82.24 Favored 'General case' 0 N--CA 1.484 1.255 0 N-CA-C 109.435 -0.579 . . . . 65.45 109.435 168.7 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . 0.432 ' O ' HG23 ' A' ' 47' ' ' VAL . 74.3 m -60.79 -43.51 98.0 Favored 'General case' 0 N--CA 1.476 0.859 0 C-N-CA 123.251 0.62 . . . . 71.33 111.582 179.465 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 44' ' ' ILE . . . . . 0.54 HG22 ' HA ' ' A' ' 41' ' ' LEU . 12.5 tt -69.02 -40.45 80.86 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.972 0 O-C-N 123.121 0.263 . . . . 54.44 110.464 -178.145 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 14.3 mm-40 -58.81 -42.51 89.34 Favored 'General case' 0 N--CA 1.484 1.251 0 C-N-CA 122.895 0.478 . . . . 62.05 110.767 172.747 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 99.4 m -62.0 -43.37 98.97 Favored 'General case' 0 N--CA 1.48 1.059 0 C-N-CA 123.919 0.888 . . . . 51.53 111.578 -179.437 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 47' ' ' VAL . . . . . 0.432 HG23 ' O ' ' A' ' 43' ' ' SER . 58.0 t -67.95 -41.89 85.07 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.012 0 C-N-CA 122.269 0.228 . . . . 63.03 110.938 178.889 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 48' ' ' MET . . . . . . . . . . . . . 78.4 mtm -68.91 -34.45 75.41 Favored 'General case' 0 N--CA 1.484 1.244 0 N-CA-C 112.479 0.548 . . . . 42.54 112.479 -177.468 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 13.1 pt-20 -82.33 -24.22 34.7 Favored 'General case' 0 N--CA 1.487 1.407 0 C-N-CA 122.355 0.262 . . . . 72.21 111.359 179.574 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 13.4 mptt -83.72 143.66 29.87 Favored 'General case' 0 N--CA 1.479 1.021 0 C-N-CA 122.914 0.486 . . . . 75.51 110.228 177.808 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 51.1 tt0 -74.55 137.48 42.44 Favored 'General case' 0 CA--C 1.542 0.645 0 CA-C-N 114.975 -1.011 . . . . 72.32 110.581 -178.869 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 17.4 m -62.95 132.76 95.09 Favored Pre-proline 0 CA--C 1.561 1.397 0 O-C-N 123.799 0.687 . . . . 62.24 110.381 175.637 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 53' ' ' PRO . . . . . 0.468 ' HG3' ' HA ' ' A' ' 4' ' ' THR . 61.0 Cg_endo -70.05 156.26 63.0 Favored 'Trans proline' 0 C--N 1.377 2.072 0 C-N-CA 122.645 2.23 . . . . 63.11 112.424 177.376 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 35.6 Cg_endo -64.5 -47.57 5.51 Favored 'Trans proline' 0 C--N 1.374 1.891 0 C-N-CA 122.803 2.335 . . . . 71.22 113.284 175.61 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . -67.14 83.34 0.12 Allowed Glycine 0 C--N 1.347 1.154 0 O-C-N 123.866 0.729 . . . . 71.32 113.613 -174.115 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 60.5 mt -124.86 103.02 11.71 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.455 0 C-N-CA 124.203 1.001 . . . . 72.34 108.455 175.164 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 57' ' ' THR . . . . . 0.423 ' H ' HD12 ' A' ' 60' ' ' ILE . 81.9 p -83.67 -178.9 7.17 Favored 'General case' 0 N--CA 1.473 0.712 0 N-CA-C 109.244 -0.65 . . . . 62.34 109.244 170.547 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 27.1 tpt180 -69.04 -35.53 76.69 Favored 'General case' 0 N--CA 1.472 0.626 0 N-CA-C 110.016 -0.364 . . . . 74.31 110.016 177.261 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 35.9 m -60.49 -47.9 84.1 Favored 'General case' 0 CA--C 1.546 0.799 0 C-N-CA 123.212 0.605 . . . . 71.34 110.716 176.508 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 60' ' ' ILE . . . . . 0.423 HD12 ' H ' ' A' ' 57' ' ' THR . 86.1 mt -61.75 -42.73 95.52 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.814 0 CA-C-N 115.097 -0.956 . . . . 74.31 110.405 176.347 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 64.5 tt0 -65.26 -36.3 83.7 Favored 'General case' 0 N--CA 1.476 0.864 0 C-N-CA 123.754 0.822 . . . . 52.15 111.597 -178.129 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 37.2 m-20 -75.68 -38.1 59.01 Favored 'General case' 0 N--CA 1.481 1.079 0 C-N-CA 122.831 0.452 . . . . 62.24 111.786 179.924 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 63' ' ' MET . . . . . . . . . . . . . 72.3 mtm -66.8 -51.55 54.43 Favored 'General case' 0 N--CA 1.482 1.125 0 C-N-CA 122.4 0.28 . . . . 75.45 110.446 176.649 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 64' ' ' VAL . . . . . 0.488 ' O ' HG13 ' A' ' 68' ' ' ILE . 55.5 t -59.58 -58.97 4.7 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.765 0 C-N-CA 123.524 0.73 . . . . 73.35 110.768 179.128 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . 0.485 ' HB2' HD23 ' A' ' 109' ' ' LEU . . . -62.26 -35.94 80.53 Favored 'General case' 0 N--CA 1.488 1.475 0 C-N-CA 122.567 0.347 . . . . 51.14 111.876 -178.405 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -59.27 -41.68 96.93 Favored Glycine 0 C--N 1.347 1.172 0 N-CA-C 111.776 -0.529 . . . . 72.42 111.776 175.138 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 67' ' ' TYR . . . . . 0.444 ' CE2' ' HG2' ' A' ' 12' ' ' GLN . 10.7 m-30 -78.86 -29.81 44.75 Favored 'General case' 0 N--CA 1.467 0.422 0 N-CA-C 113.198 0.814 . . . . 74.42 113.198 -179.902 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 68' ' ' ILE . . . . . 0.488 HG13 ' O ' ' A' ' 64' ' ' VAL . 59.4 mt -64.85 -51.64 64.35 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.095 0 N-CA-C 108.414 -0.958 . . . . 74.11 108.414 174.702 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 20.2 tptm -55.21 -45.17 75.89 Favored 'General case' 0 N--CA 1.474 0.767 0 O-C-N 123.913 0.758 . . . . 73.21 110.57 175.119 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 55.4 tt0 -61.38 -45.39 94.55 Favored 'General case' 0 C--N 1.352 0.717 0 O-C-N 123.818 0.699 . . . . 75.35 110.848 -176.3 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 71' ' ' THR . . . . . 0.619 ' HB ' ' HA ' ' A' ' 15' ' ' ALA . 11.1 t -78.3 -28.1 47.4 Favored 'General case' 0 C--N 1.353 0.752 0 O-C-N 122.999 0.187 . . . . 75.54 110.999 -173.864 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 72' ' ' LEU . . . . . 0.433 ' O ' ' HB2' ' A' ' 76' ' ' GLN . 36.0 mt -73.64 -29.54 62.4 Favored 'General case' 0 N--CA 1.474 0.748 0 O-C-N 123.407 0.442 . . . . 74.41 110.658 174.966 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 33.3 t70 -77.22 -43.49 33.4 Favored 'General case' 0 N--CA 1.48 1.055 0 O-C-N 123.907 0.754 . . . . 75.32 110.678 178.927 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 74' ' ' ASN . . . . . 0.431 ' HA ' HD22 ' A' ' 22' ' ' LEU . 82.7 m-20 -59.66 -49.57 77.25 Favored 'General case' 0 N--CA 1.472 0.638 0 CA-C-N 115.613 -0.721 . . . . 65.5 109.676 176.499 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . 0.43 ' HA ' ' HB2' ' A' ' 78' ' ' LEU . 25.5 tt0 -74.7 -23.1 58.55 Favored 'General case' 0 CA--C 1.552 1.027 0 CA-C-N 115.082 -0.963 . . . . 64.42 111.494 179.609 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 76' ' ' GLN . . . . . 0.433 ' HB2' ' O ' ' A' ' 72' ' ' LEU . 8.9 tt0 -58.88 -48.31 81.84 Favored 'General case' 0 N--CA 1.488 1.426 0 N-CA-C 109.085 -0.709 . . . . 72.42 109.085 172.283 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 82.6 mt -67.56 -43.72 79.97 Favored 'General case' 0 CA--C 1.548 0.869 0 CA-C-N 115.169 -0.923 . . . . 72.22 111.183 177.451 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . 0.673 HD21 ' HA ' ' A' ' 22' ' ' LEU . 61.1 mt -62.18 -58.75 6.61 Favored 'General case' 0 N--CA 1.486 1.343 0 C-N-CA 123.35 0.66 . . . . 74.32 112.474 -178.421 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 79' ' ' LYS . . . . . 0.612 ' HB3' ' HA ' ' A' ' 84' ' ' GLN . 46.3 mmtm -64.49 -34.47 78.29 Favored 'General case' 0 CA--C 1.553 1.08 0 C-N-CA 123.159 0.584 . . . . 72.24 110.611 176.794 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -62.5 -28.3 71.01 Favored Glycine 0 C--N 1.346 1.137 0 CA-C-N 116.695 -0.23 . . . . 72.2 112.928 175.396 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 8.6 tt -86.16 -47.13 9.76 Favored 'General case' 0 CA--C 1.545 0.769 0 C-N-CA 123.871 0.868 . . . . 72.45 109.728 175.281 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 50.4 mt -87.3 -66.15 0.94 Allowed 'General case' 0 N--CA 1.478 0.938 0 C-N-CA 123.682 0.793 . . . . 53.4 110.667 -166.415 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 2.0 mm100 -177.92 97.3 0.04 OUTLIER 'General case' 0 N--CA 1.475 0.786 0 C-N-CA 125.002 1.321 . . . . 73.12 108.91 -172.486 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 84' ' ' GLN . . . . . 0.612 ' HA ' ' HB3' ' A' ' 79' ' ' LYS . 7.2 tt0 -43.77 -53.98 5.51 Favored 'General case' 0 N--CA 1.491 1.583 0 C-N-CA 124.761 1.224 . . . . 75.5 111.492 172.27 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 85' ' ' ARG . . . . . . . . . . . . . 99.6 mtt180 -70.01 130.45 42.2 Favored 'General case' 0 CA--C 1.543 0.702 0 CA-C-N 114.517 -1.22 . . . . 64.54 108.979 170.339 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 72.8 mt -54.01 110.31 0.58 Allowed 'General case' 0 N--CA 1.478 0.938 0 C-N-CA 123.904 0.882 . . . . 74.21 110.527 -179.535 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 14.0 t70 -157.44 -62.15 0.09 Allowed 'General case' 0 CA--C 1.541 0.619 0 N-CA-C 109.303 -0.628 . . . . 74.22 109.303 -171.869 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 34.6 mm-40 -67.1 -42.49 84.49 Favored 'General case' 0 N--CA 1.486 1.33 0 C-N-CA 122.962 0.505 . . . . 75.55 110.69 172.709 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 90.5 mt -136.09 109.16 7.69 Favored 'General case' 0 CA--C 1.544 0.723 0 N-CA-C 107.576 -1.268 . . . . 63.45 107.576 176.131 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 90' ' ' SER . . . . . 0.465 ' O ' HD13 ' A' ' 41' ' ' LEU . 14.0 m -113.78 -89.23 0.54 Allowed 'General case' 0 N--CA 1.482 1.14 0 C-N-CA 123.112 0.565 . . . . 61.53 110.674 -176.351 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 22.1 t 50.64 26.12 2.34 Favored 'General case' 0 N--CA 1.499 1.976 0 C-N-CA 124.861 1.264 . . . . 64.3 114.314 174.867 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 92' ' ' LEU . . . . . 0.456 ' HG ' ' O ' ' A' ' 90' ' ' SER . 97.7 mt -124.67 -173.12 2.71 Favored 'General case' 0 N--CA 1.491 1.576 0 C-N-CA 123.582 0.753 . . . . 71.22 110.863 -178.487 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 60.4 mt -59.04 -71.61 0.1 Allowed 'Isoleucine or valine' 0 N--CA 1.482 1.146 0 C-N-CA 124.023 0.929 . . . . 75.41 111.768 -178.608 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -139.53 -123.26 2.05 Favored Glycine 0 C--N 1.346 1.135 0 N-CA-C 112.099 -0.401 . . . . 44.01 112.099 -173.949 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -88.46 148.2 24.29 Favored 'General case' 0 N--CA 1.477 0.91 0 C-N-CA 122.896 0.478 . . . . 73.33 109.881 176.099 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 70.2 p 52.26 -79.88 0.01 OUTLIER 'General case' 0 CA--C 1.559 1.289 0 C-N-CA 125.79 1.636 . . . . 63.13 111.972 -175.705 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 28.1 m 66.74 -80.35 0.03 OUTLIER 'General case' 0 CA--C 1.555 1.145 0 C-N-CA 125.188 1.395 . . . . 54.1 111.905 175.779 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 98' ' ' ARG . . . . . 0.47 ' HB2' HD13 ' A' ' 44' ' ' ILE . 0.0 OUTLIER -62.64 -43.9 97.64 Favored 'General case' 0 N--CA 1.488 1.446 0 N-CA-C 112.581 0.586 . . . . 71.13 112.581 -170.243 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 3.8 pt20 -70.5 -40.06 73.78 Favored 'General case' 0 N--CA 1.477 0.885 0 C-N-CA 122.61 0.364 . . . . 74.32 110.331 -174.768 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 23.6 tptm -66.9 -46.12 75.85 Favored 'General case' 0 CA--C 1.55 0.96 0 C-N-CA 124.144 0.978 . . . . 73.04 110.579 -179.498 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 31.4 t -72.68 -39.56 66.97 Favored 'General case' 0 N--CA 1.476 0.835 0 CA-C-N 115.155 -0.93 . . . . 70.45 111.546 -174.437 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 11.2 mp -78.39 -29.69 47.41 Favored 'General case' 0 N--CA 1.485 1.281 0 C-N-CA 122.684 0.394 . . . . 73.13 111.54 -179.838 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 50.1 t-20 -64.97 -45.85 83.96 Favored 'General case' 0 N--CA 1.482 1.13 0 N-CA-C 108.563 -0.903 . . . . 65.31 108.563 172.239 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 104' ' ' ASN . . . . . 0.404 ' O ' ' HD3' ' A' ' 108' ' ' ARG . 40.3 t-20 -59.71 -47.0 87.39 Favored 'General case' 0 N--CA 1.478 0.945 0 CA-C-N 115.269 -0.878 . . . . 71.34 109.557 176.017 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -63.87 -33.63 76.13 Favored 'General case' 0 CA--C 1.538 0.503 0 CA-C-N 115.112 -0.949 . . . . 73.53 111.627 -178.488 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 106' ' ' TYR . . . . . . . . . . . . . 3.9 t80 -70.54 -54.23 12.98 Favored 'General case' 0 N--CA 1.476 0.838 0 C-N-CA 122.897 0.479 . . . . 74.31 110.071 -179.063 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -62.64 -32.03 82.02 Favored Glycine 0 C--N 1.345 1.064 0 CA-C-N 115.512 -0.767 . . . . 74.43 112.573 -178.781 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 108' ' ' ARG . . . . . 0.539 ' HG2' ' HA ' ' A' ' 116' ' ' PRO . 9.7 mpt_? -83.28 -21.5 33.27 Favored 'General case' 0 C--O 1.217 -0.641 0 C-N-CA 122.935 0.494 . . . . 74.24 110.62 176.463 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 109' ' ' LEU . . . . . 0.525 HD13 ' HB2' ' A' ' 114' ' ' LEU . 43.9 tp -68.79 -31.18 70.0 Favored 'General case' 0 N--CA 1.494 1.728 0 CA-C-N 118.841 0.746 . . . . 55.03 109.603 170.633 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 25.7 t -72.81 -46.57 52.44 Favored 'General case' 0 CA--C 1.551 1.002 0 CA-C-N 115.382 -0.826 . . . . 60.5 110.205 170.592 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . -89.97 -63.0 1.27 Allowed Glycine 0 C--N 1.358 1.793 0 N-CA-C 115.67 1.028 . . . . 45.2 115.67 -172.201 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 112' ' ' MET . . . . . . . . . . . . . 54.8 mmm -92.67 -69.51 0.74 Allowed 'General case' 0 N--CA 1.49 1.542 0 CA-C-N 118.277 1.038 . . . . 72.12 113.683 -175.472 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 113' ' ' LEU . . . . . 0.405 ' HB3' HG22 ' A' ' 115' ' ' VAL . 15.2 tp 173.27 28.76 0.0 OUTLIER 'General case' 0 N--CA 1.492 1.629 0 C-N-CA 123.34 0.656 . . . . 62.42 109.673 -169.769 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 114' ' ' LEU . . . . . 0.525 ' HB2' HD13 ' A' ' 109' ' ' LEU . 6.3 tt 77.12 -22.47 0.28 Allowed 'General case' 0 N--CA 1.501 2.115 0 C-N-CA 125.454 1.502 . . . . 73.31 111.267 -172.394 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 115' ' ' VAL . . . . . 0.405 HG22 ' HB3' ' A' ' 113' ' ' LEU . 29.0 m -79.11 127.86 77.99 Favored Pre-proline 0 CA--C 1.557 1.23 0 C-N-CA 123.511 0.724 . . . . 71.34 110.352 179.795 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 116' ' ' PRO . . . . . 0.539 ' HA ' ' HG2' ' A' ' 108' ' ' ARG . 80.6 Cg_endo -77.86 157.7 31.2 Favored 'Trans proline' 0 C--N 1.377 2.034 0 C-N-CA 122.514 2.143 . . . . 73.23 112.244 176.498 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 13.3 t70 -100.79 -70.51 0.74 Allowed 'General case' 0 N--CA 1.472 0.646 0 N-CA-C 108.098 -1.075 . . . . 63.31 108.098 176.854 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -148.82 105.48 3.43 Favored Pre-proline 0 CA--C 1.555 1.138 0 C-N-CA 124.498 1.119 . . . . 61.01 108.583 178.111 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 119' ' ' PRO . . . . . . . . . . . . . 42.3 Cg_endo -64.7 150.17 88.59 Favored 'Trans proline' 0 C--N 1.378 2.095 0 C-N-CA 122.789 2.326 . . . . 72.1 112.718 -179.316 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . -155.53 84.27 0.14 Allowed Glycine 0 C--N 1.344 1.017 0 N-CA-C 111.848 -0.501 . . . . 40.14 111.848 -175.506 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . -145.16 -178.06 5.86 Favored 'General case' 0 N--CA 1.475 0.82 0 C-N-CA 124.127 0.971 . . . . 74.03 109.86 -179.542 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 122' ' ' SER . . . . . . . . . . . . . 40.3 m . . . . . 0 CA--C 1.553 1.061 0 N-CA-C 108.825 -0.806 . . . . 63.35 108.825 172.369 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . 0.49 ' SD ' ' HB ' ' A' ' 4' ' ' THR . 13.7 tpt . . . . . 0 N--CA 1.482 1.138 0 CA-C-O 119.272 -0.394 . . . . 65.11 111.217 . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 62.5 m -53.94 -47.4 71.29 Favored 'General case' 0 N--CA 1.489 1.498 0 C-N-CA 124.205 1.002 . . . . 71.25 112.572 -175.388 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 46.9 t -62.69 -38.25 89.68 Favored 'General case' 0 N--CA 1.481 1.124 0 C-N-CA 123.025 0.53 . . . . 50.32 110.656 177.347 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . 0.49 ' HB ' ' SD ' ' A' ' 1' ' ' MET . 11.9 m -69.35 -33.39 73.02 Favored 'General case' 0 CA--C 1.547 0.853 0 C-N-CA 123.508 0.723 . . . . 73.41 111.059 179.552 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 62.9 t -64.58 -48.56 84.39 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.175 0 C-N-CA 123.504 0.722 . . . . 70.13 109.837 177.376 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 26.7 mm-40 -62.29 -41.03 98.16 Favored 'General case' 0 N--CA 1.477 0.923 0 O-C-N 123.904 0.752 . . . . 74.0 110.896 175.753 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 65.2 t80 -60.99 -46.4 90.9 Favored 'General case' 0 CA--C 1.547 0.855 0 C-N-CA 124.487 1.115 . . . . 63.11 110.937 -176.608 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . 0.429 HG13 ' O ' ' A' ' 4' ' ' THR . 85.0 mt -62.14 -52.62 58.09 Favored 'Isoleucine or valine' 0 C--N 1.356 0.882 0 O-C-N 123.778 0.674 . . . . 74.31 109.559 175.906 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 28.4 t-20 -58.67 -34.29 71.08 Favored 'General case' 0 N--CA 1.481 1.118 0 O-C-N 124.177 0.923 . . . . 65.21 111.781 -174.762 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 99.2 mtt180 -78.19 -37.07 46.48 Favored 'General case' 0 N--CA 1.471 0.616 0 C-N-CA 123.039 0.535 . . . . 72.44 111.021 -179.8 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 11' ' ' TRP . . . . . . . . . . . . . 51.3 m95 -71.59 -25.8 62.33 Favored 'General case' 0 N--CA 1.484 1.226 0 N-CA-C 111.549 0.203 . . . . 74.35 111.549 172.518 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . 0.506 ' HG2' ' CE2' ' A' ' 67' ' ' TYR . 53.0 mt-30 -67.25 -44.81 78.49 Favored 'General case' 0 C--O 1.208 -1.101 0 N-CA-C 108.163 -1.051 . . . . 73.45 108.163 170.399 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 15.0 tpt180 -60.48 -44.17 96.19 Favored 'General case' 0 CA--C 1.545 0.762 0 O-C-N 124.152 0.908 . . . . 71.33 110.816 -177.042 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 14' ' ' ILE . . . . . 0.431 HD11 HG21 ' A' ' 47' ' ' VAL . 58.3 mt -68.32 -45.84 81.89 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.997 0 C-N-CA 122.601 0.36 . . . . 74.3 110.035 177.916 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . 0.579 ' HA ' ' HB ' ' A' ' 71' ' ' THR . . . -56.87 -49.0 76.81 Favored 'General case' 0 N--CA 1.484 1.251 0 C-N-CA 123.76 0.824 . . . . 64.02 111.551 -179.976 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 96.8 mt -73.33 -43.71 60.3 Favored 'General case' 0 N--CA 1.475 0.802 0 CA-C-N 114.422 -1.263 . . . . 71.45 110.675 -173.154 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.493 ' O ' ' HG ' ' A' ' 21' ' ' LEU . 40.7 mt -61.05 -53.53 56.03 Favored 'General case' 0 N--CA 1.481 1.077 0 O-C-N 123.606 0.566 . . . . 74.11 110.566 178.68 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 87.2 p -65.69 -33.55 76.14 Favored 'General case' 0 N--CA 1.478 0.953 0 O-C-N 123.682 0.614 . . . . 45.2 111.231 -176.04 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 6.7 tp-100 -69.11 -37.32 78.32 Favored 'General case' 0 N--CA 1.479 0.975 0 C-N-CA 122.845 0.458 . . . . 53.24 110.836 175.601 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 68.9 m -70.05 -33.24 71.7 Favored 'General case' 0 CA--C 1.539 0.542 0 CA-C-N 115.826 -0.624 . . . . 63.03 110.66 174.423 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . 0.622 HD22 ' HA ' ' A' ' 33' ' ' LEU . 50.5 mt -73.91 -29.2 61.93 Favored 'General case' 0 N--CA 1.474 0.755 0 C-N-CA 123.146 0.578 . . . . 65.14 110.044 178.294 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.709 ' HA ' HD21 ' A' ' 78' ' ' LEU . 50.3 tp -67.29 -48.46 67.58 Favored 'General case' 0 N--CA 1.47 0.545 0 C-N-CA 123.366 0.666 . . . . 71.41 109.357 174.425 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 38.3 mm-40 -51.06 -59.4 4.21 Favored 'General case' 0 N--CA 1.47 0.555 0 C-N-CA 124.169 0.988 . . . . 74.21 111.374 173.263 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 93.6 mt -59.09 -46.54 88.02 Favored 'General case' 0 CA--C 1.539 0.548 0 O-C-N 124.233 0.958 . . . . 55.4 111.358 -175.585 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . 0.525 ' HB2' HD21 ' A' ' 33' ' ' LEU . . . -60.06 -45.24 93.53 Favored 'General case' 0 N--CA 1.48 1.038 0 C-N-CA 123.413 0.685 . . . . 73.12 112.047 -177.915 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 97.1 mt-30 -67.04 -32.03 72.96 Favored 'General case' 0 N--CA 1.483 1.2 0 C-N-CA 123.169 0.587 . . . . 73.1 111.269 178.15 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 92.5 mtt-85 -83.97 -2.2 56.13 Favored 'General case' 0 N--CA 1.479 1.005 0 C-N-CA 123.591 0.757 . . . . 72.51 111.239 176.716 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 92.7 2.33 67.34 Favored Glycine 0 C--N 1.356 1.679 0 C-N-CA 123.37 0.509 . . . . 71.02 114.2 171.256 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 58.9 mm-40 -83.66 70.01 10.24 Favored 'General case' 0 CA--C 1.548 0.896 0 C-N-CA 124.123 0.969 . . . . 75.35 111.563 -179.827 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 30' ' ' TRP . . . . . . . . . . . . . 65.3 m95 -69.93 -39.31 76.19 Favored 'General case' 0 N--CA 1.482 1.173 0 C-N-CA 123.983 0.913 . . . . 72.33 111.628 -176.626 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 18.2 m-20 -62.06 -31.9 72.36 Favored 'General case' 0 N--CA 1.477 0.901 0 CA-C-N 115.517 -0.765 . . . . 74.53 111.001 -177.616 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 62.1 mt -70.69 -28.03 64.46 Favored 'General case' 0 CA--C 1.542 0.663 0 C-N-CA 122.569 0.347 . . . . 64.13 111.021 178.677 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . 0.622 ' HA ' HD22 ' A' ' 21' ' ' LEU . 10.1 mp -66.9 -47.55 71.43 Favored 'General case' 0 N--CA 1.493 1.69 0 C-N-CA 122.799 0.439 . . . . 70.55 109.913 169.724 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 80.2 mt -61.74 -33.62 74.37 Favored 'General case' 0 N--CA 1.481 1.118 0 O-C-N 124.282 0.989 . . . . 55.22 111.677 -178.777 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 35' ' ' GLN . . . . . 0.492 HE21 ' N ' ' A' ' 35' ' ' GLN . 0.0 OUTLIER -70.8 -55.9 7.54 Favored 'General case' 0 N--CA 1.477 0.905 0 C-N-CA 123.716 0.806 . . . . 62.43 109.58 175.396 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 36' ' ' GLN . . . . . 0.435 ' HB2' HD21 ' A' ' 21' ' ' LEU . 89.6 mm-40 -66.03 -12.69 56.99 Favored 'General case' 0 N--CA 1.482 1.128 0 O-C-N 123.84 0.713 . . . . 61.23 112.742 -176.873 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . 0.542 ' O ' ' HG ' ' A' ' 41' ' ' LEU . 43.3 tt0 -47.87 -40.41 21.47 Favored 'General case' 0 C--O 1.211 -0.95 0 C-N-CA 123.941 0.896 . . . . 73.12 111.656 172.87 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 43.1 t -58.22 -48.89 83.53 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.521 0 C-N-CA 123.052 0.541 . . . . 64.42 110.935 178.838 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 23.3 m -66.24 -38.96 89.15 Favored 'General case' 0 N--CA 1.475 0.786 0 CA-C-N 115.139 -0.937 . . . . 62.45 111.167 178.558 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 36.3 t80 -57.28 -52.05 66.9 Favored 'General case' 0 C--N 1.352 0.69 0 C-N-CA 124.887 1.275 . . . . 72.1 109.164 178.749 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . 0.542 ' HG ' ' O ' ' A' ' 37' ' ' GLU . 17.2 mt -59.38 -58.29 9.26 Favored 'General case' 0 C--N 1.363 1.193 0 O-C-N 124.702 1.251 . . . . 73.31 109.629 -178.601 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 48.1 tt0 -52.21 -49.61 63.58 Favored 'General case' 0 N--CA 1.476 0.828 0 O-C-N 123.994 0.809 . . . . 70.52 111.758 -174.094 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 36.9 m -64.85 -54.36 32.23 Favored 'General case' 0 CA--C 1.549 0.917 0 CA-C-N 115.991 -0.55 . . . . 73.01 111.859 -177.584 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 44' ' ' ILE . . . . . 0.554 HD11 HD11 ' A' ' 102' ' ' LEU . 14.1 tt -65.42 -36.23 77.2 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.105 0 C-N-CA 123.162 0.585 . . . . 64.31 111.238 -173.328 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 12.5 mm-40 -64.57 -47.36 79.02 Favored 'General case' 0 C--N 1.348 0.508 0 C-N-CA 123.773 0.829 . . . . 73.22 110.058 174.898 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 87.1 m -62.87 -26.1 68.61 Favored 'General case' 0 N--CA 1.477 0.902 0 O-C-N 123.443 0.464 . . . . 64.34 111.593 -179.314 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 47' ' ' VAL . . . . . 0.431 HG21 HD11 ' A' ' 14' ' ' ILE . 63.0 t -73.64 -54.05 16.29 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.008 0 O-C-N 122.173 -0.329 . . . . 72.5 110.906 172.831 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 48' ' ' MET . . . . . . . . . . . . . 70.4 mtm -72.22 -24.17 61.35 Favored 'General case' 0 N--CA 1.487 1.389 0 C-N-CA 123.104 0.562 . . . . 70.13 112.215 -171.324 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 32.7 mm-40 -82.34 -24.5 34.52 Favored 'General case' 0 N--CA 1.48 1.043 0 C-N-CA 123.96 0.904 . . . . 63.11 111.329 176.607 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 13.7 mptt -97.22 165.27 12.12 Favored 'General case' 0 N--CA 1.479 1.004 0 CA-C-O 121.802 0.81 . . . . 63.01 111.393 -175.663 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 8.5 tt0 -90.76 133.34 35.25 Favored 'General case' 0 C--O 1.24 0.594 0 CA-C-N 113.968 -1.469 . . . . 72.35 110.529 -172.81 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 89.9 m -78.26 127.94 79.67 Favored Pre-proline 0 CA--C 1.553 1.07 0 N-CA-C 108.755 -0.831 . . . . 63.11 108.755 169.754 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 57.0 Cg_endo -68.49 156.8 64.34 Favored 'Trans proline' 0 CA--C 1.562 1.901 0 C-N-CA 122.907 2.405 . . . . 65.31 112.574 176.996 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 7.6 Cg_exo -74.43 -50.06 0.16 Allowed 'Trans proline' 0 C--N 1.374 1.902 0 C-N-CA 122.798 2.332 . . . . 64.23 112.153 173.607 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . -80.86 72.64 2.68 Favored Glycine 0 C--N 1.349 1.274 0 CA-C-N 115.447 -0.797 . . . . 75.21 112.389 -177.141 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 70.0 mt -83.66 -85.01 0.08 OUTLIER 'Isoleucine or valine' 0 CA--C 1.559 1.291 0 N-CA-C 108.574 -0.898 . . . . 72.24 108.574 178.507 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 36.8 p 138.18 163.32 0.0 OUTLIER 'General case' 0 N--CA 1.495 1.794 0 C-N-CA 131.201 3.8 . . . . 73.51 107.165 167.342 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 46.0 tpt85 -60.28 -52.28 65.97 Favored 'General case' 0 CA--C 1.549 0.934 0 C-N-CA 123.82 0.848 . . . . 53.41 111.996 -174.084 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 43.4 m -63.95 -36.61 84.52 Favored 'General case' 0 N--CA 1.476 0.85 0 C-N-CA 123.426 0.691 . . . . 41.14 112.07 -178.646 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 78.1 mt -71.15 -35.17 57.48 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.645 0 CA-C-N 116.339 -0.392 . . . . 74.42 110.06 178.038 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 61' ' ' GLN . . . . . 0.404 HE22 ' HB2' ' A' ' 121' ' ' ALA . 57.7 tt0 -60.88 -38.77 86.78 Favored 'General case' 0 CA--C 1.543 0.693 0 C-N-CA 123.123 0.569 . . . . 73.35 109.899 175.05 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 44.4 m-20 -65.35 -42.69 92.56 Favored 'General case' 0 N--CA 1.479 0.987 0 CA-C-N 115.909 -0.587 . . . . 73.43 112.045 175.088 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 63' ' ' MET . . . . . . . . . . . . . 71.3 mtm -68.18 -49.36 61.4 Favored 'General case' 0 N--CA 1.484 1.259 0 C-N-CA 122.566 0.346 . . . . 53.42 111.6 -178.933 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 64' ' ' VAL . . . . . 0.455 ' O ' HG13 ' A' ' 68' ' ' ILE . 70.8 t -60.14 -56.91 14.37 Favored 'Isoleucine or valine' 0 C--N 1.35 0.607 0 C-N-CA 123.879 0.872 . . . . 60.54 110.675 177.518 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -62.38 -28.2 69.61 Favored 'General case' 0 N--CA 1.489 1.498 0 O-C-N 123.405 0.44 . . . . 64.33 111.282 -179.848 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -63.65 -42.73 98.64 Favored Glycine 0 C--N 1.347 1.154 0 N-CA-C 111.753 -0.539 . . . . 55.32 111.753 172.608 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 67' ' ' TYR . . . . . 0.506 ' CE2' ' HG2' ' A' ' 12' ' ' GLN . 17.1 m-30 -79.59 -27.24 41.12 Favored 'General case' 0 N--CA 1.48 1.051 0 N-CA-C 112.855 0.687 . . . . 74.03 112.855 -179.621 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 68' ' ' ILE . . . . . 0.525 ' O ' ' HG ' ' A' ' 72' ' ' LEU . 38.9 mt -66.29 -49.59 74.63 Favored 'Isoleucine or valine' 0 C--N 1.35 0.592 0 N-CA-C 107.405 -1.331 . . . . 35.42 107.405 171.581 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 69' ' ' LYS . . . . . 0.659 ' HB2' ' HE2' ' A' ' 106' ' ' TYR . 0.3 OUTLIER -54.78 -46.75 74.46 Favored 'General case' 0 C--N 1.356 0.872 0 O-C-N 123.989 0.805 . . . . 71.23 110.619 177.66 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 62.0 tt0 -57.43 -51.11 70.75 Favored 'General case' 0 C--N 1.349 0.569 0 O-C-N 124.926 1.391 . . . . 71.34 110.506 -178.843 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 71' ' ' THR . . . . . 0.579 ' HB ' ' HA ' ' A' ' 15' ' ' ALA . 12.8 t -72.57 -19.67 61.45 Favored 'General case' 0 C--O 1.215 -0.757 0 CA-C-O 118.566 -0.731 . . . . 73.11 111.607 -179.199 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 72' ' ' LEU . . . . . 0.716 HD21 ' HB3' ' A' ' 102' ' ' LEU . 17.0 mt -79.74 -28.78 40.44 Favored 'General case' 0 N--CA 1.49 1.566 0 C-N-CA 122.945 0.498 . . . . 70.32 111.499 174.559 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 29.8 m-20 -65.53 -53.24 45.07 Favored 'General case' 0 N--CA 1.473 0.719 0 N-CA-C 107.882 -1.155 . . . . 62.24 107.882 170.519 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 35.0 m-20 -61.54 -33.53 73.99 Favored 'General case' 0 N--CA 1.477 0.879 0 CA-C-N 114.666 -1.152 . . . . 64.1 110.961 179.553 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . 0.455 ' O ' ' HG2' ' A' ' 79' ' ' LYS . 27.2 tp10 -61.84 -60.63 3.36 Favored 'General case' 0 N--CA 1.474 0.737 0 C-N-CA 124.238 1.015 . . . . 73.01 109.455 176.876 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 10.3 tt0 -63.5 -36.34 83.45 Favored 'General case' 0 CA--C 1.545 0.787 0 CA-C-N 116.108 -0.496 . . . . 72.23 111.862 -175.715 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . 0.431 ' O ' ' HB2' ' A' ' 81' ' ' LEU . 93.1 mt -68.22 -54.42 17.92 Favored 'General case' 0 N--CA 1.471 0.594 0 C-N-CA 122.84 0.456 . . . . 72.24 110.537 -179.281 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . 0.709 HD21 ' HA ' ' A' ' 22' ' ' LEU . 51.0 mt -62.24 -52.66 62.84 Favored 'General case' 0 N--CA 1.484 1.248 0 C-N-CA 122.979 0.512 . . . . 71.4 112.08 -178.532 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 79' ' ' LYS . . . . . 0.455 ' HG2' ' O ' ' A' ' 75' ' ' GLU . 26.3 mmtp -73.87 -28.08 61.39 Favored 'General case' 0 N--CA 1.476 0.86 0 O-C-N 123.716 0.635 . . . . 73.31 110.805 -173.81 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -75.42 -24.19 71.38 Favored Glycine 0 C--N 1.344 1.019 0 CA-C-N 116.02 -0.536 . . . . 64.31 112.287 171.285 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . 0.431 ' HB2' ' O ' ' A' ' 77' ' ' LEU . 5.1 tt -80.51 -41.96 23.33 Favored 'General case' 0 N--CA 1.475 0.791 0 C-N-CA 123.662 0.785 . . . . 71.41 109.829 178.087 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 96.4 mt -70.47 -65.55 0.72 Allowed 'General case' 0 N--CA 1.475 0.799 0 N-CA-C 109.754 -0.461 . . . . 71.21 109.754 -173.131 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 66.9 mm-40 -129.75 -74.21 0.55 Allowed 'General case' 0 N--CA 1.473 0.687 0 N-CA-C 108.518 -0.919 . . . . 74.31 108.518 179.3 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 21.7 tp60 174.88 105.83 0.02 OUTLIER 'General case' 0 N--CA 1.479 1.014 0 C-N-CA 124.461 1.104 . . . . 75.21 108.977 -177.354 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 85' ' ' ARG . . . . . 0.563 ' HG3' ' H ' ' A' ' 86' ' ' LEU . 4.3 ptp180 34.38 -77.05 0.0 OUTLIER 'General case' 0 N--CA 1.499 2.025 0 C-N-CA 126.898 2.079 . . . . 61.0 114.792 -179.859 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 86' ' ' LEU . . . . . 0.563 ' H ' ' HG3' ' A' ' 85' ' ' ARG . 63.4 mt -73.49 101.57 3.57 Favored 'General case' 0 N--CA 1.477 0.887 0 CA-C-N 119.096 0.862 . . . . 73.02 109.461 175.969 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 40.2 p-10 -170.05 -151.41 0.08 Allowed 'General case' 0 N--CA 1.486 1.359 0 N-CA-C 112.373 0.509 . . . . 51.33 112.373 -173.963 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 43.3 mt-10 -49.86 160.93 0.28 Allowed 'General case' 0 N--CA 1.481 1.112 0 C-N-CA 126.282 1.833 . . . . 73.1 114.182 178.153 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . 0.434 ' HB2' ' HE2' ' A' ' 79' ' ' LYS . 65.4 mt 63.95 25.14 13.84 Favored 'General case' 0 N--CA 1.48 1.047 0 C-N-CA 125.107 1.363 . . . . 70.34 110.764 -176.868 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 45.7 t -94.07 -92.76 0.18 Allowed 'General case' 0 C--N 1.349 0.585 0 N-CA-C 107.918 -1.141 . . . . 61.3 107.918 175.644 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 35.8 p 43.79 25.28 0.09 Allowed 'General case' 0 N--CA 1.488 1.443 0 C-N-CA 124.88 1.272 . . . . 64.43 113.761 -175.552 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 80.3 mt -89.23 -72.67 0.54 Allowed 'General case' 0 C--N 1.355 0.842 0 N-CA-C 107.946 -1.131 . . . . 71.32 107.946 178.594 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 93' ' ' ILE . . . . . 0.482 HG22 ' HG2' ' A' ' 95' ' ' GLN . 43.8 mt -128.24 138.02 55.82 Favored 'Isoleucine or valine' 0 C--O 1.241 0.625 0 N-CA-C 107.53 -1.285 . . . . 73.41 107.53 177.383 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -63.08 -30.59 77.94 Favored Glycine 0 C--N 1.353 1.481 0 O-C-N 124.114 0.884 . . . . 64.14 114.362 -171.671 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 95' ' ' GLN . . . . . 0.482 ' HG2' HG22 ' A' ' 93' ' ' ILE . 30.0 pt20 -73.12 -0.29 13.68 Favored 'General case' 0 N--CA 1.486 1.343 0 C-N-CA 123.338 0.655 . . . . 74.45 112.407 178.437 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 20.9 m 66.12 30.27 9.48 Favored 'General case' 0 C--N 1.358 0.96 0 C-N-CA 124.987 1.315 . . . . 75.13 111.978 171.503 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 14.9 t -74.6 14.11 0.52 Allowed 'General case' 0 N--CA 1.481 1.106 0 C-N-CA 123.679 0.792 . . . . 72.24 112.923 -176.265 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 98' ' ' ARG . . . . . 0.401 ' O ' HD13 ' A' ' 102' ' ' LEU . 60.6 ttp180 -53.57 -53.09 56.7 Favored 'General case' 0 N--CA 1.476 0.857 0 C-N-CA 124.377 1.071 . . . . 63.24 111.622 179.145 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 99' ' ' GLN . . . . . 0.409 HE22 ' HG3' ' A' ' 75' ' ' GLU . 9.7 mm100 -61.94 -47.0 86.87 Favored 'General case' 0 N--CA 1.479 0.997 0 CA-C-O 121.488 0.661 . . . . 70.13 109.63 -176.76 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 38.9 ttmt -62.36 -40.53 96.73 Favored 'General case' 0 CA--C 1.54 0.584 0 CA-C-N 113.781 -1.554 . . . . 61.34 111.729 -178.385 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 38.7 t -71.95 -44.37 63.7 Favored 'General case' 0 N--CA 1.474 0.737 0 C-N-CA 123.753 0.821 . . . . 55.52 110.942 -172.464 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 102' ' ' LEU . . . . . 0.716 ' HB3' HD21 ' A' ' 72' ' ' LEU . 8.9 mp -72.08 -37.57 69.57 Favored 'General case' 0 CA--C 1.546 0.819 0 CA-C-N 115.314 -0.857 . . . . 51.14 110.682 -179.662 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 9.8 t30 -68.82 -31.9 71.21 Favored 'General case' 0 N--CA 1.48 1.051 0 CA-C-N 115.698 -0.683 . . . . 74.52 110.503 176.176 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 49.0 t30 -74.47 -36.11 63.3 Favored 'General case' 0 N--CA 1.482 1.173 0 C-N-CA 123.596 0.759 . . . . 52.52 110.017 176.947 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -61.21 -49.59 76.52 Favored 'General case' 0 N--CA 1.475 0.794 0 C-N-CA 123.057 0.543 . . . . 53.03 110.134 177.4 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 106' ' ' TYR . . . . . 0.659 ' HE2' ' HB2' ' A' ' 69' ' ' LYS . 1.7 t80 -63.85 -48.88 74.97 Favored 'General case' 0 C--N 1.354 0.795 0 O-C-N 123.993 0.808 . . . . 72.35 109.472 175.62 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -56.93 -38.3 83.91 Favored Glycine 0 C--N 1.35 1.31 0 O-C-N 124.017 0.823 . . . . 35.42 113.772 -173.691 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 70.8 mtm180 -75.63 -42.82 50.61 Favored 'General case' 0 C--O 1.239 0.545 0 C-N-CA 123.386 0.674 . . . . 75.03 110.533 176.767 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 32.7 tp -61.82 -28.27 69.35 Favored 'General case' 0 N--CA 1.491 1.578 0 C-N-CA 123.141 0.576 . . . . 72.13 110.894 177.251 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 39.5 t -83.08 -38.62 22.26 Favored 'General case' 0 N--CA 1.452 -0.363 0 CA-C-N 114.711 -1.131 . . . . 62.21 109.449 178.144 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . -79.09 -64.99 1.85 Allowed Glycine 0 C--N 1.356 1.643 0 CA-C-O 119.214 -0.77 . . . . 50.13 113.558 -173.228 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 112' ' ' MET . . . . . 0.675 ' HA ' ' HA2' ' A' ' 120' ' ' GLY . 0.0 OUTLIER -99.32 -66.53 0.9 Allowed 'General case' 0 N--CA 1.485 1.3 0 CA-C-N 118.793 1.297 . . . . 70.21 109.525 172.637 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER 170.43 27.31 0.0 OUTLIER 'General case' 0 CA--C 1.573 1.831 0 O-C-N 124.712 1.258 . . . . 74.02 109.626 -171.633 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER 76.86 -22.18 0.29 Allowed 'General case' 0 N--CA 1.501 2.109 0 C-N-CA 125.92 1.688 . . . . 72.04 111.368 -178.324 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 115' ' ' VAL . . . . . . . . . . . . . 33.9 m -124.48 144.51 46.28 Favored Pre-proline 0 C--O 1.247 0.923 0 C-N-CA 124.33 1.052 . . . . 61.44 109.31 -174.866 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 17.8 Cg_exo -68.07 167.29 22.18 Favored 'Trans proline' 0 C--N 1.367 1.545 0 C-N-CA 122.53 2.153 . . . . 63.01 111.606 173.506 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 16.2 m-20 65.36 27.52 11.93 Favored 'General case' 0 N--CA 1.486 1.329 0 C-N-CA 124.31 1.044 . . . . 72.15 110.967 178.806 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -126.3 137.67 30.75 Favored Pre-proline 0 N--CA 1.473 0.705 0 C-N-CA 124.138 0.975 . . . . 65.21 109.617 -178.508 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 119' ' ' PRO . . . . . . . . . . . . . 38.2 Cg_endo -64.2 132.8 35.32 Favored 'Trans proline' 0 C--N 1.377 2.067 0 C-N-CA 122.58 2.187 . . . . 75.42 111.512 -175.252 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 120' ' ' GLY . . . . . 0.675 ' HA2' ' HA ' ' A' ' 112' ' ' MET . . . -59.96 123.59 33.57 Favored Glycine 0 C--N 1.349 1.272 0 O-C-N 124.284 0.99 . . . . 53.33 114.057 -171.077 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 121' ' ' ALA . . . . . 0.404 ' HB2' HE22 ' A' ' 61' ' ' GLN . . . -76.46 175.11 9.5 Favored 'General case' 0 N--CA 1.473 0.695 0 C-N-CA 123.809 0.844 . . . . 50.32 111.607 178.181 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 122' ' ' SER . . . . . . . . . . . . . 20.3 m . . . . . 0 C--O 1.253 1.262 0 CA-C-O 118.547 -0.739 . . . . 64.23 109.482 -178.904 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 25.9 ttt . . . . . 0 CA--C 1.555 1.162 0 CA-C-O 119.621 -0.228 . . . . 73.5 110.906 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 4.6 p -53.85 -35.33 61.39 Favored 'General case' 0 N--CA 1.489 1.477 0 C-N-CA 123.501 0.72 . . . . 70.44 112.471 -178.957 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 63.5 p -62.22 -48.07 81.62 Favored 'General case' 0 N--CA 1.48 1.069 0 C-N-CA 123.701 0.8 . . . . 72.32 110.555 176.524 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 22.1 m -66.26 -37.63 85.93 Favored 'General case' 0 CA--C 1.54 0.594 0 CA-C-N 115.023 -0.99 . . . . 75.13 111.194 -179.876 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 78.1 t -65.75 -44.63 93.11 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.936 0 C-N-CA 123.192 0.597 . . . . 54.1 110.433 -179.175 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 11.7 mm-40 -61.54 -41.57 97.54 Favored 'General case' 0 C--N 1.353 0.761 0 O-C-N 123.581 0.551 . . . . 73.43 110.703 173.782 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 44.6 t80 -63.05 -47.85 81.18 Favored 'General case' 0 N--CA 1.481 1.101 0 C-N-CA 123.852 0.861 . . . . 75.44 111.439 -176.958 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . 0.434 HD11 HG23 ' A' ' 60' ' ' ILE . 73.1 mt -65.0 -41.54 92.37 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.033 0 C-N-CA 123.682 0.793 . . . . 74.1 109.541 177.472 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 4.0 t-20 -65.76 -29.15 69.62 Favored 'General case' 0 N--CA 1.479 1.022 0 C-N-CA 123.756 0.822 . . . . 72.51 111.104 179.23 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . 0.749 ' HB3' HG22 ' A' ' 47' ' ' VAL . 57.6 mtt180 -78.55 -30.64 46.99 Favored 'General case' 0 N--CA 1.469 0.477 0 C-N-CA 123.689 0.796 . . . . 74.13 110.381 177.431 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 11' ' ' TRP . . . . . 0.479 ' HH2' ' HG ' ' A' ' 102' ' ' LEU . 76.8 m95 -74.98 -27.57 60.21 Favored 'General case' 0 N--CA 1.477 0.902 0 CA-C-O 119.492 -0.29 . . . . 61.13 110.945 170.381 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . 0.426 ' HG3' ' O ' ' A' ' 8' ' ' ILE . 51.5 mt-30 -64.49 -44.18 91.8 Favored 'General case' 0 C--O 1.212 -0.896 0 N-CA-C 107.744 -1.206 . . . . 64.14 107.744 168.959 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 30.9 tpt180 -59.04 -50.98 72.02 Favored 'General case' 0 CA--C 1.547 0.862 0 O-C-N 124.087 0.867 . . . . 74.35 110.689 -177.222 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 56.4 mt -63.97 -49.53 81.26 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.313 0 C-N-CA 122.666 0.387 . . . . 63.52 110.335 179.187 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . 0.558 ' HA ' ' HB ' ' A' ' 71' ' ' THR . . . -59.06 -43.51 91.72 Favored 'General case' 0 N--CA 1.485 1.31 0 C-N-CA 123.864 0.865 . . . . 71.02 112.115 -176.373 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 95.1 mt -77.41 -39.6 46.49 Favored 'General case' 0 N--CA 1.481 1.082 0 CA-C-N 115.248 -0.887 . . . . 75.34 110.658 -174.848 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.509 ' O ' ' HG ' ' A' ' 21' ' ' LEU . 53.9 mt -64.45 -47.04 80.55 Favored 'General case' 0 N--CA 1.483 1.186 0 O-C-N 123.302 0.377 . . . . 75.23 110.511 179.718 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . 0.424 ' HB3' ' CE1' ' A' ' 40' ' ' TYR . 71.7 p -68.65 -35.5 77.34 Favored 'General case' 0 N--CA 1.477 0.882 0 O-C-N 123.768 0.667 . . . . 71.51 111.143 178.592 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 19' ' ' GLN . . . . . 0.491 ' O ' ' HG2' ' A' ' 23' ' ' GLU . 6.3 tp-100 -62.41 -41.17 98.48 Favored 'General case' 0 C--N 1.357 0.913 0 O-C-N 123.586 0.554 . . . . 74.41 109.878 174.702 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 68.6 m -63.37 -49.19 74.81 Favored 'General case' 0 C--N 1.352 0.702 0 O-C-N 123.818 0.699 . . . . 71.34 109.288 175.564 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . 0.509 ' HG ' ' O ' ' A' ' 17' ' ' LEU . 83.8 mt -57.22 -31.53 65.59 Favored 'General case' 0 N--CA 1.479 1.016 0 C-N-CA 123.811 0.844 . . . . 64.33 110.665 179.995 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.553 ' HA ' HD21 ' A' ' 78' ' ' LEU . 37.9 tp -73.33 -52.45 13.84 Favored 'General case' 0 CA--C 1.543 0.674 0 O-C-N 123.862 0.727 . . . . 64.24 110.727 178.491 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . 0.573 ' HB3' ' NH1' ' A' ' 27' ' ' ARG . 46.5 mm-40 -51.79 -55.2 21.21 Favored 'General case' 0 N--CA 1.491 1.586 0 CA-C-O 122.159 0.981 . . . . 72.12 110.454 177.734 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 70.4 mt -56.36 -51.36 68.59 Favored 'General case' 0 CA--C 1.545 0.77 0 CA-C-N 112.878 -1.965 . . . . 74.32 110.425 179.79 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . 0.504 ' HB2' HD21 ' A' ' 33' ' ' LEU . . . -60.91 -41.52 96.26 Favored 'General case' 0 N--CA 1.49 1.527 0 C-N-CA 123.396 0.679 . . . . 70.42 112.68 -175.962 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 94.6 mt-30 -64.51 -38.22 90.27 Favored 'General case' 0 N--CA 1.478 0.943 0 C-N-CA 123.537 0.735 . . . . 71.3 110.264 179.265 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . 0.573 ' NH1' ' HB3' ' A' ' 23' ' ' GLU . 58.0 mtt180 -81.65 -15.66 53.85 Favored 'General case' 0 N--CA 1.488 1.453 0 N-CA-C 112.306 0.484 . . . . 71.23 112.306 175.517 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 88.79 24.93 31.21 Favored Glycine 0 C--N 1.349 1.305 0 N-CA-C 114.527 0.571 . . . . 74.55 114.527 177.417 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 49.7 mm-40 -84.33 60.55 6.05 Favored 'General case' 0 N--CA 1.477 0.895 0 C-N-CA 124.239 1.016 . . . . 64.22 110.699 175.491 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 30' ' ' TRP . . . . . 0.471 ' O ' ' HG ' ' A' ' 34' ' ' LEU . 88.5 m95 -66.17 -30.57 71.07 Favored 'General case' 0 N--CA 1.477 0.88 0 C-N-CA 123.911 0.884 . . . . 74.54 112.575 -171.952 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 4.8 m-20 -61.18 -40.64 94.65 Favored 'General case' 0 N--CA 1.483 1.197 0 C-N-CA 123.332 0.653 . . . . 74.41 110.563 175.642 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 64.2 mt -71.6 -26.54 62.63 Favored 'General case' 0 CA--C 1.543 0.683 0 CA-C-N 115.211 -0.904 . . . . 61.02 110.396 179.842 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . 0.504 HD21 ' HB2' ' A' ' 25' ' ' ALA . 7.6 mp -66.29 -44.59 83.11 Favored 'General case' 0 N--CA 1.489 1.492 0 N-CA-C 110.476 -0.194 . . . . 62.54 110.476 169.039 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.471 ' HG ' ' O ' ' A' ' 30' ' ' TRP . 83.0 mt -63.63 -34.53 78.04 Favored 'General case' 0 N--CA 1.48 1.058 0 O-C-N 123.896 0.747 . . . . 74.44 111.124 -178.548 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 96.8 mt-30 -65.71 -58.04 6.62 Favored 'General case' 0 N--CA 1.483 1.186 0 CA-C-O 121.168 0.508 . . . . 63.41 110.033 174.687 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 36' ' ' GLN . . . . . 0.422 ' HB2' HD21 ' A' ' 21' ' ' LEU . 80.1 mm-40 -73.82 -10.39 59.62 Favored 'General case' 0 N--CA 1.477 0.896 0 CA-C-N 114.885 -1.052 . . . . 54.11 112.654 -174.207 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 37.1 tt0 -53.38 -52.31 59.7 Favored 'General case' 0 N--CA 1.475 0.79 0 C-N-CA 124.591 1.156 . . . . 73.44 110.692 175.224 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 46.8 t -58.7 -43.97 88.89 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.141 0 O-C-N 123.76 0.662 . . . . 75.23 110.179 -179.18 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 42.7 m -56.95 -53.23 60.4 Favored 'General case' 0 CA--C 1.546 0.809 0 CA-C-N 115.403 -0.817 . . . . 74.2 111.631 176.211 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 40' ' ' TYR . . . . . 0.424 ' CE1' ' HB3' ' A' ' 18' ' ' SER . 58.2 t80 -63.0 -49.62 73.94 Favored 'General case' 0 N--CA 1.474 0.758 0 C-N-CA 123.797 0.839 . . . . 71.55 111.159 -173.502 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . 0.763 ' HB3' HD21 ' A' ' 92' ' ' LEU . 72.2 mt -60.23 -48.34 82.15 Favored 'General case' 0 C--O 1.257 1.486 0 C-N-CA 124.48 1.112 . . . . 72.12 111.285 -178.022 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 49.8 tt0 -61.07 -44.03 98.0 Favored 'General case' 0 N--CA 1.475 0.786 0 CA-C-N 115.557 -0.747 . . . . 73.15 110.43 -179.85 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . 0.518 ' O ' HG23 ' A' ' 47' ' ' VAL . 69.4 m -60.94 -57.7 11.56 Favored 'General case' 0 C--N 1.354 0.767 0 CA-C-N 115.378 -0.828 . . . . 73.42 111.442 -178.511 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 3.9 tt -58.38 -41.22 80.84 Favored 'Isoleucine or valine' 0 C--O 1.251 1.156 0 C-N-CA 123.266 0.626 . . . . 72.15 111.375 -174.682 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . 0.406 ' CG ' HD22 ' A' ' 92' ' ' LEU . 40.9 mm-40 -59.19 -49.8 76.47 Favored 'General case' 0 C--N 1.367 1.333 0 N-CA-C 111.542 0.201 . . . . 75.11 111.542 173.442 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 46' ' ' THR . . . . . 0.49 ' O ' ' HD3' ' A' ' 50' ' ' LYS . 97.3 m -55.72 -41.78 74.36 Favored 'General case' 0 N--CA 1.482 1.155 0 O-C-N 123.958 0.786 . . . . 55.45 111.617 -178.292 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 47' ' ' VAL . . . . . 0.749 HG22 ' HB3' ' A' ' 10' ' ' ARG . 26.2 t -70.05 -37.71 73.04 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.997 0 C-N-CA 122.884 0.474 . . . . 73.33 110.623 -177.94 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 48' ' ' MET . . . . . . . . . . . . . 79.1 mtm -72.22 -19.93 61.64 Favored 'General case' 0 N--CA 1.481 1.113 0 CA-C-N 116.183 -0.462 . . . . 71.21 111.76 175.375 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 48.2 mt-10 -83.02 -7.47 59.66 Favored 'General case' 0 N--CA 1.49 1.57 0 C-N-CA 123.285 0.634 . . . . 74.11 111.759 172.918 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . 0.49 ' HD3' ' O ' ' A' ' 46' ' ' THR . 12.7 mptt -95.44 132.0 40.98 Favored 'General case' 0 N--CA 1.482 1.169 0 C-N-CA 123.485 0.714 . . . . 72.52 110.235 177.691 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 34.2 tt0 -68.57 151.99 45.99 Favored 'General case' 0 C--O 1.247 0.923 0 C-N-CA 123.524 0.729 . . . . 74.5 109.389 172.787 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 20.0 m -59.69 118.85 35.3 Favored Pre-proline 0 CA--C 1.556 1.185 0 CA-C-O 118.744 -0.646 . . . . 73.32 109.792 173.471 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 53' ' ' PRO . . . . . 0.511 ' HD2' HD11 ' A' ' 56' ' ' ILE . 31.6 Cg_exo -62.72 153.62 71.1 Favored 'Trans proline' 0 C--N 1.377 2.075 0 C-N-CA 122.602 2.202 . . . . 55.12 112.79 177.844 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 54' ' ' PRO . . . . . 0.445 ' HD3' ' HA ' ' A' ' 53' ' ' PRO . 22.7 Cg_exo -66.98 -47.98 2.14 Favored 'Trans proline' 0 C--N 1.373 1.861 0 C-N-CA 123.199 2.599 . . . . 73.35 112.506 177.591 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . -83.94 59.86 4.91 Favored Glycine 0 C--N 1.346 1.092 0 CA-C-N 115.966 -0.561 . . . . 62.33 114.07 -173.233 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 56' ' ' ILE . . . . . 0.511 HD11 ' HD2' ' A' ' 53' ' ' PRO . 56.1 mt -100.72 116.23 43.79 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.763 0 N-CA-C 108.133 -1.062 . . . . 44.44 108.133 169.971 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 57' ' ' THR . . . . . 0.423 ' H ' HD12 ' A' ' 60' ' ' ILE . 71.6 p -101.73 -166.88 1.34 Allowed 'General case' 0 CA--C 1.545 0.763 0 C-N-CA 124.178 0.991 . . . . 62.32 109.523 177.634 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 16.6 tpt85 -61.25 -63.42 1.29 Allowed 'General case' 0 N--CA 1.474 0.773 0 C-N-CA 123.715 0.806 . . . . 75.11 111.017 -179.828 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 26.0 m -54.73 -38.0 66.6 Favored 'General case' 0 N--CA 1.482 1.142 0 C-N-CA 123.482 0.713 . . . . 62.02 111.778 -178.41 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 60' ' ' ILE . . . . . 0.434 HG23 HD11 ' A' ' 8' ' ' ILE . 80.2 mt -63.51 -46.72 94.35 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.703 0 C-N-CA 123.481 0.712 . . . . 72.14 110.655 178.079 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 61' ' ' GLN . . . . . 0.535 ' HG3' ' HG ' ' A' ' 109' ' ' LEU . 50.9 tt0 -61.77 -39.35 91.36 Favored 'General case' 0 N--CA 1.476 0.849 0 C-N-CA 123.073 0.549 . . . . 63.25 111.106 179.896 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 9.0 m-20 -69.15 -37.42 78.23 Favored 'General case' 0 N--CA 1.479 1.002 0 C-N-CA 123.175 0.59 . . . . 74.02 111.944 179.298 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 63' ' ' MET . . . . . . . . . . . . . 72.1 mtm -68.42 -49.79 57.46 Favored 'General case' 0 N--CA 1.48 1.029 0 C-N-CA 122.41 0.284 . . . . 74.05 110.564 177.477 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 64' ' ' VAL . . . . . 0.513 ' O ' HG13 ' A' ' 68' ' ' ILE . 60.6 t -60.49 -59.76 3.65 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.664 0 C-N-CA 123.873 0.869 . . . . 71.04 110.216 -179.87 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . 0.568 ' HB2' HD23 ' A' ' 109' ' ' LEU . . . -60.36 -38.56 84.23 Favored 'General case' 0 N--CA 1.483 1.179 0 O-C-N 123.635 0.584 . . . . 64.02 111.571 -179.24 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -58.59 -42.36 96.06 Favored Glycine 0 C--N 1.35 1.307 0 O-C-N 123.218 0.324 . . . . 70.03 112.457 175.961 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 67' ' ' TYR . . . . . 0.428 ' O ' HG22 ' A' ' 71' ' ' THR . 12.3 m-85 -70.35 -36.26 74.08 Favored 'General case' 0 N--CA 1.473 0.702 0 C-N-CA 123.083 0.553 . . . . 72.12 111.681 177.007 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 68' ' ' ILE . . . . . 0.513 HG13 ' O ' ' A' ' 64' ' ' VAL . 65.0 mt -60.02 -56.61 16.31 Favored 'Isoleucine or valine' 0 C--N 1.361 1.072 0 N-CA-C 108.852 -0.796 . . . . 75.23 108.852 177.785 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 69' ' ' LYS . . . . . 0.498 ' HB2' ' HE2' ' A' ' 106' ' ' TYR . 28.3 tptp -53.69 -47.27 70.63 Favored 'General case' 0 C--N 1.354 0.771 0 O-C-N 124.283 0.989 . . . . 75.42 110.001 179.997 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 59.8 tt0 -58.93 -48.04 82.89 Favored 'General case' 0 C--N 1.35 0.603 0 O-C-N 124.653 1.221 . . . . 75.35 111.364 -176.292 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 71' ' ' THR . . . . . 0.558 ' HB ' ' HA ' ' A' ' 15' ' ' ALA . 10.5 t -76.99 -22.68 52.79 Favored 'General case' 0 N--CA 1.475 0.805 0 O-C-N 123.433 0.458 . . . . 63.45 111.234 -175.949 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 72' ' ' LEU . . . . . 0.512 ' HG ' ' O ' ' A' ' 68' ' ' ILE . 21.1 mt -74.08 -34.81 64.12 Favored 'General case' 0 N--CA 1.476 0.845 0 O-C-N 123.261 0.351 . . . . 63.31 110.261 173.756 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 73' ' ' ASP . . . . . 0.443 ' HA ' HE21 ' A' ' 76' ' ' GLN . 73.4 m-20 -75.39 -38.44 59.94 Favored 'General case' 0 N--CA 1.473 0.679 0 O-C-N 124.092 0.87 . . . . 73.02 110.535 176.492 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 74' ' ' ASN . . . . . 0.424 ' O ' ' HG ' ' A' ' 78' ' ' LEU . 92.4 m-20 -60.25 -51.87 67.71 Favored 'General case' 0 N--CA 1.48 1.068 0 N-CA-C 109.112 -0.699 . . . . 73.2 109.112 176.819 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 5.4 tt0 -59.95 -42.83 94.9 Favored 'General case' 0 C--N 1.356 0.872 0 CA-C-N 115.518 -0.764 . . . . 75.23 110.869 176.031 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 76' ' ' GLN . . . . . 0.443 HE21 ' HA ' ' A' ' 73' ' ' ASP . 7.8 tt0 -57.09 -43.84 82.6 Favored 'General case' 0 N--CA 1.486 1.337 0 C-N-CA 123.985 0.914 . . . . 72.0 111.415 -179.201 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 94.5 mt -70.6 -37.32 73.88 Favored 'General case' 0 CA--C 1.536 0.412 0 CA-C-N 115.112 -0.949 . . . . 64.31 110.814 -179.473 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . 0.553 HD21 ' HA ' ' A' ' 22' ' ' LEU . 72.2 mt -64.84 -42.21 95.11 Favored 'General case' 0 N--CA 1.481 1.106 0 O-C-N 123.699 0.625 . . . . 75.14 111.419 174.928 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 47.3 mmtm -74.24 -34.84 63.77 Favored 'General case' 0 N--CA 1.476 0.865 0 C-N-CA 123.139 0.576 . . . . 61.14 110.674 -176.148 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -70.71 -37.11 67.08 Favored Glycine 0 C--N 1.347 1.194 0 O-C-N 123.91 0.756 . . . . 71.41 111.672 175.828 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 6.7 tt -65.57 -56.83 10.15 Favored 'General case' 0 N--CA 1.481 1.109 0 C-N-CA 123.839 0.855 . . . . 71.53 108.881 177.373 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 82' ' ' LEU . . . . . 0.431 HD13 ' HG2' ' A' ' 88' ' ' GLU . 80.7 mt -66.36 -22.12 66.25 Favored 'General case' 0 CA--C 1.543 0.696 0 C-N-CA 124.248 1.019 . . . . 61.14 111.934 -178.44 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 25.9 mt-30 60.46 33.3 20.64 Favored 'General case' 0 N--CA 1.487 1.391 0 C-N-CA 124.516 1.127 . . . . 52.44 111.292 178.191 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 16.5 mm-40 -89.2 176.13 7.08 Favored 'General case' 0 N--CA 1.478 0.928 0 C-N-CA 123.42 0.688 . . . . 74.12 111.29 -176.671 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 85' ' ' ARG . . . . . . . . . . . . . 20.3 mmt180 -116.51 38.77 3.33 Favored 'General case' 0 N--CA 1.481 1.077 0 C-N-CA 124.595 1.158 . . . . 71.33 109.006 178.429 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 56.8 mt 67.35 89.56 0.1 Allowed 'General case' 0 C--N 1.361 1.069 0 C-N-CA 124.959 1.304 . . . . 73.42 110.607 -178.003 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 22.9 t70 -160.0 -59.43 0.06 Allowed 'General case' 0 CA--C 1.539 0.524 0 CA-C-N 115.089 -0.959 . . . . 63.23 109.784 -179.644 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 88' ' ' GLU . . . . . 0.431 ' HG2' HD13 ' A' ' 82' ' ' LEU . 7.4 tp10 -48.46 -53.49 17.7 Favored 'General case' 0 N--CA 1.48 1.07 0 O-C-N 124.855 1.347 . . . . 73.53 112.612 -173.053 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 81.8 mt -124.65 52.39 1.54 Allowed 'General case' 0 N--CA 1.477 0.905 0 N-CA-C 108.352 -0.981 . . . . 64.23 108.352 177.794 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 29.9 t -150.4 17.83 0.83 Allowed 'General case' 0 N--CA 1.478 0.958 0 C-N-CA 123.788 0.835 . . . . 62.04 110.486 -176.089 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 24.2 m -75.87 77.4 2.78 Favored 'General case' 0 C--N 1.352 0.709 0 C-N-CA 124.369 1.068 . . . . 75.11 111.256 -175.737 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 92' ' ' LEU . . . . . 0.763 HD21 ' HB3' ' A' ' 41' ' ' LEU . 89.7 mt -141.12 -73.68 0.33 Allowed 'General case' 0 N--CA 1.473 0.681 0 C-N-CA 125.094 1.358 . . . . 73.53 108.493 -178.655 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 38.3 mt -112.72 -20.32 6.28 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.872 0 C-N-CA 124.852 1.261 . . . . 72.03 108.449 175.434 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 102.35 -62.76 0.48 Allowed Glycine 0 C--N 1.353 1.473 0 CA-C-N 115.962 -0.563 . . . . 72.11 111.915 173.972 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 9.9 pt20 -77.25 -171.81 2.2 Favored 'General case' 0 N--CA 1.482 1.165 0 C-N-CA 123.255 0.622 . . . . 61.52 111.935 -176.942 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 71.7 p -74.81 11.67 1.01 Allowed 'General case' 0 N--CA 1.472 0.647 0 CA-C-O 117.847 -1.073 . . . . 74.1 113.797 -174.944 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 96.0 m -48.58 -42.19 33.0 Favored 'General case' 0 N--CA 1.483 1.199 0 C-N-CA 124.173 0.989 . . . . 72.35 112.397 177.528 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 98' ' ' ARG . . . . . 0.569 ' HD2' HD12 ' A' ' 92' ' ' LEU . 18.5 mtm105 -68.11 -53.65 23.81 Favored 'General case' 0 N--CA 1.475 0.815 0 C-N-CA 124.074 0.95 . . . . 73.45 109.696 -176.687 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 7.7 tp-100 -61.93 -35.16 77.57 Favored 'General case' 0 N--CA 1.477 0.913 0 C-N-CA 124.605 1.162 . . . . 70.22 110.617 -178.226 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -72.75 -39.44 66.83 Favored 'General case' 0 N--CA 1.472 0.656 0 C-N-CA 124.645 1.178 . . . . 73.44 108.966 179.734 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 42.6 t -69.65 -38.3 77.07 Favored 'General case' 0 C--N 1.352 0.678 0 C-N-CA 124.008 0.923 . . . . 75.21 111.585 -176.265 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 102' ' ' LEU . . . . . 0.479 ' HG ' ' HH2' ' A' ' 11' ' ' TRP . 10.8 mp -80.8 -32.7 35.2 Favored 'General case' 0 N--CA 1.472 0.628 0 O-C-N 123.551 0.532 . . . . 62.45 110.649 -179.838 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 25.0 t-20 -68.61 -37.34 79.7 Favored 'General case' 0 N--CA 1.486 1.325 0 CA-C-O 120.975 0.416 . . . . 62.15 109.958 172.852 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 104' ' ' ASN . . . . . 0.667 ' HA ' HH21 ' A' ' 108' ' ' ARG . 28.4 t-20 -65.92 -44.84 83.95 Favored 'General case' 0 C--N 1.356 0.89 0 N-CA-C 108.812 -0.811 . . . . 74.33 108.812 174.661 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -56.5 -41.8 77.29 Favored 'General case' 0 C--N 1.346 0.433 0 O-C-N 124.052 0.845 . . . . 75.43 110.973 178.164 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 106' ' ' TYR . . . . . 0.498 ' HE2' ' HB2' ' A' ' 69' ' ' LYS . 17.2 t80 -68.02 -58.32 4.71 Favored 'General case' 0 CA--C 1.547 0.83 0 C-N-CA 123.339 0.656 . . . . 73.23 110.973 -176.642 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -65.34 -37.04 93.45 Favored Glycine 0 C--N 1.353 1.478 0 CA-C-N 115.797 -0.638 . . . . 53.44 112.413 -173.232 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 108' ' ' ARG . . . . . 0.667 HH21 ' HA ' ' A' ' 104' ' ' ASN . 0.0 OUTLIER -80.34 -22.73 41.14 Favored 'General case' 0 CA--C 1.538 0.507 0 C-N-CA 123.514 0.726 . . . . 73.14 110.673 179.422 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 109' ' ' LEU . . . . . 0.568 HD23 ' HB2' ' A' ' 65' ' ' ALA . 41.0 tp -67.15 -37.24 83.45 Favored 'General case' 0 N--CA 1.498 1.974 0 CA-C-O 121.402 0.62 . . . . 73.55 109.543 170.55 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 30.4 t -70.7 -36.15 73.12 Favored 'General case' 0 CA--C 1.55 0.976 0 CA-C-N 114.418 -1.265 . . . . 51.44 110.295 173.529 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . -90.33 -68.25 1.2 Allowed Glycine 0 C--N 1.371 2.509 0 N-CA-C 115.759 1.064 . . . . 70.54 115.759 -176.511 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 112' ' ' MET . . . . . . . . . . . . . 5.5 tmm? -95.97 -62.99 1.2 Allowed 'General case' 0 N--CA 1.498 1.967 0 CA-C-N 118.911 1.356 . . . . 64.23 111.078 -177.49 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 113' ' ' LEU . . . . . 0.406 HD23 ' HA ' ' A' ' 113' ' ' LEU . 5.8 mt 157.47 66.38 0.0 OUTLIER 'General case' 0 N--CA 1.494 1.749 0 C-N-CA 128.141 2.576 . . . . 63.42 107.198 179.526 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 114' ' ' LEU . . . . . 0.47 ' H ' ' HA ' ' A' ' 109' ' ' LEU . 7.1 tt 79.55 -29.25 0.14 Allowed 'General case' 0 N--CA 1.483 1.211 0 C-N-CA 126.958 2.103 . . . . 72.31 112.698 171.12 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 115' ' ' VAL . . . . . . . . . . . . . 18.2 m -124.3 128.03 25.13 Favored Pre-proline 0 CA--C 1.55 0.979 0 C-N-CA 123.424 0.69 . . . . 70.11 110.811 -172.932 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 21.8 Cg_endo -98.34 -173.72 0.17 Allowed 'Trans proline' 0 C--N 1.375 1.938 0 C-N-CA 123.672 2.914 . . . . 72.44 112.587 173.261 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 5.6 m-20 -100.67 -38.21 8.42 Favored 'General case' 0 N--CA 1.488 1.445 0 N-CA-C 108.096 -1.076 . . . . 72.51 108.096 162.458 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -156.22 146.32 15.76 Favored Pre-proline 0 CA--C 1.548 0.884 0 CA-C-N 114.247 -1.342 . . . . 65.5 108.305 176.224 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 119' ' ' PRO . . . . . . . . . . . . . 22.0 Cg_endo -59.83 137.35 75.98 Favored 'Trans proline' 0 C--N 1.373 1.837 0 C-N-CA 122.662 2.241 . . . . 52.13 111.264 173.733 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . -70.89 135.45 24.57 Favored Glycine 0 C--N 1.345 1.039 0 O-C-N 123.539 0.524 . . . . 52.41 113.338 -174.19 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . -108.86 178.21 4.54 Favored 'General case' 0 N--CA 1.479 1.004 0 C-N-CA 124.478 1.111 . . . . 64.14 110.864 178.52 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 122' ' ' SER . . . . . . . . . . . . . 35.6 t . . . . . 0 C--O 1.249 1.061 0 C-N-CA 124.22 1.008 . . . . 54.14 108.291 173.145 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 18.5 ptt? . . . . . 0 N--CA 1.479 1.001 0 CA-C-O 120.923 0.392 . . . . 64.21 110.739 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 8.8 t -55.52 -36.22 66.49 Favored 'General case' 0 N--CA 1.487 1.412 0 C-N-CA 123.268 0.627 . . . . 73.12 111.27 -178.205 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 18.4 m -55.11 -50.07 70.16 Favored 'General case' 0 C--N 1.356 0.855 0 C-N-CA 124.382 1.073 . . . . 72.23 110.85 174.416 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . 0.463 HG21 HD13 ' A' ' 60' ' ' ILE . 24.2 m -69.14 -39.09 79.04 Favored 'General case' 0 C--O 1.217 -0.616 0 CA-C-N 115.19 -0.914 . . . . 73.32 111.741 -177.508 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 74.6 t -61.91 -47.37 93.52 Favored 'Isoleucine or valine' 0 C--O 1.255 1.378 0 C-N-CA 122.698 0.399 . . . . 43.31 110.143 -177.276 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 27.6 mm-40 -61.43 -48.35 81.6 Favored 'General case' 0 C--N 1.351 0.639 0 CA-C-N 115.669 -0.696 . . . . 45.21 110.114 174.862 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 38.4 t80 -54.18 -49.88 68.31 Favored 'General case' 0 N--CA 1.485 1.31 0 C-N-CA 124.633 1.173 . . . . 64.32 111.472 -176.568 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . 0.449 HG13 ' O ' ' A' ' 4' ' ' THR . 64.0 mt -64.02 -47.33 90.87 Favored 'Isoleucine or valine' 0 C--N 1.359 0.988 0 C-N-CA 123.506 0.722 . . . . 72.02 110.123 179.624 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 2.9 t-20 -62.15 -28.94 70.0 Favored 'General case' 0 N--CA 1.484 1.251 0 O-C-N 123.559 0.537 . . . . 64.34 111.272 -176.811 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 96.9 mtt180 -72.82 -40.27 65.95 Favored 'General case' 0 CA--C 1.543 0.692 0 C-N-CA 123.803 0.841 . . . . 52.12 110.584 174.347 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 11' ' ' TRP . . . . . . . . . . . . . 84.0 m95 -65.8 -29.96 70.52 Favored 'General case' 0 N--CA 1.486 1.328 0 C-N-CA 122.801 0.441 . . . . 74.2 111.591 172.99 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . 0.459 ' HG2' ' CE2' ' A' ' 67' ' ' TYR . 38.2 mt-30 -65.21 -46.29 81.31 Favored 'General case' 0 C--O 1.211 -0.953 0 N-CA-C 107.796 -1.187 . . . . 72.31 107.796 173.352 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 61.6 ttt180 -59.62 -41.27 90.03 Favored 'General case' 0 CA--C 1.547 0.851 0 O-C-N 124.034 0.834 . . . . 63.3 111.71 -179.767 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 77.9 mt -64.41 -49.91 78.65 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.478 0 C-N-CA 123.098 0.559 . . . . 71.31 110.094 178.537 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . 0.463 ' HA ' ' HB ' ' A' ' 71' ' ' THR . . . -57.36 -46.55 83.22 Favored 'General case' 0 N--CA 1.478 0.933 0 C-N-CA 124.629 1.172 . . . . 74.3 111.656 178.869 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 89.5 mt -80.17 -34.33 37.63 Favored 'General case' 0 N--CA 1.477 0.896 0 CA-C-N 114.579 -1.191 . . . . 72.23 111.402 -171.968 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.512 ' O ' ' HG ' ' A' ' 21' ' ' LEU . 21.0 mt -67.71 -49.46 62.54 Favored 'General case' 0 N--CA 1.481 1.092 0 N-CA-C 109.642 -0.503 . . . . 73.43 109.642 177.542 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 85.0 p -62.56 -37.72 87.25 Favored 'General case' 0 N--CA 1.478 0.953 0 O-C-N 123.513 0.508 . . . . 64.42 111.052 178.588 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 19' ' ' GLN . . . . . 0.424 HE21 ' NE2' ' A' ' 70' ' ' GLN . 6.2 tp-100 -56.95 -46.92 81.78 Favored 'General case' 0 C--N 1.358 0.951 0 C-N-CA 123.497 0.719 . . . . 74.12 110.159 172.163 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 63.9 m -65.7 -42.11 91.56 Favored 'General case' 0 C--O 1.213 -0.819 0 O-C-N 123.707 0.629 . . . . 75.43 110.688 179.018 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . 0.512 ' HG ' ' O ' ' A' ' 17' ' ' LEU . 87.1 mt -63.43 -34.23 77.3 Favored 'General case' 0 N--CA 1.476 0.832 0 C-N-CA 123.56 0.744 . . . . 53.33 109.882 -178.032 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.589 ' HA ' HD21 ' A' ' 78' ' ' LEU . 56.1 tp -66.97 -54.72 19.16 Favored 'General case' 0 C--N 1.352 0.682 0 C-N-CA 123.535 0.734 . . . . 73.43 110.12 176.026 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 9.5 mm-40 -50.82 -52.58 39.82 Favored 'General case' 0 N--CA 1.479 1.01 0 C-N-CA 124.341 1.056 . . . . 71.34 111.439 178.15 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.469 HD22 HD12 ' A' ' 32' ' ' LEU . 62.4 mt -70.15 -34.54 73.15 Favored 'General case' 0 CA--C 1.539 0.557 0 C-N-CA 124.602 1.161 . . . . 74.02 111.078 -173.334 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . 0.45 ' HB2' HD21 ' A' ' 33' ' ' LEU . . . -60.64 -44.01 96.89 Favored 'General case' 0 N--CA 1.479 1.012 0 CA-C-O 120.902 0.382 . . . . 34.13 110.65 173.754 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 95.1 mt-30 -69.48 -31.79 70.29 Favored 'General case' 0 CA--C 1.549 0.918 0 CA-C-N 115.303 -0.862 . . . . 55.24 111.518 179.016 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 78.3 mtt180 -90.48 -2.57 57.93 Favored 'General case' 0 N--CA 1.483 1.198 0 C-N-CA 123.756 0.822 . . . . 71.24 112.315 -177.834 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 85.38 10.04 78.12 Favored Glycine 0 N--CA 1.479 1.566 0 N-CA-C 114.433 0.533 . . . . 74.11 114.433 174.891 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . 0.422 ' HB2' ' HB3' ' A' ' 24' ' ' LEU . 15.3 mm-40 -90.37 55.08 2.93 Favored 'General case' 0 N--CA 1.478 0.942 0 C-N-CA 124.79 1.236 . . . . 71.44 111.126 178.261 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 30' ' ' TRP . . . . . 0.489 ' HA ' HD13 ' A' ' 33' ' ' LEU . 83.5 m95 -63.02 -23.38 67.43 Favored 'General case' 0 N--CA 1.491 1.58 0 C-N-CA 123.875 0.87 . . . . 71.04 111.6 179.441 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 4.1 m-20 -55.61 -47.83 75.89 Favored 'General case' 0 N--CA 1.473 0.702 0 C-N-CA 124.984 1.314 . . . . 51.43 110.18 175.22 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.469 HD12 HD22 ' A' ' 24' ' ' LEU . 82.0 mt -72.3 -24.33 61.31 Favored 'General case' 0 CA--C 1.544 0.723 0 CA-C-N 114.306 -1.315 . . . . 53.4 110.954 -177.872 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . 0.489 HD13 ' HA ' ' A' ' 30' ' ' TRP . 9.4 mp -66.23 -45.18 81.57 Favored 'General case' 0 C--N 1.363 1.184 0 N-CA-C 110.101 -0.333 . . . . 73.23 110.101 171.228 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 88.8 mt -65.54 -38.63 90.17 Favored 'General case' 0 N--CA 1.482 1.136 0 C-N-CA 123.325 0.65 . . . . 72.41 111.784 -178.677 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 95.7 mt-30 -71.09 -49.68 41.81 Favored 'General case' 0 N--CA 1.478 0.938 0 C-N-CA 122.588 0.355 . . . . 74.5 110.681 179.211 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 85.2 mm-40 -73.95 -14.2 61.01 Favored 'General case' 0 N--CA 1.483 1.182 0 C-N-CA 123.102 0.561 . . . . 53.32 112.464 179.314 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . 0.453 ' O ' ' HG ' ' A' ' 41' ' ' LEU . 42.9 tt0 -51.92 -52.13 52.1 Favored 'General case' 0 N--CA 1.484 1.236 0 C-N-CA 123.94 0.896 . . . . 73.42 111.32 176.485 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 62.9 t -56.63 -47.84 81.59 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.755 0 O-C-N 123.889 0.743 . . . . 71.53 110.661 -178.856 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 32.0 m -67.04 -37.0 83.31 Favored 'General case' 0 CA--C 1.538 0.508 0 CA-C-N 115.455 -0.793 . . . . 75.55 111.801 -177.695 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 43.8 t80 -70.69 -49.47 46.77 Favored 'General case' 0 N--CA 1.47 0.541 0 C-N-CA 123.248 0.619 . . . . 72.14 110.65 -176.875 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . 0.564 HD22 HD22 ' A' ' 92' ' ' LEU . 22.2 mt -68.36 -41.88 80.03 Favored 'General case' 0 N--CA 1.478 0.939 0 O-C-N 123.851 0.719 . . . . 74.13 110.144 -176.749 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 41.1 tt0 -57.43 -56.03 27.16 Favored 'General case' 0 C--N 1.358 0.965 0 O-C-N 123.924 0.765 . . . . 70.54 110.788 176.119 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . 0.537 ' O ' HG23 ' A' ' 47' ' ' VAL . 73.0 m -57.54 -56.98 14.93 Favored 'General case' 0 C--N 1.352 0.704 0 O-C-N 124.046 0.841 . . . . 74.21 110.692 -177.587 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 14.6 tt -59.2 -40.8 82.01 Favored 'Isoleucine or valine' 0 C--N 1.354 0.803 0 O-C-N 123.799 0.687 . . . . 63.4 111.39 -172.139 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 38.1 mm-40 -64.07 -47.55 79.65 Favored 'General case' 0 C--N 1.358 0.964 0 CA-C-O 119.435 -0.317 . . . . 71.44 111.412 176.429 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 18.3 m -66.53 -27.6 67.89 Favored 'General case' 0 CA--C 1.551 0.983 0 O-C-N 123.457 0.473 . . . . 73.51 111.849 -177.222 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 47' ' ' VAL . . . . . 0.537 HG23 ' O ' ' A' ' 43' ' ' SER . 59.1 t -80.97 -38.37 16.81 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.384 0 C-N-CA 123.335 0.654 . . . . 72.02 110.612 -179.194 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 48' ' ' MET . . . . . . . . . . . . . 68.5 mtm -73.13 -21.9 60.63 Favored 'General case' 0 N--CA 1.486 1.374 0 C-N-CA 122.755 0.422 . . . . 62.45 110.407 172.894 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 17.2 tp10 -88.0 -18.74 28.34 Favored 'General case' 0 N--CA 1.481 1.096 0 C-N-CA 124.251 1.02 . . . . 73.2 110.167 174.793 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 14.2 tppt? -78.36 138.76 38.7 Favored 'General case' 0 C--O 1.24 0.581 0 N-CA-C 109.27 -0.641 . . . . 64.5 109.27 -179.852 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 8.6 tt0 -68.5 124.99 25.08 Favored 'General case' 0 C--O 1.241 0.639 0 CA-C-N 115.423 -0.808 . . . . 71.31 109.558 -177.899 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 52' ' ' THR . . . . . 0.463 HG21 ' HB3' ' A' ' 114' ' ' LEU . 29.7 m -61.08 121.34 61.82 Favored Pre-proline 0 CA--C 1.555 1.155 0 C-N-CA 123.672 0.789 . . . . 73.21 110.612 178.686 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 55.7 Cg_endo -67.19 155.88 68.69 Favored 'Trans proline' 0 C--N 1.376 1.988 0 C-N-CA 122.414 2.076 . . . . 65.23 111.764 176.484 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 18.1 Cg_exo -67.08 -52.87 0.56 Allowed 'Trans proline' 0 C--N 1.376 1.992 0 C-N-CA 122.399 2.066 . . . . 75.32 111.72 177.574 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . -70.11 86.8 0.31 Allowed Glycine 0 C--N 1.349 1.251 0 O-C-N 124.09 0.869 . . . . 63.24 112.912 -175.618 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 56' ' ' ILE . . . . . 0.472 ' O ' ' HB ' ' A' ' 60' ' ' ILE . 71.9 mt -115.5 -50.28 4.82 Favored 'Isoleucine or valine' 0 C--O 1.209 -1.044 0 C-N-CA 124.646 1.178 . . . . 73.21 108.99 176.416 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 10.4 p 60.43 -177.37 0.1 Allowed 'General case' 0 CA--C 1.557 1.23 0 C-N-CA 125.872 1.669 . . . . 53.0 111.077 -178.2 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -55.57 -42.85 75.3 Favored 'General case' 0 N--CA 1.479 1.011 0 C-N-CA 124.345 1.058 . . . . 71.44 110.144 176.168 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 49.3 m -61.76 -53.97 48.83 Favored 'General case' 0 CA--C 1.545 0.788 0 CA-C-N 115.697 -0.683 . . . . 30.1 112.759 -173.264 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 60' ' ' ILE . . . . . 0.472 ' HB ' ' O ' ' A' ' 56' ' ' ILE . 26.1 mt -79.28 -23.74 12.52 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.182 0 N-CA-C 109.631 -0.507 . . . . 70.15 109.631 -174.648 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 61' ' ' GLN . . . . . 0.47 ' HG3' ' HG ' ' A' ' 109' ' ' LEU . 53.2 tt0 -58.75 -48.23 81.92 Favored 'General case' 0 C--N 1.358 0.942 0 N-CA-C 109.866 -0.42 . . . . 75.35 109.866 172.005 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 3.4 m-20 -71.56 -37.68 71.05 Favored 'General case' 0 CA--C 1.547 0.842 0 CA-C-N 115.973 -0.558 . . . . 62.41 112.416 178.616 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 63' ' ' MET . . . . . . . . . . . . . 69.2 mtm -64.93 -59.79 3.78 Favored 'General case' 0 N--CA 1.488 1.466 0 CA-C-N 117.775 0.261 . . . . 70.13 111.284 179.172 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 64' ' ' VAL . . . . . 0.456 ' O ' HG13 ' A' ' 68' ' ' ILE . 55.5 t -57.64 -49.44 80.64 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.033 0 C-N-CA 123.516 0.726 . . . . 74.23 111.984 178.263 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . 0.498 ' HB2' HD23 ' A' ' 109' ' ' LEU . . . -64.7 -33.21 75.41 Favored 'General case' 0 N--CA 1.495 1.795 0 CA-C-N 118.977 0.808 . . . . 50.2 111.279 -179.638 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -64.36 -39.02 96.61 Favored Glycine 0 C--N 1.347 1.19 0 N-CA-C 112.182 -0.367 . . . . 52.44 112.182 174.795 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 67' ' ' TYR . . . . . 0.47 ' O ' HG22 ' A' ' 71' ' ' THR . 14.2 m-30 -65.48 -42.6 92.06 Favored 'General case' 0 N--CA 1.471 0.61 0 C-N-CA 123.636 0.774 . . . . 74.13 110.752 175.306 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 68' ' ' ILE . . . . . 0.542 ' O ' ' HG ' ' A' ' 72' ' ' LEU . 78.5 mt -59.34 -49.97 81.57 Favored 'Isoleucine or valine' 0 C--N 1.355 0.836 0 O-C-N 124.619 1.199 . . . . 74.23 109.38 178.689 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 69' ' ' LYS . . . . . 0.576 ' HB2' ' HE2' ' A' ' 106' ' ' TYR . 27.9 tptp -57.37 -46.09 83.76 Favored 'General case' 0 N--CA 1.472 0.666 0 C-N-CA 124.013 0.925 . . . . 74.24 110.393 -179.26 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 70' ' ' GLN . . . . . 0.424 ' NE2' HE21 ' A' ' 19' ' ' GLN . 53.5 tt0 -59.35 -48.21 82.49 Favored 'General case' 0 C--N 1.354 0.802 0 CA-C-N 115.306 -0.861 . . . . 72.32 111.058 -179.411 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 71' ' ' THR . . . . . 0.47 HG22 ' O ' ' A' ' 67' ' ' TYR . 9.2 t -76.08 -23.74 55.03 Favored 'General case' 0 C--O 1.24 0.584 0 O-C-N 123.401 0.438 . . . . 74.12 110.227 -174.438 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 72' ' ' LEU . . . . . 0.631 ' HA ' HH12 ' A' ' 98' ' ' ARG . 39.5 mt -61.37 -51.73 67.56 Favored 'General case' 0 C--N 1.363 1.158 0 N-CA-C 108.648 -0.871 . . . . 72.42 108.648 171.796 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 28.6 m-20 -64.51 -48.57 74.65 Favored 'General case' 0 N--CA 1.484 1.231 0 O-C-N 123.945 0.778 . . . . 75.51 112.429 179.716 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 94.6 m-20 -52.02 -56.63 13.09 Favored 'General case' 0 N--CA 1.491 1.593 0 C-N-CA 124.03 0.932 . . . . 63.2 110.729 -179.989 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 15.6 tt0 -70.49 -30.52 67.32 Favored 'General case' 0 CA--C 1.551 1.014 0 CA-C-N 114.787 -1.097 . . . . 74.24 110.762 -176.527 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 8.4 tt0 -64.22 -41.26 97.11 Favored 'General case' 0 N--CA 1.487 1.419 0 C-N-CA 123.49 0.716 . . . . 55.11 110.77 176.744 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 95.2 mt -67.26 -38.99 86.03 Favored 'General case' 0 N--CA 1.47 0.57 0 CA-C-N 115.7 -0.682 . . . . 73.42 109.929 178.085 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . 0.589 HD21 ' HA ' ' A' ' 22' ' ' LEU . 74.9 mt -58.78 -51.25 70.8 Favored 'General case' 0 C--N 1.357 0.898 0 CA-C-N 115.867 -0.606 . . . . 74.5 111.454 172.042 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 79' ' ' LYS . . . . . 0.563 ' HE2' ' O ' ' A' ' 88' ' ' GLU . 2.9 mptm? -61.33 -38.97 88.81 Favored 'General case' 0 N--CA 1.481 1.122 0 C-N-CA 123.956 0.902 . . . . 73.15 111.313 -179.442 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -67.94 -29.83 73.82 Favored Glycine 0 C--N 1.341 0.857 0 O-C-N 123.738 0.649 . . . . 62.13 112.204 177.429 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . 0.431 HD22 ' HH2' ' A' ' 30' ' ' TRP . 4.3 tt -78.2 -39.28 41.13 Favored 'General case' 0 CA--C 1.554 1.115 0 C-N-CA 123.5 0.72 . . . . 72.32 109.582 176.088 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 82' ' ' LEU . . . . . 0.433 ' HG ' ' O ' ' A' ' 78' ' ' LEU . 94.0 mt -77.85 -66.6 0.82 Allowed 'General case' 0 N--CA 1.48 1.073 0 C-N-CA 123.184 0.594 . . . . 74.13 111.057 -171.997 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 15.5 mm100 -147.28 -72.57 0.22 Allowed 'General case' 0 N--CA 1.475 0.821 0 C-N-CA 124.162 0.985 . . . . 74.1 109.308 -170.563 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 84' ' ' GLN . . . . . 0.422 ' HG2' ' HG2' ' A' ' 85' ' ' ARG . 8.4 tt0 -169.01 163.8 11.35 Favored 'General case' 0 CA--C 1.541 0.612 0 C-N-CA 124.209 1.003 . . . . 55.12 108.417 -173.499 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 85' ' ' ARG . . . . . 0.422 ' HG2' ' HG2' ' A' ' 84' ' ' GLN . 4.6 ptp180 -44.84 -35.5 2.8 Favored 'General case' 0 N--CA 1.489 1.502 0 C-N-CA 125.499 1.519 . . . . 73.1 113.865 -179.244 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 86' ' ' LEU . . . . . 0.578 HD22 ' HB3' ' A' ' 96' ' ' SER . 86.0 mt -130.19 98.45 4.73 Favored 'General case' 0 N--CA 1.469 0.487 0 C-N-CA 123.588 0.755 . . . . 70.22 109.218 176.957 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 10.2 t70 -160.63 -89.9 0.03 OUTLIER 'General case' 0 CA--C 1.55 0.974 0 N-CA-C 108.531 -0.914 . . . . 74.02 108.531 174.649 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 88' ' ' GLU . . . . . 0.563 ' O ' ' HE2' ' A' ' 79' ' ' LYS . 48.9 mt-10 -85.89 148.4 25.81 Favored 'General case' 0 N--CA 1.485 1.296 0 C-N-CA 123.598 0.759 . . . . 61.4 109.036 175.559 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 88.5 mt 61.73 20.74 11.63 Favored 'General case' 0 N--CA 1.498 1.93 0 C-N-CA 124.59 1.156 . . . . 43.31 112.265 -179.508 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 20.2 m -112.64 -40.58 4.02 Favored 'General case' 0 N--CA 1.48 1.064 0 C-N-CA 123.635 0.774 . . . . 74.53 110.301 -176.166 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 26.9 m -79.24 92.24 5.09 Favored 'General case' 0 N--CA 1.471 0.602 0 C-N-CA 123.811 0.844 . . . . 74.42 109.786 176.897 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 92' ' ' LEU . . . . . 0.564 HD22 HD22 ' A' ' 41' ' ' LEU . 11.9 mt -90.51 -62.89 1.36 Allowed 'General case' 0 N--CA 1.476 0.875 0 CA-C-N 116.044 -0.525 . . . . 70.0 110.552 -174.461 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 49.4 mt -77.24 -43.52 31.13 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.244 0 N-CA-C 109.076 -0.713 . . . . 72.14 109.076 173.14 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -171.62 -29.41 0.02 OUTLIER Glycine 0 C--N 1.346 1.115 0 CA-C-N 115.14 -0.936 . . . . 72.21 112.289 -179.226 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 14.1 pt20 -140.99 -177.41 5.08 Favored 'General case' 0 N--CA 1.481 1.102 0 C-N-CA 123.61 0.764 . . . . 73.52 110.112 179.544 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 96' ' ' SER . . . . . 0.578 ' HB3' HD22 ' A' ' 86' ' ' LEU . 50.2 m -66.91 83.01 0.11 Allowed 'General case' 0 CA--C 1.541 0.615 0 C-N-CA 124.233 1.013 . . . . 74.33 112.249 -174.618 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 89.7 m -88.12 -41.85 12.75 Favored 'General case' 0 CA--C 1.54 0.558 0 C-N-CA 123.744 0.818 . . . . 64.41 110.075 176.526 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 98' ' ' ARG . . . . . 0.631 HH12 ' HA ' ' A' ' 72' ' ' LEU . 1.7 tmt_? -49.88 -57.65 6.99 Favored 'General case' 0 N--CA 1.478 0.948 0 C-N-CA 125.075 1.35 . . . . 64.2 112.929 -165.57 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 8.9 tt0 -60.51 -52.4 65.35 Favored 'General case' 0 N--CA 1.477 0.916 0 O-C-N 123.789 0.681 . . . . 64.43 110.861 -170.318 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 65.5 tttp -64.78 -42.99 94.65 Favored 'General case' 0 CA--C 1.542 0.673 0 O-C-N 124.15 0.906 . . . . 51.42 111.473 -178.397 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 26.5 t -69.37 -40.24 77.55 Favored 'General case' 0 N--CA 1.467 0.419 0 C-N-CA 123.426 0.691 . . . . 71.11 111.613 -173.122 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 102' ' ' LEU . . . . . 0.49 ' HG ' HG23 ' A' ' 68' ' ' ILE . 3.4 tp -80.38 -34.65 36.19 Favored 'General case' 0 N--CA 1.471 0.6 0 C-N-CA 122.787 0.435 . . . . 62.25 110.47 -176.372 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 7.6 t30 -63.41 -40.03 96.11 Favored 'General case' 0 N--CA 1.479 1.016 0 C-N-CA 122.933 0.493 . . . . 54.41 109.907 172.902 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 12.0 t30 -67.07 -41.28 86.69 Favored 'General case' 0 N--CA 1.473 0.722 0 CA-C-N 115.651 -0.704 . . . . 71.52 110.126 177.188 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -59.14 -45.17 91.66 Favored 'General case' 0 N--CA 1.47 0.566 0 O-C-N 123.598 0.561 . . . . 55.33 110.402 177.44 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 106' ' ' TYR . . . . . 0.576 ' HE2' ' HB2' ' A' ' 69' ' ' LYS . 19.9 t80 -60.71 -55.4 33.67 Favored 'General case' 0 C--N 1.355 0.821 0 O-C-N 124.046 0.841 . . . . 74.41 110.477 178.999 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -66.09 -44.04 92.13 Favored Glycine 0 C--N 1.349 1.302 0 O-C-N 124.318 1.011 . . . . 43.14 112.494 -171.058 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 20.4 mmm180 -67.1 -33.3 75.18 Favored 'General case' 0 CA--C 1.541 0.633 0 C-N-CA 123.258 0.623 . . . . 72.44 111.048 177.512 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 109' ' ' LEU . . . . . 0.535 ' HA ' ' N ' ' A' ' 114' ' ' LEU . 35.6 tp -68.33 -43.43 77.57 Favored 'General case' 0 N--CA 1.485 1.287 0 C-N-CA 122.819 0.448 . . . . 62.1 110.359 176.327 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 33.2 t -68.06 -31.73 71.57 Favored 'General case' 0 CA--C 1.54 0.595 0 CA-C-N 114.701 -1.136 . . . . 70.11 110.296 -178.326 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . -89.64 -65.18 1.25 Allowed Glycine 0 C--N 1.36 1.898 0 CA-C-O 119.109 -0.828 . . . . 73.24 113.941 -179.502 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 112' ' ' MET . . . . . 0.484 ' O ' ' HG ' ' A' ' 113' ' ' LEU . 10.0 tpt -98.1 -72.52 0.65 Allowed 'General case' 0 N--CA 1.486 1.347 0 CA-C-N 118.609 1.204 . . . . 74.11 112.273 174.637 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 113' ' ' LEU . . . . . 0.484 ' HG ' ' O ' ' A' ' 112' ' ' MET . 12.2 mt 171.25 45.88 0.0 OUTLIER 'General case' 0 N--CA 1.505 2.305 0 C-N-CA 125.445 1.498 . . . . 62.44 109.561 -174.406 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 114' ' ' LEU . . . . . 0.535 ' N ' ' HA ' ' A' ' 109' ' ' LEU . 2.1 tt 82.12 -25.32 0.16 Allowed 'General case' 0 N--CA 1.507 2.388 0 C-N-CA 126.633 1.973 . . . . 62.13 111.343 172.075 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 115' ' ' VAL . . . . . 0.418 ' HA ' ' HD3' ' A' ' 116' ' ' PRO . 35.2 m -77.53 129.93 75.65 Favored Pre-proline 0 CA--C 1.552 1.026 0 C-N-CA 123.685 0.794 . . . . 74.44 109.988 -175.841 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 116' ' ' PRO . . . . . 0.418 ' HD3' ' HA ' ' A' ' 115' ' ' VAL . 12.2 Cg_exo -71.53 92.25 0.68 Allowed 'Trans proline' 0 C--N 1.372 1.807 0 C-N-CA 122.91 2.407 . . . . 64.33 110.956 177.178 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 33.8 t70 -171.5 88.22 0.1 Allowed 'General case' 0 C--O 1.241 0.635 0 C-N-CA 124.295 1.038 . . . . 64.24 108.555 -172.717 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -80.69 109.96 15.26 Favored Pre-proline 0 CA--C 1.553 1.085 0 C-N-CA 123.444 0.698 . . . . 72.1 110.413 179.308 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 119' ' ' PRO . . . . . . . . . . . . . 42.9 Cg_endo -99.8 19.09 0.32 Allowed 'Trans proline' 0 C--N 1.375 1.967 0 C-N-CA 123.629 2.886 . . . . 72.34 112.972 -179.824 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . 83.77 -67.23 3.76 Favored Glycine 0 C--N 1.348 1.233 0 N-CA-C 110.599 -1.0 . . . . 71.43 110.599 -168.775 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . -168.09 161.21 12.45 Favored 'General case' 0 N--CA 1.472 0.667 0 C-N-CA 124.557 1.143 . . . . 62.34 109.158 171.381 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 122' ' ' SER . . . . . . . . . . . . . 17.8 m . . . . . 0 C--O 1.253 1.255 0 N-CA-C 109.004 -0.739 . . . . 71.31 109.004 175.749 . . . . . . . . 0 0 . 1 stop_ save_