data_4a54_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 4a54 _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 ' 2' ' ' SER . . . . . . . . . . . . . 73.0 m . . . . . 0 N--CA 1.496 1.829 0 CA-C-O 120.983 0.42 . . . . 1.1299999999999999 110.027 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 66.8 t -66.55 -27.82 41.43 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.13 0 O-C-N 121.675 -0.641 . . . . 1.4299999999999999 110.301 -178.486 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -55.18 -31.16 61.16 Favored 'General case' 0 N--CA 1.504 2.251 0 O-C-N 121.492 -0.755 . . . . 1.1699999999999999 110.504 -178.262 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 9.7 m-20 -69.05 -30.59 68.96 Favored 'General case' 0 N--CA 1.498 1.962 0 O-C-N 121.833 -0.542 . . . . 1.1699999999999999 110.304 174.903 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 95.4 m-85 -95.49 10.01 38.04 Favored 'General case' 0 N--CA 1.497 1.887 0 O-C-N 121.638 -0.664 . . . . 0.73999999999999999 111.537 -177.88 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 3.4 m-30 -67.1 136.1 54.64 Favored 'General case' 0 N--CA 1.502 2.144 0 O-C-N 121.2 -0.938 . . . . 2.6000000000000001 109.966 174.172 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 83.13 -0.9 89.5 Favored Glycine 0 N--CA 1.498 2.794 0 N-CA-C 110.583 -1.007 . . . . 0.26000000000000001 110.583 -175.711 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 27.4 t -77.24 134.77 38.49 Favored 'General case' 0 N--CA 1.498 1.951 0 O-C-N 121.2 -1.176 . . . . 1.6899999999999999 110.451 178.409 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 12.7 t-20 -83.52 120.03 25.43 Favored 'General case' 0 N--CA 1.497 1.896 0 O-C-N 121.623 -0.673 . . . . 2.0899999999999999 109.612 173.227 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 35.9 m -142.73 162.92 17.86 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.714 0 O-C-N 121.79 -0.569 . . . . 1.05 109.718 -178.89 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 49.4 tt0 -109.39 147.31 32.99 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.654 -0.654 . . . . 1.0600000000000001 109.533 177.04 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 57.7 t -136.07 125.16 38.77 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.79 0 O-C-N 121.642 -0.661 . . . . 1.1000000000000001 109.742 -174.259 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 24.1 tp -95.93 127.84 42.3 Favored 'General case' 0 N--CA 1.493 1.701 0 N-CA-C 109.238 -0.653 . . . . 1.1499999999999999 109.238 174.942 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 85.1 mt -92.78 171.83 8.73 Favored 'General case' 0 N--CA 1.496 1.83 0 O-C-N 121.659 -0.651 . . . . 1.1000000000000001 110.887 -173.961 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 24.0 p30 -56.89 -22.39 36.93 Favored 'General case' 0 N--CA 1.505 2.281 0 O-C-N 121.731 -0.606 . . . . 0.40000000000000002 111.518 -177.814 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 53.2 p-10 -92.99 22.92 4.55 Favored 'General case' 0 N--CA 1.498 1.972 0 O-C-N 121.613 -0.679 . . . . 1.0700000000000001 110.835 -178.038 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 74.3 m-20 58.73 27.81 16.44 Favored 'General case' 0 N--CA 1.506 2.334 0 O-C-N 121.446 -0.784 . . . . 1.0 110.647 176.279 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 49.9 m -105.81 146.9 29.28 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.511 -0.743 . . . . 0.89000000000000001 109.697 173.052 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 73.6 mttt -109.55 145.55 36.16 Favored 'General case' 0 N--CA 1.495 1.783 0 O-C-N 121.572 -0.705 . . . . 2.1699999999999999 110.609 -176.64 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -153.07 131.52 12.14 Favored 'General case' 0 N--CA 1.496 1.833 0 O-C-N 121.809 -0.557 . . . . 1.1000000000000001 110.266 176.74 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 16.6 ptp180 -126.17 144.26 50.82 Favored 'General case' 0 N--CA 1.497 1.92 0 O-C-N 121.659 -0.651 . . . . 2.7999999999999998 110.427 -178.133 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -171.77 171.4 44.08 Favored Glycine 0 N--CA 1.496 2.642 0 N-CA-C 109.189 -1.564 . . . . 0.28000000000000003 109.189 -176.101 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 47.2 t -94.67 119.9 43.32 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.958 0 O-C-N 121.593 -0.945 . . . . 1.04 109.375 -176.963 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 90.7 mt -64.21 144.16 14.98 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.139 0 O-C-N 121.658 -0.652 . . . . 1.23 110.531 -171.482 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 19.1 p -121.28 -27.28 4.89 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.823 -0.548 . . . . 1.1000000000000001 111.152 178.128 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 2.1 t-20 -161.37 160.79 29.98 Favored 'General case' 0 N--CA 1.5 2.029 0 C-N-CA 118.97 -1.092 . . . . 1.74 111.823 -178.921 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 84.1 t80 -150.11 126.97 11.07 Favored 'General case' 0 N--CA 1.498 1.954 0 N-CA-C 109.138 -0.689 . . . . 0.81999999999999995 109.138 170.234 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 17.9 t70 -99.7 129.16 45.8 Favored 'General case' 0 N--CA 1.491 1.619 0 N-CA-C 109.121 -0.696 . . . . 1.1499999999999999 109.121 -178.263 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 22.8 m -67.41 -47.67 69.58 Favored 'General case' 0 N--CA 1.498 1.949 0 O-C-N 121.647 -0.658 . . . . 1.6599999999999999 110.714 -175.609 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 22.1 m -59.47 -45.23 92.23 Favored 'General case' 0 N--CA 1.503 2.206 0 O-C-N 121.596 -0.69 . . . . 1.3300000000000001 110.892 -173.878 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 91.3 m-20 -104.69 -7.09 19.83 Favored 'General case' 0 N--CA 1.497 1.891 0 O-C-N 121.645 -0.659 . . . . 1.74 111.608 -178.386 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 16.7 m 49.64 67.23 0.93 Allowed 'General case' 0 N--CA 1.507 2.422 0 O-C-N 121.058 -1.026 . . . . 1.48 110.857 -174.378 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 45.5 mm -121.4 125.98 74.34 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.993 0 O-C-N 121.545 -0.722 . . . . 1.0600000000000001 109.333 -175.224 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 11.5 tp -115.87 120.76 40.27 Favored 'General case' 0 N--CA 1.494 1.748 0 O-C-N 121.735 -0.603 . . . . 1.0800000000000001 110.559 -168.865 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 98.8 mt-30 -91.03 132.8 35.79 Favored 'General case' 0 N--CA 1.49 1.563 0 N-CA-C 109.494 -0.558 . . . . 1.4099999999999999 109.494 173.87 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 16.3 mt -117.86 123.82 46.82 Favored 'General case' 0 N--CA 1.495 1.819 0 O-C-N 121.824 -0.547 . . . . 1.28 109.992 176.408 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 26.4 mtp85 -96.79 107.09 19.51 Favored 'General case' 0 N--CA 1.496 1.87 0 O-C-N 121.651 -0.656 . . . . 3.5699999999999998 109.935 175.545 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 17.2 tp -84.53 152.08 24.15 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.684 -0.635 . . . . 1.4099999999999999 110.911 -174.618 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -66.37 -5.83 12.18 Favored 'General case' 0 N--CA 1.502 2.143 0 O-C-N 121.946 -0.471 . . . . 1.1599999999999999 112.006 -172.251 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 91.1 m-20 -86.61 27.91 0.92 Allowed 'General case' 0 N--CA 1.498 1.946 0 O-C-N 121.107 -0.995 . . . . 3.02 110.925 174.504 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 8.0 t70 62.96 29.46 16.47 Favored 'General case' 0 N--CA 1.504 2.251 0 O-C-N 121.099 -1.0 . . . . 2.02 110.524 175.687 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 49.9 m -124.51 137.91 54.38 Favored 'General case' 0 N--CA 1.495 1.808 0 O-C-N 121.316 -0.865 . . . . 1.4199999999999999 110.554 -179.597 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 8.6 t -97.97 151.0 20.75 Favored 'General case' 0 N--CA 1.497 1.876 0 O-C-N 121.75 -0.593 . . . . 1.3 110.116 175.265 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 37.9 ttmt -150.49 119.13 6.52 Favored 'General case' 0 N--CA 1.495 1.791 0 O-C-N 121.521 -0.737 . . . . 2.4300000000000002 110.393 179.023 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 88.8 p -95.12 122.87 38.24 Favored 'General case' 0 N--CA 1.496 1.834 0 O-C-N 121.687 -0.633 . . . . 0.89000000000000001 110.27 179.356 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 82.0 mt -129.36 136.36 59.58 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.866 0 O-C-N 121.654 -0.654 . . . . 1.1499999999999999 109.301 179.427 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 66.9 t -81.88 127.63 39.43 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.914 0 O-C-N 121.565 -0.709 . . . . 1.1000000000000001 109.165 179.068 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 34.6 p -59.53 -24.86 64.04 Favored 'General case' 0 N--CA 1.504 2.266 0 O-C-N 121.56 -0.713 . . . . 1.0700000000000001 111.998 -170.606 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 77.1 tttt -56.55 -25.49 52.29 Favored 'General case' 0 N--CA 1.502 2.173 0 O-C-N 121.45 -0.781 . . . . 3.7000000000000002 110.943 -176.558 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 7.3 p30 -84.09 4.63 29.34 Favored 'General case' 0 N--CA 1.499 2.007 0 C-N-CA 119.714 -0.794 . . . . 0.54000000000000004 111.364 176.517 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 98.2 mt -75.8 126.46 36.56 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.137 0 O-C-N 121.07 -1.019 . . . . 1.1899999999999999 109.872 175.933 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 47.3 tptt -91.44 -29.95 16.76 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.833 -0.542 . . . . 2.4300000000000002 109.903 170.579 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 5.3 m-20 -164.29 157.01 17.24 Favored 'General case' 0 N--CA 1.5 2.06 0 O-C-N 121.795 -0.566 . . . . 0.85999999999999999 110.026 -178.136 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 84.1 mt -132.97 150.74 52.14 Favored 'General case' 0 N--CA 1.497 1.92 0 O-C-N 121.756 -0.59 . . . . 1.28 110.581 -178.65 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 9.2 ptp85 -152.79 142.33 21.78 Favored 'General case' 0 N--CA 1.497 1.884 0 O-C-N 121.729 -0.607 . . . . 2.4300000000000002 109.973 175.349 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 68.8 mt -86.42 133.25 30.24 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.928 0 O-C-N 121.501 -0.75 . . . . 1.1399999999999999 110.094 175.14 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 59.6 mt . . . . . 0 N--CA 1.499 1.981 0 O-C-N 121.634 -0.666 . . . . 1.1499999999999999 110.029 -179.557 . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' B' B ' 257' ' ' SER . . . . . . . . . . . . . 49.0 m . . . . . 0 N--CA 1.503 2.207 0 CA-C-O 121.219 0.533 . . . . 1.6000000000000001 110.459 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' B' B ' 258' ' ' SER . . . . . . . . . . . . . 25.4 m -69.07 -32.27 71.6 Favored 'General case' 0 N--CA 1.498 1.968 0 C-N-CA 120.502 -0.479 . . . . 1.7 110.3 -179.883 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 259' ' ' GLN . . . . . . . . . . . . . 98.5 mt-30 -63.42 -36.88 85.2 Favored 'General case' 0 N--CA 1.501 2.086 0 O-C-N 121.557 -0.714 . . . . 2.7000000000000002 110.46 -179.038 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 260' ' ' LEU . . . . . . . . . . . . . 83.3 mt -68.18 -43.9 77.1 Favored 'General case' 0 N--CA 1.5 2.051 0 O-C-N 121.691 -0.631 . . . . 1.1799999999999999 110.206 179.349 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 261' ' ' LEU . . . . . . . . . . . . . 21.7 tp -68.88 -35.06 76.43 Favored 'General case' 0 N--CA 1.498 1.932 0 O-C-N 121.703 -0.623 . . . . 1.1100000000000001 109.756 176.039 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 262' ' ' SER . . . . . . . . . . . . . 23.1 t -62.74 -37.98 88.74 Favored 'General case' 0 N--CA 1.5 2.028 0 O-C-N 121.714 -0.616 . . . . 1.49 110.599 178.127 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 263' ' ' LEU . . . . . . . . . . . . . 33.8 mt . . . . . 0 N--CA 1.501 2.117 0 O-C-N 121.663 -0.648 . . . . 1.2 110.09 -179.212 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 70.7 m . . . . . 0 N--CA 1.495 1.794 0 CA-C-O 120.994 0.426 . . . . 0.0 110.085 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 73.2 t -66.18 -27.82 41.85 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.061 0 O-C-N 121.703 -0.623 . . . . 0.0 110.278 -179.153 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -55.06 -31.07 60.87 Favored 'General case' 0 N--CA 1.505 2.295 0 O-C-N 121.454 -0.779 . . . . 0.0 110.405 -178.907 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 74.4 m-20 -68.91 -30.62 69.13 Favored 'General case' 0 N--CA 1.499 1.991 0 O-C-N 121.845 -0.534 . . . . 0.0 110.279 174.886 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 96.1 m-85 -95.63 10.13 37.85 Favored 'General case' 0 N--CA 1.497 1.909 0 O-C-N 121.652 -0.655 . . . . 0.0 111.507 -178.025 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 3.1 m-30 -67.28 133.18 49.2 Favored 'General case' 0 N--CA 1.502 2.141 0 O-C-N 121.17 -0.956 . . . . 0.0 110.018 173.986 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 83.66 -2.15 87.75 Favored Glycine 0 N--CA 1.497 2.753 0 N-CA-C 110.695 -0.962 . . . . 0.0 110.695 -176.086 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 30.4 t -77.27 138.91 39.67 Favored 'General case' 0 N--CA 1.497 1.918 0 O-C-N 121.11 -1.23 . . . . 0.0 110.461 177.948 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 14.8 t-20 -83.7 121.99 28.03 Favored 'General case' 0 N--CA 1.497 1.924 0 O-C-N 121.69 -0.631 . . . . 0.0 109.659 173.652 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 35.8 m -143.24 159.75 17.46 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.775 0 O-C-N 121.79 -0.568 . . . . 0.0 109.598 -179.22 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 12' ' ' GLU . . . . . 0.434 ' HA ' ' HA ' ' A' ' 22' ' ' ARG . 46.5 tt0 -109.45 123.74 49.87 Favored 'General case' 0 N--CA 1.493 1.71 0 C-N-CA 119.901 -0.72 . . . . 0.0 109.984 177.009 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 60.3 t -106.77 123.4 61.74 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.822 0 O-C-N 121.592 -0.693 . . . . 0.0 109.964 -177.128 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 27.0 tp -96.03 127.53 42.13 Favored 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.69 -0.631 . . . . 0.0 109.622 175.537 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 84.6 mt -97.83 169.87 9.36 Favored 'General case' 0 N--CA 1.495 1.813 0 O-C-N 121.623 -0.673 . . . . 0.0 110.977 -171.945 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 25.0 p30 -58.07 -21.18 44.71 Favored 'General case' 0 N--CA 1.505 2.314 0 O-C-N 121.782 -0.574 . . . . 0.0 111.594 -178.427 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 52.9 p-10 -90.27 21.01 4.02 Favored 'General case' 0 N--CA 1.499 1.978 0 O-C-N 121.548 -0.72 . . . . 0.0 111.121 -177.372 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 74.4 m-20 58.84 27.39 16.05 Favored 'General case' 0 N--CA 1.505 2.298 0 O-C-N 121.36 -0.838 . . . . 0.0 110.734 175.046 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 49.1 m -109.76 133.85 52.67 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.486 -0.759 . . . . 0.0 109.613 172.159 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 22.2 ttpt -109.78 143.12 40.06 Favored 'General case' 0 N--CA 1.494 1.748 0 O-C-N 121.618 -0.677 . . . . 0.0 110.738 -176.377 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -153.08 159.72 42.84 Favored 'General case' 0 N--CA 1.495 1.805 0 O-C-N 121.756 -0.59 . . . . 0.0 109.838 178.264 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . 0.434 ' HA ' ' HA ' ' A' ' 12' ' ' GLU . 33.9 ptt-85 -141.27 148.64 40.15 Favored 'General case' 0 N--CA 1.497 1.895 0 O-C-N 121.625 -0.672 . . . . 0.0 110.831 -178.779 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -171.7 171.41 44.06 Favored Glycine 0 N--CA 1.495 2.631 0 N-CA-C 108.805 -1.718 . . . . 0.0 108.805 -176.589 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 46.4 t -94.57 122.5 46.08 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.944 0 O-C-N 121.428 -1.042 . . . . 0.0 109.348 -175.371 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 93.6 mt -64.85 142.73 16.54 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.152 0 O-C-N 121.665 -0.647 . . . . 0.0 110.496 -172.066 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 6.7 p -121.22 -26.46 5.07 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.758 -0.589 . . . . 0.0 111.363 179.09 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 6.9 t-20 -162.07 160.49 27.49 Favored 'General case' 0 N--CA 1.499 2.009 0 C-N-CA 118.93 -1.108 . . . . 0.0 111.912 -179.109 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 86.8 t80 -150.03 127.49 11.49 Favored 'General case' 0 N--CA 1.498 1.935 0 N-CA-C 109.136 -0.69 . . . . 0.0 109.136 169.18 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 17.9 t70 -99.43 130.41 45.7 Favored 'General case' 0 N--CA 1.492 1.654 0 N-CA-C 109.002 -0.74 . . . . 0.0 109.002 -177.726 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 23.1 t -68.8 -50.31 51.23 Favored 'General case' 0 N--CA 1.498 1.956 0 C-N-CA 120.097 -0.641 . . . . 0.0 110.538 -176.268 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 21.8 t -59.57 -43.0 93.72 Favored 'General case' 0 N--CA 1.502 2.147 0 O-C-N 121.614 -0.679 . . . . 0.0 110.907 -174.415 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 91.6 m-20 -103.47 -10.02 18.87 Favored 'General case' 0 N--CA 1.498 1.929 0 O-C-N 121.628 -0.67 . . . . 0.0 111.615 -178.079 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 1.9 m 49.94 67.34 0.92 Allowed 'General case' 0 N--CA 1.508 2.443 0 O-C-N 121.072 -1.018 . . . . 0.0 110.938 -174.284 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 46.9 mm -124.31 126.51 72.17 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.09 0 O-C-N 121.615 -0.678 . . . . 0.0 109.472 -175.753 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 11.7 tp -115.8 121.17 41.64 Favored 'General case' 0 N--CA 1.494 1.75 0 O-C-N 121.692 -0.63 . . . . 0.0 110.517 -169.243 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 78.9 mt-30 -91.27 134.33 34.66 Favored 'General case' 0 N--CA 1.491 1.577 0 N-CA-C 109.436 -0.579 . . . . 0.0 109.436 173.684 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 89.3 mt -117.78 123.85 46.98 Favored 'General case' 0 N--CA 1.497 1.891 0 O-C-N 121.729 -0.607 . . . . 0.0 109.862 173.635 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 64.8 ttt180 -97.12 108.4 21.12 Favored 'General case' 0 N--CA 1.497 1.918 0 O-C-N 121.678 -0.639 . . . . 0.0 109.813 176.371 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 19.1 tp -84.81 151.85 24.05 Favored 'General case' 0 N--CA 1.494 1.77 0 O-C-N 121.758 -0.589 . . . . 0.0 110.925 -174.522 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -65.88 -6.69 13.05 Favored 'General case' 0 N--CA 1.503 2.176 0 O-C-N 121.97 -0.456 . . . . 0.0 111.951 -172.481 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 91.6 m-20 -86.58 27.81 0.93 Allowed 'General case' 0 N--CA 1.498 1.974 0 O-C-N 121.103 -0.998 . . . . 0.0 110.909 174.73 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 7.9 t70 62.99 29.45 16.43 Favored 'General case' 0 N--CA 1.505 2.275 0 O-C-N 121.078 -1.014 . . . . 0.0 110.52 175.591 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 51.0 m -123.19 137.85 54.79 Favored 'General case' 0 N--CA 1.496 1.872 0 O-C-N 121.36 -0.837 . . . . 0.0 110.411 -179.651 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 8.9 t -98.89 151.02 21.31 Favored 'General case' 0 N--CA 1.497 1.902 0 O-C-N 121.754 -0.591 . . . . 0.0 110.278 176.08 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 85.4 tttt -149.81 119.12 6.83 Favored 'General case' 0 N--CA 1.494 1.767 0 O-C-N 121.579 -0.7 . . . . 0.0 110.301 178.183 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 91.2 p -96.12 122.87 39.42 Favored 'General case' 0 N--CA 1.496 1.827 0 O-C-N 121.647 -0.658 . . . . 0.0 110.175 178.653 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 82.3 mt -129.32 136.2 60.0 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.871 0 O-C-N 121.698 -0.626 . . . . 0.0 109.377 179.682 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 59.3 t -82.37 127.6 39.5 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.91 0 O-C-N 121.6 -0.687 . . . . 0.0 109.196 178.762 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 37.5 p -59.92 -24.88 64.7 Favored 'General case' 0 N--CA 1.505 2.302 0 O-C-N 121.563 -0.711 . . . . 0.0 112.021 -170.265 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 91.4 mttt -56.84 -23.65 45.62 Favored 'General case' 0 N--CA 1.503 2.204 0 O-C-N 121.461 -0.774 . . . . 0.0 111.006 -176.616 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 45.7 p30 -84.34 2.75 38.96 Favored 'General case' 0 N--CA 1.498 1.957 0 C-N-CA 119.718 -0.793 . . . . 0.0 111.402 176.407 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 98.9 mt -75.12 126.15 35.55 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.119 0 O-C-N 121.204 -0.935 . . . . 0.0 109.997 178.17 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 40.9 tttp -92.79 -28.87 16.3 Favored 'General case' 0 N--CA 1.493 1.722 0 O-C-N 121.848 -0.532 . . . . 0.0 109.954 171.111 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 5.3 m-20 -163.98 155.27 16.14 Favored 'General case' 0 N--CA 1.501 2.086 0 O-C-N 121.806 -0.559 . . . . 0.0 110.005 -178.033 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 85.2 mt -132.95 149.03 52.27 Favored 'General case' 0 N--CA 1.496 1.833 0 O-C-N 121.708 -0.62 . . . . 0.0 110.563 -178.973 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 6.6 ptm180 -151.52 136.05 16.99 Favored 'General case' 0 N--CA 1.497 1.88 0 O-C-N 121.784 -0.573 . . . . 0.0 109.893 175.262 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 68.7 mt -84.42 133.18 29.84 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.893 0 O-C-N 121.424 -0.798 . . . . 0.0 109.876 175.841 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 32.3 mt . . . . . 0 N--CA 1.497 1.909 0 O-C-N 121.581 -0.7 . . . . 0.0 110.01 179.619 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' B' B ' 257' ' ' SER . . . . . . . . . . . . . 24.3 m . . . . . 0 N--CA 1.503 2.213 0 CA-C-O 121.348 0.594 . . . . 0.0 110.389 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' B' B ' 258' ' ' SER . . . . . . . . . . . . . 24.0 m -69.56 -32.75 71.72 Favored 'General case' 0 N--CA 1.498 1.934 0 C-N-CA 120.501 -0.48 . . . . 0.0 110.252 179.189 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 259' ' ' GLN . . . . . . . . . . . . . 48.4 tt0 -63.05 -37.85 88.82 Favored 'General case' 0 N--CA 1.501 2.085 0 O-C-N 121.66 -0.65 . . . . 0.0 110.494 -179.248 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 260' ' ' LEU . . . . . . . . . . . . . 84.5 mt -67.47 -42.68 82.61 Favored 'General case' 0 N--CA 1.499 2.01 0 O-C-N 121.611 -0.681 . . . . 0.0 110.154 179.69 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 261' ' ' LEU . . . . . . . . . . . . . 23.1 tp -69.65 -35.87 75.57 Favored 'General case' 0 N--CA 1.497 1.913 0 O-C-N 121.665 -0.647 . . . . 0.0 109.743 175.802 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 262' ' ' SER . . . . . . . . . . . . . 22.8 t -62.72 -38.29 89.89 Favored 'General case' 0 N--CA 1.5 2.074 0 O-C-N 121.743 -0.598 . . . . 0.0 110.634 178.013 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 263' ' ' LEU . . . . . . . . . . . . . 34.9 mt . . . . . 0 N--CA 1.501 2.123 0 O-C-N 121.673 -0.642 . . . . 0.0 110.221 -179.306 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 70.8 m . . . . . 0 N--CA 1.494 1.755 0 CA-C-O 120.982 0.42 . . . . 0.0 110.057 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 67.1 t -66.69 -27.92 41.56 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.084 0 O-C-N 121.652 -0.655 . . . . 0.0 110.086 179.474 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -55.02 -30.46 59.56 Favored 'General case' 0 N--CA 1.505 2.289 0 O-C-N 121.451 -0.781 . . . . 0.0 110.395 -179.523 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 74.4 m-20 -68.46 -31.15 70.25 Favored 'General case' 0 N--CA 1.499 1.99 0 O-C-N 121.802 -0.561 . . . . 0.0 110.186 174.676 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 96.1 m-85 -96.02 10.07 38.67 Favored 'General case' 0 N--CA 1.498 1.948 0 O-C-N 121.712 -0.618 . . . . 0.0 111.469 -178.755 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 3.6 m-30 -67.19 140.28 57.46 Favored 'General case' 0 N--CA 1.503 2.178 0 O-C-N 121.153 -0.967 . . . . 0.0 110.102 174.647 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 82.33 0.05 89.43 Favored Glycine 0 N--CA 1.497 2.727 0 N-CA-C 110.574 -1.01 . . . . 0.0 110.574 -175.982 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 30.2 t -77.41 134.91 38.3 Favored 'General case' 0 N--CA 1.497 1.912 0 O-C-N 121.129 -1.218 . . . . 0.0 110.492 179.208 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 11.8 t-20 -83.23 118.73 23.83 Favored 'General case' 0 N--CA 1.497 1.889 0 O-C-N 121.625 -0.672 . . . . 0.0 109.596 173.063 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 35.6 m -142.45 161.68 19.04 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.678 0 O-C-N 121.674 -0.641 . . . . 0.0 109.741 -177.381 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 46.7 tt0 -109.32 147.41 32.74 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.684 -0.635 . . . . 0.0 109.632 177.103 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 60.9 t -137.14 126.41 36.43 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.743 0 O-C-N 121.621 -0.674 . . . . 0.0 109.709 -175.36 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 23.7 tp -95.89 129.79 43.04 Favored 'General case' 0 N--CA 1.492 1.646 0 N-CA-C 109.432 -0.581 . . . . 0.0 109.432 176.525 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 82.3 mt -90.6 170.14 10.42 Favored 'General case' 0 N--CA 1.496 1.857 0 O-C-N 121.657 -0.652 . . . . 0.0 110.565 -175.53 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 23.9 p30 -56.8 -22.95 39.98 Favored 'General case' 0 N--CA 1.506 2.351 0 O-C-N 121.751 -0.593 . . . . 0.0 111.51 -177.799 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 53.6 p-10 -94.2 24.15 4.58 Favored 'General case' 0 N--CA 1.497 1.89 0 O-C-N 121.535 -0.728 . . . . 0.0 110.733 -177.714 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 10.4 m-20 59.41 28.43 17.8 Favored 'General case' 0 N--CA 1.506 2.346 0 O-C-N 121.446 -0.783 . . . . 0.0 110.607 175.721 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 50.3 m -103.87 144.83 30.98 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.437 -0.789 . . . . 0.0 109.659 172.359 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 97.2 mttt -109.57 145.07 36.99 Favored 'General case' 0 N--CA 1.495 1.791 0 O-C-N 121.543 -0.723 . . . . 0.0 110.665 -176.166 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -153.05 133.4 13.58 Favored 'General case' 0 N--CA 1.496 1.86 0 O-C-N 121.713 -0.617 . . . . 0.0 110.229 176.359 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 35.1 ptt180 -128.48 144.78 51.2 Favored 'General case' 0 N--CA 1.498 1.957 0 O-C-N 121.685 -0.634 . . . . 0.0 110.39 -178.009 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -171.78 171.43 44.1 Favored Glycine 0 N--CA 1.496 2.635 0 N-CA-C 109.229 -1.548 . . . . 0.0 109.229 -175.36 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 47.4 t -94.59 119.11 42.11 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.986 0 O-C-N 121.609 -0.936 . . . . 0.0 109.355 -176.968 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 89.7 mt -64.29 143.57 15.57 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.163 0 O-C-N 121.704 -0.623 . . . . 0.0 110.56 -171.381 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 10.1 p -121.24 -25.89 5.17 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.773 -0.58 . . . . 0.0 111.237 178.246 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 2.0 t-20 -162.28 158.07 23.76 Favored 'General case' 0 N--CA 1.501 2.121 0 O-C-N 121.0 -1.063 . . . . 0.0 111.774 -179.08 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 91.2 t80 -150.16 124.29 9.43 Favored 'General case' 0 N--CA 1.5 2.056 0 N-CA-C 109.361 -0.607 . . . . 0.0 109.361 171.428 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . 0.402 ' O ' ' N ' ' A' ' 33' ' ' SER . 21.7 t70 -98.12 126.27 43.49 Favored 'General case' 0 N--CA 1.492 1.658 0 N-CA-C 109.091 -0.707 . . . . 0.0 109.091 -179.296 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 87.0 p -65.16 -43.03 93.1 Favored 'General case' 0 N--CA 1.5 2.07 0 O-C-N 121.65 -0.656 . . . . 0.0 110.778 -174.143 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 19.6 m -60.21 -48.05 83.37 Favored 'General case' 0 N--CA 1.503 2.196 0 O-C-N 121.522 -0.736 . . . . 0.0 110.884 -173.573 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 91.7 m-20 -107.07 -0.05 23.18 Favored 'General case' 0 N--CA 1.498 1.961 0 O-C-N 121.621 -0.675 . . . . 0.0 111.697 -179.258 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 33' ' ' SER . . . . . 0.402 ' N ' ' O ' ' A' ' 29' ' ' ASP . 38.8 p 45.71 67.08 0.79 Allowed 'General case' 0 N--CA 1.508 2.45 0 O-C-N 121.423 -0.798 . . . . 0.0 111.142 -174.754 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 44.8 mm -114.5 125.79 71.89 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.981 0 O-C-N 121.553 -0.717 . . . . 0.0 109.222 -175.917 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 11.3 tp -115.84 120.52 39.53 Favored 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.633 -0.667 . . . . 0.0 110.53 -168.605 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 67.3 mt-30 -91.04 132.11 36.21 Favored 'General case' 0 N--CA 1.489 1.51 0 N-CA-C 109.201 -0.666 . . . . 0.0 109.201 171.952 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 16.7 mt -117.77 123.76 46.77 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.812 -0.555 . . . . 0.0 110.07 175.837 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 72.8 ttt180 -96.29 104.95 16.95 Favored 'General case' 0 N--CA 1.496 1.868 0 O-C-N 121.721 -0.612 . . . . 0.0 109.79 176.001 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 18.4 tp -84.56 153.63 23.13 Favored 'General case' 0 N--CA 1.495 1.803 0 O-C-N 121.699 -0.626 . . . . 0.0 110.949 -173.602 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -67.46 -4.59 11.77 Favored 'General case' 0 N--CA 1.503 2.201 0 O-C-N 121.895 -0.503 . . . . 0.0 111.986 -171.753 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 30.1 m120 -87.1 27.62 1.01 Allowed 'General case' 0 N--CA 1.498 1.925 0 O-C-N 121.063 -1.023 . . . . 0.0 110.871 174.063 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 15.3 t0 63.13 29.28 16.16 Favored 'General case' 0 N--CA 1.505 2.286 0 O-C-N 121.079 -1.013 . . . . 0.0 110.521 175.848 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 48.7 m -125.65 137.85 53.89 Favored 'General case' 0 N--CA 1.495 1.818 0 O-C-N 121.357 -0.839 . . . . 0.0 110.528 -179.33 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 9.7 t -97.94 151.03 20.7 Favored 'General case' 0 N--CA 1.497 1.917 0 O-C-N 121.764 -0.585 . . . . 0.0 110.122 174.986 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 42.1 tttp -148.96 119.09 7.21 Favored 'General case' 0 N--CA 1.496 1.84 0 O-C-N 121.562 -0.711 . . . . 0.0 110.384 179.049 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 90.3 p -96.46 120.34 36.6 Favored 'General case' 0 N--CA 1.495 1.805 0 O-C-N 121.712 -0.617 . . . . 0.0 110.286 179.271 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 82.5 mt -129.42 138.89 53.16 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.908 0 O-C-N 121.712 -0.618 . . . . 0.0 109.343 179.251 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 63.2 t -82.12 127.69 39.39 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.955 0 C-N-CA 120.001 -0.679 . . . . 0.0 109.207 178.54 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 41.9 p -59.34 -25.08 63.9 Favored 'General case' 0 N--CA 1.504 2.235 0 O-C-N 121.624 -0.672 . . . . 0.0 112.059 -169.449 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 60.0 tttt -57.58 -23.15 49.2 Favored 'General case' 0 N--CA 1.502 2.149 0 O-C-N 121.546 -0.721 . . . . 0.0 111.261 -175.524 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 10.3 p30 -81.17 -3.46 52.26 Favored 'General case' 0 N--CA 1.499 2.01 0 C-N-CA 119.702 -0.799 . . . . 0.0 111.058 176.078 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 95.8 mt -79.79 135.28 25.84 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.021 0 O-C-N 121.265 -0.897 . . . . 0.0 110.219 177.926 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 83.6 tttt -92.08 -28.47 17.11 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.9 -0.5 . . . . 0.0 109.785 170.294 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -164.83 158.46 17.42 Favored 'General case' 0 N--CA 1.503 2.204 0 O-C-N 121.735 -0.603 . . . . 0.0 110.287 -177.012 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 4.2 mp -132.93 153.64 51.21 Favored 'General case' 0 N--CA 1.497 1.893 0 O-C-N 121.74 -0.6 . . . . 0.0 110.411 178.227 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 20.1 ptp180 -151.87 146.39 25.63 Favored 'General case' 0 N--CA 1.496 1.863 0 O-C-N 121.719 -0.613 . . . . 0.0 109.964 175.549 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 62.4 mt -85.54 133.32 29.78 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.956 0 O-C-N 121.559 -0.713 . . . . 0.0 109.87 173.732 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 61.3 mt . . . . . 0 N--CA 1.498 1.946 0 O-C-N 121.559 -0.713 . . . . 0.0 110.073 -177.971 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' B' B ' 257' ' ' SER . . . . . . . . . . . . . 27.1 m . . . . . 0 N--CA 1.503 2.195 0 CA-C-O 121.091 0.472 . . . . 0.0 110.643 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' B' B ' 258' ' ' SER . . . . . . . . . . . . . 60.2 p -69.32 -30.87 69.02 Favored 'General case' 0 N--CA 1.5 2.029 0 C-N-CA 120.366 -0.534 . . . . 0.0 110.4 -177.604 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 259' ' ' GLN . . . . . . . . . . . . . 47.4 tt0 -64.96 -40.1 94.48 Favored 'General case' 0 N--CA 1.5 2.051 0 O-C-N 121.623 -0.673 . . . . 0.0 110.395 -179.721 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 260' ' ' LEU . . . . . . . . . . . . . 83.7 mt -68.84 -38.98 80.19 Favored 'General case' 0 N--CA 1.499 1.993 0 O-C-N 121.686 -0.634 . . . . 0.0 110.243 179.882 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 261' ' ' LEU . . . . . . . . . . . . . 29.6 tp -67.91 -36.98 81.13 Favored 'General case' 0 N--CA 1.498 1.965 0 O-C-N 121.638 -0.664 . . . . 0.0 110.018 179.064 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 262' ' ' SER . . . . . . . . . . . . . 23.0 t -62.48 -38.54 90.25 Favored 'General case' 0 N--CA 1.501 2.101 0 O-C-N 121.754 -0.591 . . . . 0.0 110.465 177.587 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 263' ' ' LEU . . . . . . . . . . . . . 45.7 mt . . . . . 0 N--CA 1.501 2.076 0 O-C-N 121.663 -0.648 . . . . 0.0 110.363 179.208 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 68.6 m . . . . . 0 N--CA 1.496 1.858 0 CA-C-O 120.933 0.397 . . . . 0.0 110.047 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 78.5 t -66.64 -27.75 41.09 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.06 0 O-C-N 121.699 -0.626 . . . . 0.0 110.303 -178.543 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -55.33 -31.53 61.77 Favored 'General case' 0 N--CA 1.504 2.272 0 O-C-N 121.375 -0.828 . . . . 0.0 110.399 -178.828 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 74.4 m-20 -69.04 -30.64 69.04 Favored 'General case' 0 N--CA 1.499 2.0 0 O-C-N 121.85 -0.531 . . . . 0.0 110.283 174.845 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 91.0 m-85 -95.4 10.02 37.86 Favored 'General case' 0 N--CA 1.497 1.917 0 O-C-N 121.59 -0.694 . . . . 0.0 111.536 -178.08 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 2.9 m-30 -67.2 134.57 51.95 Favored 'General case' 0 N--CA 1.502 2.163 0 O-C-N 121.072 -1.017 . . . . 0.0 109.941 173.953 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 83.49 -1.05 89.3 Favored Glycine 0 N--CA 1.496 2.676 0 N-CA-C 110.84 -0.904 . . . . 0.0 110.84 -178.046 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 83.1 p -77.82 137.59 38.5 Favored 'General case' 0 N--CA 1.499 2.01 0 O-C-N 121.064 -1.257 . . . . 0.0 110.516 176.855 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 27.0 t-20 -85.17 119.28 25.38 Favored 'General case' 0 N--CA 1.498 1.952 0 O-C-N 121.592 -0.692 . . . . 0.0 109.925 174.102 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 35.2 m -142.5 163.02 18.37 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.729 0 N-CA-C 109.448 -0.575 . . . . 0.0 109.448 -179.837 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 41.8 tt0 -109.34 127.4 54.3 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.489 -0.757 . . . . 0.0 110.072 178.236 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 55.5 t -106.83 124.78 62.7 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.744 0 O-C-N 121.619 -0.675 . . . . 0.0 109.913 -177.848 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 22.2 tp -96.02 126.73 41.46 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.687 -0.633 . . . . 0.0 109.456 174.31 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 86.3 mt -97.46 166.37 11.56 Favored 'General case' 0 N--CA 1.495 1.819 0 O-C-N 121.588 -0.695 . . . . 0.0 111.167 -171.38 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 16.7 p30 -58.09 -22.62 51.33 Favored 'General case' 0 N--CA 1.506 2.333 0 O-C-N 121.746 -0.596 . . . . 0.0 111.535 -177.277 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 40.3 p-10 -93.0 23.56 4.18 Favored 'General case' 0 N--CA 1.497 1.918 0 O-C-N 121.571 -0.705 . . . . 0.0 110.847 -176.551 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 74.3 m-20 59.1 27.7 16.75 Favored 'General case' 0 N--CA 1.505 2.292 0 O-C-N 121.398 -0.814 . . . . 0.0 110.671 175.838 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 50.5 m -104.62 133.98 48.55 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.502 -0.749 . . . . 0.0 109.63 172.339 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 30.2 ttmt -109.66 138.76 45.56 Favored 'General case' 0 N--CA 1.495 1.793 0 O-C-N 121.715 -0.616 . . . . 0.0 110.413 -176.008 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -153.02 160.54 43.0 Favored 'General case' 0 N--CA 1.496 1.845 0 O-C-N 121.718 -0.614 . . . . 0.0 110.278 179.438 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 6.8 ptp85 -140.69 154.44 46.37 Favored 'General case' 0 N--CA 1.496 1.831 0 O-C-N 121.665 -0.647 . . . . 0.0 110.355 -179.914 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -171.85 171.13 43.95 Favored Glycine 0 N--CA 1.494 2.527 0 N-CA-C 109.059 -1.616 . . . . 0.0 109.059 179.429 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 40.9 t -94.7 123.05 46.67 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.983 0 O-C-N 121.66 -0.906 . . . . 0.0 109.259 176.3 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 96.0 mt -63.18 141.43 18.14 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.182 0 O-C-N 121.62 -0.675 . . . . 0.0 110.499 -171.953 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 12.2 p -121.15 -25.41 5.3 Favored 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.818 -0.551 . . . . 0.0 111.229 -179.545 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 2.0 t-20 -163.38 161.42 24.44 Favored 'General case' 0 N--CA 1.5 2.075 0 O-C-N 120.901 -1.124 . . . . 0.0 111.849 178.864 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 84.5 t80 -150.03 129.0 12.59 Favored 'General case' 0 N--CA 1.498 1.963 0 N-CA-C 109.23 -0.655 . . . . 0.0 109.23 169.032 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 21.2 t70 -98.77 131.23 45.06 Favored 'General case' 0 N--CA 1.492 1.625 0 N-CA-C 109.031 -0.729 . . . . 0.0 109.031 -178.359 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 87.4 p -69.81 -50.64 41.01 Favored 'General case' 0 N--CA 1.498 1.953 0 C-N-CA 120.032 -0.667 . . . . 0.0 110.616 -175.35 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 5.2 t -59.63 -42.61 93.1 Favored 'General case' 0 N--CA 1.502 2.131 0 O-C-N 121.567 -0.708 . . . . 0.0 110.782 -174.632 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 28.6 m120 -103.79 -10.06 18.56 Favored 'General case' 0 N--CA 1.496 1.875 0 O-C-N 121.663 -0.648 . . . . 0.0 111.518 -177.266 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 2.1 m 49.94 67.31 0.92 Allowed 'General case' 0 N--CA 1.508 2.452 0 O-C-N 121.027 -1.046 . . . . 0.0 110.876 -174.153 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 45.8 mm -123.51 125.86 72.18 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.043 0 O-C-N 121.519 -0.738 . . . . 0.0 109.333 -175.698 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 9.5 tp -115.7 122.73 46.42 Favored 'General case' 0 N--CA 1.495 1.792 0 O-C-N 121.701 -0.624 . . . . 0.0 110.628 -168.639 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 78.4 mt-30 -91.03 133.22 35.49 Favored 'General case' 0 N--CA 1.49 1.562 0 N-CA-C 109.445 -0.576 . . . . 0.0 109.445 172.318 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 13.7 mt -117.83 123.54 46.16 Favored 'General case' 0 N--CA 1.494 1.772 0 C-N-CA 120.224 -0.59 . . . . 0.0 110.036 174.676 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 63.3 ttt180 -104.5 105.01 14.96 Favored 'General case' 0 N--CA 1.495 1.811 0 O-C-N 121.761 -0.587 . . . . 0.0 110.132 174.62 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 62.9 tp -83.65 155.45 23.18 Favored 'General case' 0 N--CA 1.499 1.977 0 O-C-N 121.535 -0.728 . . . . 0.0 110.679 -176.086 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -67.19 -3.1 6.8 Favored 'General case' 0 N--CA 1.503 2.22 0 O-C-N 121.806 -0.559 . . . . 0.0 112.154 -170.497 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 35.4 p-10 -85.75 28.99 0.73 Allowed 'General case' 0 N--CA 1.499 1.993 0 O-C-N 121.044 -1.035 . . . . 0.0 110.937 173.166 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 74.1 m-20 59.05 29.28 18.8 Favored 'General case' 0 N--CA 1.505 2.298 0 O-C-N 121.26 -0.9 . . . . 0.0 110.357 177.138 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 68.9 m -121.5 141.93 50.55 Favored 'General case' 0 N--CA 1.494 1.758 0 O-C-N 121.502 -0.748 . . . . 0.0 109.99 177.112 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 9.0 t -128.16 147.37 50.55 Favored 'General case' 0 N--CA 1.495 1.816 0 O-C-N 121.621 -0.674 . . . . 0.0 109.966 179.903 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 77.1 tttt -150.76 134.11 16.26 Favored 'General case' 0 N--CA 1.495 1.798 0 C-N-CA 120.157 -0.617 . . . . 0.0 110.595 -177.325 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 88.4 p -94.72 123.04 37.94 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.817 -0.552 . . . . 0.0 110.105 177.93 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 82.2 mt -129.25 137.92 55.76 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.857 0 N-CA-C 109.252 -0.648 . . . . 0.0 109.252 179.683 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 58.7 t -82.41 127.61 39.48 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.874 0 O-C-N 121.598 -0.689 . . . . 0.0 109.297 179.638 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 34.2 p -59.88 -24.89 64.64 Favored 'General case' 0 N--CA 1.504 2.269 0 O-C-N 121.552 -0.717 . . . . 0.0 112.052 -170.727 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 51.4 mttm -57.14 -25.23 58.55 Favored 'General case' 0 N--CA 1.503 2.224 0 O-C-N 121.474 -0.766 . . . . 0.0 110.96 -176.289 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 6.4 p30 -84.35 4.85 29.39 Favored 'General case' 0 N--CA 1.499 1.998 0 C-N-CA 119.659 -0.817 . . . . 0.0 111.381 176.295 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 98.9 mt -75.59 127.72 37.1 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.13 0 O-C-N 121.119 -0.988 . . . . 0.0 109.831 175.953 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 85.3 tttt -92.9 -29.62 15.82 Favored 'General case' 0 N--CA 1.493 1.697 0 O-C-N 121.853 -0.53 . . . . 0.0 109.738 170.844 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 5.3 m-20 -164.09 155.18 15.77 Favored 'General case' 0 N--CA 1.5 2.048 0 O-C-N 121.821 -0.549 . . . . 0.0 110.091 -177.715 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 80.0 mt -132.95 148.97 52.28 Favored 'General case' 0 N--CA 1.496 1.861 0 O-C-N 121.675 -0.641 . . . . 0.0 110.4 -179.346 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 19.7 ptp180 -150.8 146.46 26.39 Favored 'General case' 0 N--CA 1.496 1.874 0 O-C-N 121.75 -0.594 . . . . 0.0 109.933 174.937 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 59.2 mt -86.98 133.24 30.45 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.866 0 O-C-N 121.497 -0.752 . . . . 0.0 109.97 173.455 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 73.0 mt . . . . . 0 N--CA 1.498 1.955 0 O-C-N 121.628 -0.67 . . . . 0.0 110.153 -179.205 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' B' B ' 257' ' ' SER . . . . . . . . . . . . . 23.6 m . . . . . 0 N--CA 1.502 2.139 0 CA-C-O 121.231 0.539 . . . . 0.0 110.546 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' B' B ' 258' ' ' SER . . . . . . . . . . . . . 62.4 p -70.3 -31.79 69.27 Favored 'General case' 0 N--CA 1.498 1.973 0 C-N-CA 120.306 -0.558 . . . . 0.0 110.373 -179.265 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 259' ' ' GLN . . . . . . . . . . . . . 77.7 mt-30 -65.39 -34.87 79.32 Favored 'General case' 0 N--CA 1.501 2.085 0 O-C-N 121.597 -0.69 . . . . 0.0 110.361 -179.986 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 260' ' ' LEU . . . . . . . . . . . . . 82.7 mt -68.48 -40.93 80.75 Favored 'General case' 0 N--CA 1.499 2.018 0 O-C-N 121.661 -0.649 . . . . 0.0 110.19 179.878 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 261' ' ' LEU . . . . . . . . . . . . . 24.6 tp -69.81 -40.77 75.75 Favored 'General case' 0 N--CA 1.498 1.967 0 O-C-N 121.671 -0.643 . . . . 0.0 109.972 177.678 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 262' ' ' SER . . . . . . . . . . . . . 83.5 p -63.07 -33.85 76.34 Favored 'General case' 0 N--CA 1.501 2.081 0 O-C-N 121.678 -0.639 . . . . 0.0 110.462 177.64 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 263' ' ' LEU . . . . . . . . . . . . . 25.3 mt . . . . . 0 N--CA 1.501 2.118 0 O-C-N 121.606 -0.684 . . . . 0.0 110.204 178.682 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 73.9 m . . . . . 0 N--CA 1.496 1.87 0 CA-C-O 121.1 0.476 . . . . 0.0 110.435 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 55.9 t -64.97 -27.95 43.63 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.165 0 O-C-N 121.707 -0.621 . . . . 0.0 110.408 -179.298 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -55.45 -31.39 61.91 Favored 'General case' 0 N--CA 1.504 2.234 0 O-C-N 121.418 -0.801 . . . . 0.0 110.515 -178.664 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 74.4 m-20 -68.5 -34.24 75.54 Favored 'General case' 0 N--CA 1.499 1.984 0 O-C-N 121.793 -0.567 . . . . 0.0 109.973 174.787 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 96.6 m-85 -97.5 10.12 40.64 Favored 'General case' 0 N--CA 1.496 1.867 0 O-C-N 121.732 -0.605 . . . . 0.0 111.246 178.931 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -67.41 127.95 34.61 Favored 'General case' 0 N--CA 1.501 2.09 0 O-C-N 121.223 -0.923 . . . . 0.0 110.162 -178.661 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 83.24 -2.11 87.58 Favored Glycine 0 N--CA 1.498 2.77 0 N-CA-C 110.851 -0.899 . . . . 0.0 110.851 -177.51 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 57.0 p -76.85 145.05 38.61 Favored 'General case' 0 N--CA 1.498 1.949 0 O-C-N 120.969 -1.312 . . . . 0.0 110.168 177.499 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 2.3 m-20 -85.21 119.27 25.41 Favored 'General case' 0 N--CA 1.496 1.87 0 O-C-N 121.644 -0.66 . . . . 0.0 109.598 174.785 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 32.9 m -142.44 159.84 19.42 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.846 0 O-C-N 121.69 -0.631 . . . . 0.0 109.754 179.885 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 12' ' ' GLU . . . . . 0.441 ' HA ' ' HA ' ' A' ' 22' ' ' ARG . 46.5 tt0 -109.4 128.94 55.52 Favored 'General case' 0 N--CA 1.494 1.731 0 C-N-CA 119.912 -0.715 . . . . 0.0 110.169 179.023 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 60.4 t -106.78 127.69 62.1 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.766 0 O-C-N 121.728 -0.608 . . . . 0.0 109.957 -179.289 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 29.0 tp -95.74 127.73 42.02 Favored 'General case' 0 N--CA 1.494 1.733 0 N-CA-C 109.125 -0.695 . . . . 0.0 109.125 173.776 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 83.8 mt -96.05 168.27 10.72 Favored 'General case' 0 N--CA 1.495 1.821 0 O-C-N 121.653 -0.654 . . . . 0.0 111.097 -172.846 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 24.2 p30 -57.89 -22.06 46.48 Favored 'General case' 0 N--CA 1.506 2.333 0 O-C-N 121.815 -0.553 . . . . 0.0 111.484 -178.537 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 25.1 p30 -91.29 22.36 3.91 Favored 'General case' 0 N--CA 1.499 1.996 0 O-C-N 121.586 -0.696 . . . . 0.0 111.078 -177.364 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 74.4 m-20 59.79 28.53 18.01 Favored 'General case' 0 N--CA 1.506 2.361 0 O-C-N 121.393 -0.817 . . . . 0.0 110.813 172.805 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 17.9 m -111.49 147.32 35.58 Favored 'General case' 0 N--CA 1.494 1.743 0 O-C-N 121.474 -0.766 . . . . 0.0 109.573 171.229 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 97.1 mttt -109.59 150.29 28.43 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.616 -0.677 . . . . 0.0 110.608 -177.248 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -153.01 154.15 34.35 Favored 'General case' 0 N--CA 1.496 1.867 0 O-C-N 121.824 -0.548 . . . . 0.0 109.999 176.188 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . 0.441 ' HA ' ' HA ' ' A' ' 12' ' ' GLU . 7.7 ptp85 -138.22 150.41 46.71 Favored 'General case' 0 N--CA 1.494 1.765 0 O-C-N 121.569 -0.707 . . . . 0.0 110.494 179.75 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -171.83 171.16 43.96 Favored Glycine 0 N--CA 1.492 2.383 0 N-CA-C 109.069 -1.613 . . . . 0.0 109.069 -178.958 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 40.6 t -94.48 125.39 47.1 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.912 0 O-C-N 121.676 -0.896 . . . . 0.0 109.082 176.156 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 45.7 mt -61.23 137.03 24.13 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.259 0 O-C-N 121.568 -0.707 . . . . 0.0 110.824 -171.554 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 10.0 p -121.15 -19.81 6.99 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.921 -0.487 . . . . 0.0 111.581 -178.25 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 11.2 t30 -165.74 158.14 14.97 Favored 'General case' 0 N--CA 1.504 2.268 0 O-C-N 120.886 -1.134 . . . . 0.0 111.937 176.517 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 77.2 t80 -150.34 119.99 7.0 Favored 'General case' 0 N--CA 1.496 1.853 0 N-CA-C 109.101 -0.703 . . . . 0.0 109.101 172.618 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 21.2 t70 -98.21 128.28 44.59 Favored 'General case' 0 N--CA 1.492 1.641 0 N-CA-C 109.248 -0.649 . . . . 0.0 109.248 -176.949 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 22.7 m -67.48 -47.97 68.51 Favored 'General case' 0 N--CA 1.498 1.956 0 O-C-N 121.578 -0.701 . . . . 0.0 110.661 -175.856 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 22.2 m -59.32 -45.49 91.2 Favored 'General case' 0 N--CA 1.502 2.164 0 O-C-N 121.591 -0.693 . . . . 0.0 110.897 -174.058 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 91.4 m-20 -105.53 -5.63 20.05 Favored 'General case' 0 N--CA 1.496 1.861 0 O-C-N 121.63 -0.669 . . . . 0.0 111.743 -177.973 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 58.7 m 49.42 67.18 0.93 Allowed 'General case' 0 N--CA 1.508 2.461 0 O-C-N 121.023 -1.048 . . . . 0.0 110.925 -174.277 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 44.5 mm -117.7 125.9 74.4 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.974 0 O-C-N 121.537 -0.727 . . . . 0.0 109.236 -175.407 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 11.0 tp -115.93 118.97 34.44 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.687 -0.633 . . . . 0.0 110.477 -170.539 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 78.2 mt-30 -91.51 133.34 35.59 Favored 'General case' 0 N--CA 1.49 1.537 0 N-CA-C 109.333 -0.617 . . . . 0.0 109.333 171.872 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 52.0 mt -117.84 123.55 46.17 Favored 'General case' 0 N--CA 1.493 1.684 0 C-N-CA 120.222 -0.591 . . . . 0.0 110.009 174.535 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 40.7 ttp180 -105.65 104.97 14.8 Favored 'General case' 0 N--CA 1.496 1.826 0 O-C-N 121.758 -0.589 . . . . 0.0 110.126 174.137 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 64.5 tp -83.59 156.53 22.7 Favored 'General case' 0 N--CA 1.499 1.982 0 O-C-N 121.64 -0.663 . . . . 0.0 110.616 -175.977 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -68.05 -3.03 8.88 Favored 'General case' 0 N--CA 1.502 2.166 0 O-C-N 121.898 -0.501 . . . . 0.0 112.208 -170.582 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 30.1 m120 -86.75 29.13 0.82 Allowed 'General case' 0 N--CA 1.499 1.986 0 O-C-N 121.104 -0.997 . . . . 0.0 110.782 173.734 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 73.1 m-20 60.76 31.54 20.1 Favored 'General case' 0 N--CA 1.506 2.332 0 O-C-N 121.213 -0.929 . . . . 0.0 110.278 175.728 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 67.0 m -125.76 138.62 53.86 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.447 -0.783 . . . . 0.0 109.981 177.33 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 9.1 t -128.21 147.26 50.57 Favored 'General case' 0 N--CA 1.496 1.85 0 O-C-N 121.652 -0.655 . . . . 0.0 109.988 179.511 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 7.6 tmtm? -150.63 135.93 17.84 Favored 'General case' 0 N--CA 1.495 1.794 0 O-C-N 121.666 -0.646 . . . . 0.0 110.439 -177.959 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 88.5 p -94.67 124.51 38.75 Favored 'General case' 0 N--CA 1.495 1.813 0 O-C-N 121.745 -0.597 . . . . 0.0 110.208 178.372 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 82.8 mt -129.32 133.92 64.69 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.894 0 O-C-N 121.687 -0.633 . . . . 0.0 109.356 179.238 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 63.6 t -81.88 127.74 39.33 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.925 0 C-N-CA 119.999 -0.68 . . . . 0.0 109.182 179.214 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 80.8 p -57.37 -25.06 58.87 Favored 'General case' 0 N--CA 1.506 2.37 0 O-C-N 121.474 -0.766 . . . . 0.0 111.927 -168.197 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 16.0 ttpp -56.8 -26.36 57.7 Favored 'General case' 0 N--CA 1.501 2.116 0 O-C-N 121.464 -0.773 . . . . 0.0 111.022 -177.126 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 5.0 p30 -84.83 6.13 25.88 Favored 'General case' 0 N--CA 1.498 1.946 0 C-N-CA 119.729 -0.788 . . . . 0.0 111.389 176.709 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 97.7 mt -75.67 126.73 36.74 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.144 0 O-C-N 121.151 -0.968 . . . . 0.0 109.909 176.095 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 76.3 tttt -93.13 -29.17 15.9 Favored 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.802 -0.561 . . . . 0.0 109.929 170.727 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 5.0 m-20 -163.71 154.86 16.32 Favored 'General case' 0 N--CA 1.501 2.075 0 O-C-N 121.723 -0.611 . . . . 0.0 110.112 -177.836 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 86.7 mt -132.99 148.22 52.27 Favored 'General case' 0 N--CA 1.497 1.886 0 O-C-N 121.667 -0.645 . . . . 0.0 110.507 -179.248 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 4.7 ptm180 -152.19 142.33 22.3 Favored 'General case' 0 N--CA 1.495 1.793 0 O-C-N 121.757 -0.589 . . . . 0.0 109.959 175.934 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 69.9 mt -85.07 133.14 30.04 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.86 0 O-C-N 121.495 -0.753 . . . . 0.0 109.678 172.575 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 40.6 mt . . . . . 0 N--CA 1.497 1.905 0 O-C-N 121.496 -0.752 . . . . 0.0 110.204 -177.975 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' B' B ' 257' ' ' SER . . . . . . . . . . . . . 36.8 m . . . . . 0 N--CA 1.503 2.195 0 CA-C-O 121.165 0.507 . . . . 0.0 110.659 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' B' B ' 258' ' ' SER . . . . . . . . . . . . . 59.8 p -69.85 -29.63 66.92 Favored 'General case' 0 N--CA 1.5 2.039 0 C-N-CA 120.268 -0.573 . . . . 0.0 110.468 -178.225 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 259' ' ' GLN . . . . . . . . . . . . . 98.8 mt-30 -64.0 -38.77 92.28 Favored 'General case' 0 N--CA 1.502 2.126 0 O-C-N 121.547 -0.721 . . . . 0.0 110.487 -179.698 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 260' ' ' LEU . . . . . . . . . . . . . 81.3 mt -67.77 -44.29 77.8 Favored 'General case' 0 N--CA 1.501 2.076 0 O-C-N 121.608 -0.682 . . . . 0.0 110.246 179.713 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 261' ' ' LEU . . . . . . . . . . . . . 22.8 tp -68.61 -35.94 78.0 Favored 'General case' 0 N--CA 1.497 1.899 0 O-C-N 121.652 -0.655 . . . . 0.0 109.799 176.778 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 262' ' ' SER . . . . . . . . . . . . . 23.0 t -62.3 -36.72 83.02 Favored 'General case' 0 N--CA 1.5 2.064 0 O-C-N 121.753 -0.592 . . . . 0.0 110.457 177.521 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 263' ' ' LEU . . . . . . . . . . . . . 23.2 mt . . . . . 0 N--CA 1.501 2.109 0 O-C-N 121.703 -0.623 . . . . 0.0 110.099 179.582 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 69.8 m . . . . . 0 N--CA 1.495 1.81 0 CA-C-O 120.928 0.394 . . . . 0.0 110.167 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 65.7 t -66.45 -27.8 41.46 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.054 0 O-C-N 121.761 -0.587 . . . . 0.0 110.274 -179.368 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -55.3 -31.11 61.37 Favored 'General case' 0 N--CA 1.504 2.231 0 O-C-N 121.376 -0.828 . . . . 0.0 110.388 -179.033 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 9.7 m-20 -68.66 -31.13 70.04 Favored 'General case' 0 N--CA 1.499 1.985 0 O-C-N 121.821 -0.549 . . . . 0.0 110.222 174.647 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 96.4 m-85 -95.67 10.07 38.1 Favored 'General case' 0 N--CA 1.497 1.908 0 O-C-N 121.585 -0.697 . . . . 0.0 111.531 -178.955 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 3.3 m-30 -67.24 139.05 57.33 Favored 'General case' 0 N--CA 1.502 2.17 0 O-C-N 121.196 -0.94 . . . . 0.0 109.961 174.783 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 82.84 -0.32 89.68 Favored Glycine 0 N--CA 1.497 2.762 0 N-CA-C 110.602 -0.999 . . . . 0.0 110.602 -175.541 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 29.0 t -76.57 137.66 39.68 Favored 'General case' 0 N--CA 1.498 1.935 0 O-C-N 121.154 -1.204 . . . . 0.0 110.509 -179.991 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 2.4 m120 -84.14 115.59 22.48 Favored 'General case' 0 N--CA 1.498 1.97 0 O-C-N 121.684 -0.635 . . . . 0.0 109.418 174.143 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 35.7 m -141.89 162.45 20.11 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.725 0 O-C-N 121.699 -0.626 . . . . 0.0 109.769 -178.443 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 12' ' ' GLU . . . . . 0.416 ' HA ' ' HA ' ' A' ' 22' ' ' ARG . 47.0 tt0 -109.48 129.11 55.58 Favored 'General case' 0 N--CA 1.492 1.675 0 C-N-CA 119.914 -0.714 . . . . 0.0 110.012 177.933 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 61.7 t -106.66 126.53 62.5 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.655 0 O-C-N 121.614 -0.679 . . . . 0.0 109.838 -179.439 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 28.5 tp -95.86 126.63 41.25 Favored 'General case' 0 N--CA 1.493 1.703 0 N-CA-C 109.155 -0.683 . . . . 0.0 109.155 175.14 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 86.8 mt -96.39 167.11 11.37 Favored 'General case' 0 N--CA 1.496 1.836 0 O-C-N 121.587 -0.696 . . . . 0.0 111.076 -172.822 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 24.3 p30 -58.54 -21.81 53.6 Favored 'General case' 0 N--CA 1.504 2.263 0 O-C-N 121.82 -0.55 . . . . 0.0 111.685 -176.96 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 41.8 p-10 -92.76 23.51 4.09 Favored 'General case' 0 N--CA 1.497 1.924 0 O-C-N 121.531 -0.731 . . . . 0.0 110.899 -176.191 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 74.3 m-20 58.73 27.57 16.13 Favored 'General case' 0 N--CA 1.505 2.307 0 O-C-N 121.472 -0.767 . . . . 0.0 110.606 176.06 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 50.6 m -106.37 144.57 32.87 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.527 -0.733 . . . . 0.0 109.485 172.741 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 74.4 mttt -109.64 148.83 30.64 Favored 'General case' 0 N--CA 1.496 1.836 0 O-C-N 121.582 -0.699 . . . . 0.0 110.557 -176.305 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -153.05 153.56 33.1 Favored 'General case' 0 N--CA 1.496 1.869 0 O-C-N 121.717 -0.614 . . . . 0.0 110.248 176.123 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . 0.416 ' HA ' ' HA ' ' A' ' 12' ' ' GLU . 31.1 ptt180 -144.0 143.25 31.12 Favored 'General case' 0 N--CA 1.498 1.951 0 O-C-N 121.663 -0.648 . . . . 0.0 110.533 178.265 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -171.78 171.45 44.11 Favored Glycine 0 N--CA 1.494 2.51 0 N-CA-C 108.878 -1.689 . . . . 0.0 108.878 -174.986 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 39.5 t -94.54 118.37 40.42 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.916 0 O-C-N 121.468 -1.019 . . . . 0.0 109.382 -176.461 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 76.5 mt -63.72 143.27 15.81 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.122 0 O-C-N 121.657 -0.652 . . . . 0.0 110.442 -172.064 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 7.0 p -121.2 -27.76 4.83 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.733 -0.604 . . . . 0.0 111.283 -179.664 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 7.3 t-20 -161.94 158.25 24.98 Favored 'General case' 0 N--CA 1.499 2.012 0 C-N-CA 119.004 -1.078 . . . . 0.0 111.594 -177.622 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 77.1 t80 -150.1 126.71 10.92 Favored 'General case' 0 N--CA 1.498 1.936 0 N-CA-C 109.235 -0.654 . . . . 0.0 109.235 170.17 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 17.8 t70 -100.31 130.98 46.49 Favored 'General case' 0 N--CA 1.491 1.594 0 N-CA-C 109.095 -0.705 . . . . 0.0 109.095 -177.711 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 19.5 m -68.55 -48.69 63.62 Favored 'General case' 0 N--CA 1.498 1.975 0 C-N-CA 120.031 -0.668 . . . . 0.0 110.629 -175.703 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 25.2 m -59.49 -44.16 93.15 Favored 'General case' 0 N--CA 1.503 2.206 0 O-C-N 121.57 -0.706 . . . . 0.0 110.859 -174.078 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 29.6 m120 -103.88 -8.84 19.4 Favored 'General case' 0 N--CA 1.497 1.882 0 O-C-N 121.622 -0.674 . . . . 0.0 111.52 -178.164 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 16.1 m 49.46 67.22 0.92 Allowed 'General case' 0 N--CA 1.507 2.387 0 O-C-N 121.141 -0.974 . . . . 0.0 110.928 -174.381 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 45.8 mm -121.96 125.91 73.78 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.071 0 O-C-N 121.629 -0.669 . . . . 0.0 109.407 -175.679 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 7.3 tp -115.81 119.69 36.83 Favored 'General case' 0 N--CA 1.494 1.767 0 O-C-N 121.648 -0.658 . . . . 0.0 110.429 -168.847 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 98.9 mt-30 -90.98 134.25 34.63 Favored 'General case' 0 N--CA 1.49 1.544 0 C-N-CA 120.315 -0.554 . . . . 0.0 109.576 174.72 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 15.8 mt -117.79 123.83 46.91 Favored 'General case' 0 N--CA 1.495 1.787 0 O-C-N 121.939 -0.476 . . . . 0.0 109.966 174.72 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 74.4 ttt-85 -97.27 106.2 18.48 Favored 'General case' 0 N--CA 1.497 1.897 0 O-C-N 121.741 -0.6 . . . . 0.0 109.779 175.746 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 18.8 tp -84.72 152.06 23.98 Favored 'General case' 0 N--CA 1.495 1.777 0 O-C-N 121.678 -0.639 . . . . 0.0 110.877 -174.227 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -68.14 -3.55 10.84 Favored 'General case' 0 N--CA 1.502 2.146 0 O-C-N 121.928 -0.482 . . . . 0.0 111.982 -172.455 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 23.2 m120 -87.05 27.56 1.01 Allowed 'General case' 0 N--CA 1.498 1.941 0 O-C-N 121.07 -1.019 . . . . 0.0 110.923 173.545 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 14.8 t0 63.11 29.31 16.2 Favored 'General case' 0 N--CA 1.505 2.279 0 O-C-N 121.042 -1.036 . . . . 0.0 110.523 176.088 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 50.7 m -125.08 137.8 54.19 Favored 'General case' 0 N--CA 1.495 1.81 0 O-C-N 121.313 -0.867 . . . . 0.0 110.568 -179.267 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 9.8 t -98.11 151.04 20.8 Favored 'General case' 0 N--CA 1.496 1.845 0 O-C-N 121.817 -0.552 . . . . 0.0 110.208 175.362 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 33.6 ttmt -150.2 119.17 6.68 Favored 'General case' 0 N--CA 1.495 1.817 0 O-C-N 121.525 -0.734 . . . . 0.0 110.362 178.577 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 89.7 p -96.2 123.81 39.96 Favored 'General case' 0 N--CA 1.495 1.797 0 O-C-N 121.675 -0.64 . . . . 0.0 110.249 179.079 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 82.5 mt -129.4 135.89 60.62 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.887 0 N-CA-C 109.309 -0.626 . . . . 0.0 109.309 179.203 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 64.0 t -81.87 127.6 39.46 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.895 0 C-N-CA 120.032 -0.667 . . . . 0.0 109.265 179.358 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 39.0 p -59.17 -24.85 63.42 Favored 'General case' 0 N--CA 1.504 2.239 0 O-C-N 121.668 -0.645 . . . . 0.0 112.071 -169.744 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 63.4 tttt -56.46 -24.1 43.33 Favored 'General case' 0 N--CA 1.504 2.227 0 O-C-N 121.46 -0.775 . . . . 0.0 110.981 -176.824 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 46.5 p30 -83.91 2.52 38.22 Favored 'General case' 0 N--CA 1.499 1.987 0 O-C-N 121.468 -0.77 . . . . 0.0 111.281 176.598 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 98.8 mt -75.47 127.34 36.95 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.113 0 O-C-N 121.195 -0.941 . . . . 0.0 109.987 177.978 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 50.4 tttm -92.45 -29.79 16.07 Favored 'General case' 0 N--CA 1.494 1.739 0 O-C-N 121.871 -0.518 . . . . 0.0 109.652 170.506 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 5.3 m-20 -163.95 156.89 17.94 Favored 'General case' 0 N--CA 1.499 2.022 0 O-C-N 121.795 -0.566 . . . . 0.0 110.053 -178.141 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 84.3 mt -133.01 148.54 52.25 Favored 'General case' 0 N--CA 1.496 1.858 0 O-C-N 121.675 -0.641 . . . . 0.0 110.513 -179.376 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 6.5 ptm180 -151.94 143.04 23.2 Favored 'General case' 0 N--CA 1.495 1.812 0 O-C-N 121.673 -0.642 . . . . 0.0 110.046 176.006 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 68.7 mt -85.33 133.2 29.98 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.843 0 O-C-N 121.443 -0.786 . . . . 0.0 109.718 173.218 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 59.2 mt . . . . . 0 N--CA 1.497 1.915 0 O-C-N 121.583 -0.698 . . . . 0.0 110.164 -179.021 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' B' B ' 257' ' ' SER . . . . . . . . . . . . . 40.5 m . . . . . 0 N--CA 1.504 2.248 0 CA-C-O 121.24 0.543 . . . . 0.0 110.373 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' B' B ' 258' ' ' SER . . . . . . . . . . . . . 25.3 m -69.29 -33.23 72.87 Favored 'General case' 0 N--CA 1.499 1.983 0 C-N-CA 120.423 -0.511 . . . . 0.0 110.272 179.855 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 259' ' ' GLN . . . . . . . . . . . . . 78.2 mt-30 -63.79 -36.99 85.7 Favored 'General case' 0 N--CA 1.501 2.084 0 O-C-N 121.628 -0.67 . . . . 0.0 110.43 -179.433 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 260' ' ' LEU . . . . . . . . . . . . . 82.7 mt -66.59 -42.66 86.63 Favored 'General case' 0 N--CA 1.5 2.072 0 O-C-N 121.639 -0.663 . . . . 0.0 110.231 179.556 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 261' ' ' LEU . . . . . . . . . . . . . 22.5 tp -70.43 -37.49 74.39 Favored 'General case' 0 N--CA 1.498 1.928 0 O-C-N 121.719 -0.613 . . . . 0.0 109.749 176.511 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 262' ' ' SER . . . . . . . . . . . . . 22.8 t -62.53 -36.92 84.14 Favored 'General case' 0 N--CA 1.5 2.051 0 O-C-N 121.771 -0.581 . . . . 0.0 110.443 176.896 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 263' ' ' LEU . . . . . . . . . . . . . 24.1 mt . . . . . 0 N--CA 1.5 2.074 0 O-C-N 121.681 -0.637 . . . . 0.0 110.28 179.691 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 69.5 m . . . . . 0 N--CA 1.495 1.791 0 CA-C-O 121.016 0.436 . . . . 0.0 110.263 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 57.3 t -65.2 -27.99 43.48 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.164 0 O-C-N 121.702 -0.624 . . . . 0.0 110.194 179.192 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -55.19 -31.76 61.67 Favored 'General case' 0 N--CA 1.505 2.283 0 O-C-N 121.518 -0.739 . . . . 0.0 110.349 179.902 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 74.5 m-20 -68.64 -35.9 77.9 Favored 'General case' 0 N--CA 1.499 1.994 0 O-C-N 121.818 -0.551 . . . . 0.0 109.942 175.444 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 97.7 m-85 -97.67 10.0 41.12 Favored 'General case' 0 N--CA 1.497 1.892 0 O-C-N 121.708 -0.62 . . . . 0.0 111.217 178.877 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -67.41 128.63 37.15 Favored 'General case' 0 N--CA 1.501 2.082 0 O-C-N 121.257 -0.902 . . . . 0.0 110.061 179.048 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 82.24 -0.73 88.56 Favored Glycine 0 N--CA 1.497 2.716 0 N-CA-C 110.693 -0.963 . . . . 0.0 110.693 -175.794 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 30.4 t -76.61 136.67 39.21 Favored 'General case' 0 N--CA 1.497 1.883 0 O-C-N 120.989 -1.301 . . . . 0.0 110.4 177.794 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 14.3 t-20 -83.36 120.09 25.44 Favored 'General case' 0 N--CA 1.497 1.896 0 O-C-N 121.608 -0.683 . . . . 0.0 109.669 174.722 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 35.0 m -142.83 164.52 16.66 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.733 0 O-C-N 121.794 -0.567 . . . . 0.0 109.505 -178.824 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 12' ' ' GLU . . . . . 0.417 ' HA ' ' HA ' ' A' ' 22' ' ' ARG . 36.8 tt0 -109.36 128.85 55.43 Favored 'General case' 0 N--CA 1.493 1.697 0 C-N-CA 119.87 -0.732 . . . . 0.0 109.894 176.412 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 60.4 t -106.83 126.6 62.76 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.741 0 O-C-N 121.659 -0.65 . . . . 0.0 109.857 -179.285 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 24.1 tp -95.84 127.92 42.29 Favored 'General case' 0 N--CA 1.494 1.74 0 N-CA-C 109.263 -0.643 . . . . 0.0 109.263 175.483 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 83.6 mt -96.1 161.87 13.78 Favored 'General case' 0 N--CA 1.496 1.864 0 O-C-N 121.609 -0.682 . . . . 0.0 110.923 -173.466 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 24.2 p30 -57.81 -21.76 43.79 Favored 'General case' 0 N--CA 1.506 2.327 0 O-C-N 121.855 -0.528 . . . . 0.0 111.418 179.886 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 24.8 p30 -90.91 22.49 3.61 Favored 'General case' 0 N--CA 1.5 2.073 0 O-C-N 121.618 -0.676 . . . . 0.0 111.067 -177.717 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 74.3 m-20 60.26 29.01 18.65 Favored 'General case' 0 N--CA 1.506 2.346 0 O-C-N 121.356 -0.84 . . . . 0.0 110.807 172.561 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 23.8 m -110.79 143.8 40.76 Favored 'General case' 0 N--CA 1.495 1.798 0 O-C-N 121.472 -0.767 . . . . 0.0 109.551 170.838 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 34.2 mtpt -109.67 144.89 37.4 Favored 'General case' 0 N--CA 1.494 1.743 0 O-C-N 121.574 -0.704 . . . . 0.0 110.467 -176.69 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -153.09 157.93 41.14 Favored 'General case' 0 N--CA 1.497 1.905 0 O-C-N 121.8 -0.562 . . . . 0.0 110.145 177.081 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . 0.417 ' HA ' ' HA ' ' A' ' 12' ' ' GLU . 30.7 ptt180 -143.97 152.61 41.28 Favored 'General case' 0 N--CA 1.496 1.846 0 O-C-N 121.578 -0.701 . . . . 0.0 110.441 178.081 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -171.81 171.26 44.01 Favored Glycine 0 N--CA 1.494 2.503 0 N-CA-C 109.128 -1.589 . . . . 0.0 109.128 -179.075 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 43.9 t -94.64 126.06 47.14 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.918 0 O-C-N 121.59 -0.947 . . . . 0.0 109.288 176.619 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 50.9 mt -61.66 137.99 22.91 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.253 0 O-C-N 121.64 -0.663 . . . . 0.0 110.896 -170.805 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 13.7 p -121.19 -19.06 7.23 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.922 -0.486 . . . . 0.0 111.465 -179.82 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 9.9 t30 -166.15 158.8 14.65 Favored 'General case' 0 N--CA 1.503 2.222 0 O-C-N 120.917 -1.115 . . . . 0.0 111.751 176.046 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 65.0 t80 -150.32 124.96 9.69 Favored 'General case' 0 N--CA 1.495 1.818 0 N-CA-C 109.244 -0.651 . . . . 0.0 109.244 173.314 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 20.2 t70 -98.18 130.86 44.92 Favored 'General case' 0 N--CA 1.492 1.64 0 N-CA-C 109.004 -0.739 . . . . 0.0 109.004 -179.741 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 23.1 t -71.56 -53.76 12.71 Favored 'General case' 0 N--CA 1.498 1.956 0 C-N-CA 120.007 -0.677 . . . . 0.0 110.633 -175.845 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 22.9 m -61.93 -37.9 86.41 Favored 'General case' 0 N--CA 1.5 2.061 0 O-C-N 121.591 -0.693 . . . . 0.0 110.699 -175.819 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 91.5 m-20 -103.77 -9.85 18.74 Favored 'General case' 0 N--CA 1.498 1.942 0 O-C-N 121.746 -0.596 . . . . 0.0 111.66 -176.909 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 27.8 p 47.11 67.05 0.86 Allowed 'General case' 0 N--CA 1.508 2.434 0 O-C-N 121.408 -0.807 . . . . 0.0 111.202 -175.13 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 46.8 mm -121.36 125.8 74.15 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.964 0 O-C-N 121.642 -0.661 . . . . 0.0 109.236 -176.433 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 11.0 tp -116.57 120.47 38.81 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.746 -0.596 . . . . 0.0 110.468 -170.3 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 57.6 mt-30 -91.02 131.94 36.31 Favored 'General case' 0 N--CA 1.49 1.551 0 N-CA-C 109.061 -0.718 . . . . 0.0 109.061 170.659 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 50.6 mt -117.82 123.56 46.23 Favored 'General case' 0 N--CA 1.494 1.761 0 C-N-CA 120.121 -0.632 . . . . 0.0 110.007 175.723 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 70.3 ttt180 -105.63 105.08 14.95 Favored 'General case' 0 N--CA 1.495 1.788 0 O-C-N 121.821 -0.549 . . . . 0.0 110.144 173.928 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 65.2 tp -83.19 157.36 22.76 Favored 'General case' 0 N--CA 1.499 1.979 0 O-C-N 121.623 -0.673 . . . . 0.0 110.518 -176.657 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -67.57 -2.97 7.5 Favored 'General case' 0 N--CA 1.503 2.179 0 O-C-N 121.857 -0.527 . . . . 0.0 112.156 -170.822 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 30.1 m120 -86.25 29.06 0.78 Allowed 'General case' 0 N--CA 1.499 1.983 0 O-C-N 120.987 -1.07 . . . . 0.0 110.822 173.503 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 73.9 m-20 60.39 31.47 20.37 Favored 'General case' 0 N--CA 1.505 2.277 0 O-C-N 121.225 -0.922 . . . . 0.0 110.326 175.468 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 69.9 m -125.91 140.77 52.36 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.483 -0.761 . . . . 0.0 110.05 177.736 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 9.8 t -128.27 147.79 50.61 Favored 'General case' 0 N--CA 1.495 1.809 0 O-C-N 121.681 -0.637 . . . . 0.0 110.018 179.785 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 81.3 tttt -150.19 135.18 17.77 Favored 'General case' 0 N--CA 1.495 1.797 0 O-C-N 121.709 -0.619 . . . . 0.0 110.545 -178.106 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 89.5 p -94.78 121.03 35.95 Favored 'General case' 0 N--CA 1.495 1.806 0 O-C-N 121.798 -0.563 . . . . 0.0 110.142 177.85 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 81.3 mt -129.25 137.29 57.4 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.868 0 O-C-N 121.671 -0.643 . . . . 0.0 109.325 -179.956 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 60.5 t -81.53 127.78 39.28 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.846 0 O-C-N 121.566 -0.709 . . . . 0.0 109.219 179.117 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 44.3 p -58.33 -29.7 66.14 Favored 'General case' 0 N--CA 1.503 2.2 0 O-C-N 121.459 -0.776 . . . . 0.0 111.672 -170.504 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -58.56 -27.23 64.37 Favored 'General case' 0 N--CA 1.5 2.045 0 O-C-N 121.562 -0.711 . . . . 0.0 111.315 -173.261 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 4.6 p30 -82.41 0.86 40.1 Favored 'General case' 0 N--CA 1.497 1.884 0 C-N-CA 119.502 -0.879 . . . . 0.0 111.113 176.932 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 76.1 mt -79.45 132.18 32.6 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.096 0 O-C-N 121.167 -0.958 . . . . 0.0 109.923 175.649 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 23.5 ttmt -92.42 -24.32 18.89 Favored 'General case' 0 N--CA 1.494 1.746 0 C-N-CA 120.427 -0.509 . . . . 0.0 110.22 173.278 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -164.08 152.43 13.06 Favored 'General case' 0 N--CA 1.501 2.125 0 O-C-N 121.502 -0.749 . . . . 0.0 110.489 -175.949 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 4.7 mp -132.92 152.35 51.91 Favored 'General case' 0 N--CA 1.495 1.818 0 O-C-N 121.725 -0.609 . . . . 0.0 110.364 178.494 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 19.8 ptp180 -151.84 146.15 25.47 Favored 'General case' 0 N--CA 1.496 1.842 0 O-C-N 121.636 -0.665 . . . . 0.0 109.926 175.081 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 57.5 mt -87.09 133.23 30.54 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.871 0 O-C-N 121.483 -0.761 . . . . 0.0 110.0 174.092 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 78.1 mt . . . . . 0 N--CA 1.497 1.886 0 O-C-N 121.537 -0.727 . . . . 0.0 110.018 -179.785 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' B' B ' 257' ' ' SER . . . . . . . . . . . . . 33.7 m . . . . . 0 N--CA 1.502 2.17 0 CA-C-O 121.257 0.551 . . . . 0.0 110.487 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' B' B ' 258' ' ' SER . . . . . . . . . . . . . 22.6 t -69.67 -32.82 71.69 Favored 'General case' 0 N--CA 1.498 1.932 0 O-C-N 121.862 -0.524 . . . . 0.0 110.419 -179.401 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 259' ' ' GLN . . . . . . . . . . . . . 99.5 mt-30 -63.22 -37.96 89.29 Favored 'General case' 0 N--CA 1.501 2.082 0 O-C-N 121.57 -0.706 . . . . 0.0 110.634 -178.442 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 260' ' ' LEU . . . . . . . . . . . . . 84.1 mt -69.43 -41.72 75.94 Favored 'General case' 0 N--CA 1.499 1.981 0 O-C-N 121.535 -0.728 . . . . 0.0 110.296 179.915 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 261' ' ' LEU . . . . . . . . . . . . . 32.8 tp -70.26 -40.21 74.53 Favored 'General case' 0 N--CA 1.496 1.872 0 O-C-N 121.572 -0.705 . . . . 0.0 109.915 177.83 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 262' ' ' SER . . . . . . . . . . . . . 86.8 p -63.18 -35.9 81.85 Favored 'General case' 0 N--CA 1.5 2.06 0 O-C-N 121.675 -0.64 . . . . 0.0 110.484 177.374 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 263' ' ' LEU . . . . . . . . . . . . . 25.2 mt . . . . . 0 N--CA 1.499 2.005 0 O-C-N 121.631 -0.668 . . . . 0.0 110.456 179.214 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 74.3 m . . . . . 0 N--CA 1.494 1.768 0 CA-C-O 121.116 0.484 . . . . 0.0 110.533 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 56.7 t -64.67 -27.97 43.76 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.24 0 O-C-N 121.699 -0.626 . . . . 0.0 110.279 179.716 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -55.06 -30.96 60.72 Favored 'General case' 0 N--CA 1.504 2.235 0 O-C-N 121.452 -0.78 . . . . 0.0 110.393 -179.669 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 74.5 m-20 -68.73 -35.26 76.89 Favored 'General case' 0 N--CA 1.498 1.95 0 C-N-CA 120.413 -0.515 . . . . 0.0 109.968 174.658 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 95.0 m-85 -98.05 9.86 41.81 Favored 'General case' 0 N--CA 1.498 1.931 0 O-C-N 121.782 -0.574 . . . . 0.0 111.263 179.072 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -67.48 128.48 36.6 Favored 'General case' 0 N--CA 1.5 2.071 0 O-C-N 121.198 -0.939 . . . . 0.0 110.046 179.533 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 81.98 -0.59 88.35 Favored Glycine 0 N--CA 1.495 2.623 0 N-CA-C 110.757 -0.937 . . . . 0.0 110.757 -175.594 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 49.1 m -76.3 137.34 39.82 Favored 'General case' 0 N--CA 1.497 1.904 0 O-C-N 120.958 -1.319 . . . . 0.0 110.469 178.042 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 14.0 t-20 -84.51 119.12 24.8 Favored 'General case' 0 N--CA 1.497 1.886 0 O-C-N 121.683 -0.636 . . . . 0.0 109.774 174.567 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 35.8 m -142.12 162.46 19.53 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.808 0 O-C-N 121.847 -0.533 . . . . 0.0 109.636 -179.872 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 12' ' ' GLU . . . . . 0.409 ' HA ' ' HA ' ' A' ' 22' ' ' ARG . 48.4 tt0 -109.42 128.45 55.14 Favored 'General case' 0 N--CA 1.494 1.765 0 C-N-CA 119.914 -0.714 . . . . 0.0 110.01 178.05 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 60.8 t -106.74 127.71 62.04 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.765 0 O-C-N 121.642 -0.661 . . . . 0.0 109.893 -178.882 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 27.0 tp -95.83 125.87 40.7 Favored 'General case' 0 N--CA 1.493 1.7 0 N-CA-C 109.14 -0.689 . . . . 0.0 109.14 174.327 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 86.6 mt -95.08 167.33 11.45 Favored 'General case' 0 N--CA 1.496 1.828 0 O-C-N 121.6 -0.687 . . . . 0.0 111.102 -172.561 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 24.2 p30 -58.54 -21.9 53.91 Favored 'General case' 0 N--CA 1.507 2.4 0 O-C-N 121.933 -0.479 . . . . 0.0 111.575 -176.786 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 39.2 p-10 -93.06 23.76 4.12 Favored 'General case' 0 N--CA 1.498 1.936 0 O-C-N 121.6 -0.688 . . . . 0.0 110.878 -176.354 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 10.4 m-20 59.09 27.66 16.7 Favored 'General case' 0 N--CA 1.506 2.367 0 O-C-N 121.483 -0.76 . . . . 0.0 110.611 175.579 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 50.9 m -106.52 142.57 35.96 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.492 -0.755 . . . . 0.0 109.61 172.975 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 95.0 mttt -109.66 143.68 39.07 Favored 'General case' 0 N--CA 1.494 1.748 0 O-C-N 121.594 -0.691 . . . . 0.0 110.731 -176.668 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -153.1 156.06 37.96 Favored 'General case' 0 N--CA 1.497 1.907 0 O-C-N 121.752 -0.593 . . . . 0.0 110.018 175.96 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . 0.409 ' HA ' ' HA ' ' A' ' 12' ' ' GLU . 40.5 ptt85 -142.64 153.51 43.51 Favored 'General case' 0 N--CA 1.496 1.862 0 O-C-N 121.515 -0.74 . . . . 0.0 110.482 178.545 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -171.81 171.17 43.96 Favored Glycine 0 N--CA 1.494 2.517 0 N-CA-C 109.051 -1.62 . . . . 0.0 109.051 -178.965 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 44.6 t -94.65 127.12 46.88 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.898 0 O-C-N 121.604 -0.939 . . . . 0.0 109.305 176.943 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 49.2 mt -61.5 138.31 22.32 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.227 0 O-C-N 121.632 -0.668 . . . . 0.0 110.864 -171.01 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 12.5 p -121.16 -20.53 6.73 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.875 -0.515 . . . . 0.0 111.485 -179.699 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 30.9 t30 -165.77 158.58 15.32 Favored 'General case' 0 N--CA 1.504 2.262 0 O-C-N 120.902 -1.124 . . . . 0.0 111.798 176.764 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 66.8 t80 -150.27 123.08 8.68 Favored 'General case' 0 N--CA 1.494 1.761 0 N-CA-C 109.177 -0.675 . . . . 0.0 109.177 173.217 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 17.9 t70 -98.05 130.16 44.87 Favored 'General case' 0 N--CA 1.493 1.689 0 N-CA-C 109.106 -0.702 . . . . 0.0 109.106 -177.849 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 23.2 t -69.63 -51.82 31.5 Favored 'General case' 0 N--CA 1.498 1.963 0 C-N-CA 119.981 -0.688 . . . . 0.0 110.648 -175.985 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 22.1 t -59.94 -41.58 92.13 Favored 'General case' 0 N--CA 1.501 2.099 0 O-C-N 121.624 -0.672 . . . . 0.0 110.938 -174.652 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 91.6 m-20 -104.17 -9.88 18.35 Favored 'General case' 0 N--CA 1.497 1.894 0 O-C-N 121.668 -0.645 . . . . 0.0 111.663 -177.453 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 3.7 m 50.13 67.35 0.93 Allowed 'General case' 0 N--CA 1.508 2.431 0 O-C-N 120.971 -1.08 . . . . 0.0 110.85 -174.43 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 44.6 mm -120.67 125.8 74.5 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.024 0 O-C-N 121.598 -0.688 . . . . 0.0 109.332 -175.827 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 10.8 tp -115.9 119.47 36.05 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.691 -0.631 . . . . 0.0 110.548 -169.699 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 56.9 mt-30 -91.0 132.51 35.94 Favored 'General case' 0 N--CA 1.489 1.504 0 N-CA-C 109.304 -0.628 . . . . 0.0 109.304 171.441 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 51.4 mt -117.79 123.54 46.21 Favored 'General case' 0 N--CA 1.495 1.789 0 C-N-CA 120.129 -0.628 . . . . 0.0 110.001 175.81 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 57.1 ttt85 -105.86 106.18 16.57 Favored 'General case' 0 N--CA 1.496 1.85 0 O-C-N 121.753 -0.592 . . . . 0.0 110.191 173.885 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 65.4 tp -83.78 156.76 22.36 Favored 'General case' 0 N--CA 1.499 1.978 0 O-C-N 121.678 -0.639 . . . . 0.0 110.587 -177.138 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -68.19 -3.02 9.23 Favored 'General case' 0 N--CA 1.504 2.226 0 O-C-N 121.903 -0.498 . . . . 0.0 112.178 -170.804 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 91.7 m-20 -86.96 29.1 0.84 Allowed 'General case' 0 N--CA 1.498 1.963 0 O-C-N 121.04 -1.038 . . . . 0.0 110.682 173.84 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 73.1 m-20 60.74 31.67 20.14 Favored 'General case' 0 N--CA 1.505 2.316 0 O-C-N 121.242 -0.911 . . . . 0.0 110.271 175.82 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 73.5 m -125.78 138.33 53.84 Favored 'General case' 0 N--CA 1.494 1.739 0 O-C-N 121.457 -0.777 . . . . 0.0 110.006 177.212 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 9.3 t -128.18 148.88 50.63 Favored 'General case' 0 N--CA 1.497 1.881 0 O-C-N 121.659 -0.651 . . . . 0.0 110.042 179.955 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 79.2 tttt -150.37 136.09 18.28 Favored 'General case' 0 N--CA 1.495 1.822 0 O-C-N 121.718 -0.614 . . . . 0.0 110.584 -178.32 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 89.8 p -94.39 121.49 35.98 Favored 'General case' 0 N--CA 1.494 1.769 0 O-C-N 121.718 -0.614 . . . . 0.0 110.073 176.935 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 79.7 mt -129.2 135.09 62.71 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.837 0 O-C-N 121.602 -0.686 . . . . 0.0 109.44 -179.424 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 62.1 t -82.31 127.63 39.46 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.929 0 N-CA-C 109.265 -0.643 . . . . 0.0 109.265 179.032 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 57.7 p -58.36 -25.0 61.51 Favored 'General case' 0 N--CA 1.507 2.382 0 O-C-N 121.533 -0.729 . . . . 0.0 111.814 -169.148 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 49.0 tptt -56.87 -26.1 57.98 Favored 'General case' 0 N--CA 1.5 2.061 0 O-C-N 121.414 -0.804 . . . . 0.0 111.069 -177.049 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 5.3 p30 -84.64 5.88 26.27 Favored 'General case' 0 N--CA 1.499 2.009 0 C-N-CA 119.676 -0.809 . . . . 0.0 111.33 176.501 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 98.7 mt -75.32 126.46 36.11 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.107 0 O-C-N 121.184 -0.948 . . . . 0.0 109.988 175.726 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 77.0 tttt -92.91 -29.35 15.96 Favored 'General case' 0 N--CA 1.494 1.768 0 O-C-N 121.803 -0.561 . . . . 0.0 109.887 170.708 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 5.4 m-20 -163.63 154.6 16.24 Favored 'General case' 0 N--CA 1.5 2.075 0 O-C-N 121.76 -0.587 . . . . 0.0 110.168 -177.926 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 83.9 mt -132.98 150.5 52.16 Favored 'General case' 0 N--CA 1.497 1.899 0 O-C-N 121.71 -0.619 . . . . 0.0 110.424 -179.163 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 4.5 ptm180 -152.66 141.91 21.48 Favored 'General case' 0 N--CA 1.495 1.791 0 O-C-N 121.757 -0.589 . . . . 0.0 109.869 174.83 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 69.4 mt -85.19 133.34 29.61 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.883 0 O-C-N 121.453 -0.779 . . . . 0.0 109.864 174.472 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 63.9 mt . . . . . 0 N--CA 1.497 1.923 0 O-C-N 121.591 -0.693 . . . . 0.0 110.113 -179.031 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' B' B ' 257' ' ' SER . . . . . . . . . . . . . 69.2 m . . . . . 0 N--CA 1.503 2.186 0 CA-C-O 121.321 0.581 . . . . 0.0 110.48 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' B' B ' 258' ' ' SER . . . . . . . . . . . . . 27.6 m -68.27 -31.43 70.88 Favored 'General case' 0 N--CA 1.499 2.009 0 C-N-CA 120.438 -0.505 . . . . 0.0 110.296 179.186 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 259' ' ' GLN . . . . . . . . . . . . . 58.4 tp60 -63.59 -37.31 86.85 Favored 'General case' 0 N--CA 1.501 2.075 0 O-C-N 121.638 -0.664 . . . . 0.0 110.64 -179.472 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 260' ' ' LEU . . . . . . . . . . . . . 83.2 mt -70.89 -43.86 67.48 Favored 'General case' 0 N--CA 1.499 1.983 0 O-C-N 121.524 -0.735 . . . . 0.0 110.214 179.946 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 261' ' ' LEU . . . . . . . . . . . . . 24.2 tp -69.1 -39.04 79.24 Favored 'General case' 0 N--CA 1.498 1.963 0 O-C-N 121.737 -0.602 . . . . 0.0 109.844 178.023 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 262' ' ' SER . . . . . . . . . . . . . 84.9 p -62.99 -34.78 78.28 Favored 'General case' 0 N--CA 1.499 2.019 0 O-C-N 121.687 -0.633 . . . . 0.0 110.611 177.539 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 263' ' ' LEU . . . . . . . . . . . . . 23.5 mt . . . . . 0 N--CA 1.501 2.105 0 O-C-N 121.58 -0.7 . . . . 0.0 110.357 179.409 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 69.8 m . . . . . 0 N--CA 1.493 1.705 0 CA-C-O 120.978 0.418 . . . . 0.0 110.021 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 79.8 t -66.67 -27.81 41.23 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.036 0 O-C-N 121.58 -0.7 . . . . 0.0 110.263 -179.684 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -55.15 -30.83 60.61 Favored 'General case' 0 N--CA 1.505 2.315 0 O-C-N 121.461 -0.774 . . . . 0.0 110.389 -178.925 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 74.6 m-20 -68.76 -30.52 69.14 Favored 'General case' 0 N--CA 1.499 2.025 0 O-C-N 121.813 -0.555 . . . . 0.0 110.223 174.821 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 96.2 m-85 -95.4 10.07 37.69 Favored 'General case' 0 N--CA 1.498 1.953 0 O-C-N 121.645 -0.659 . . . . 0.0 111.512 -178.367 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 3.7 m-30 -67.18 137.82 56.53 Favored 'General case' 0 N--CA 1.502 2.16 0 O-C-N 121.131 -0.98 . . . . 0.0 110.106 173.979 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 83.07 -1.08 89.3 Favored Glycine 0 N--CA 1.496 2.694 0 N-CA-C 110.718 -0.953 . . . . 0.0 110.718 -177.352 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 68.9 m -77.2 136.82 38.58 Favored 'General case' 0 N--CA 1.499 1.979 0 O-C-N 121.031 -1.276 . . . . 0.0 110.417 177.747 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 16.1 t-20 -84.16 117.11 23.27 Favored 'General case' 0 N--CA 1.498 1.944 0 O-C-N 121.633 -0.667 . . . . 0.0 109.628 173.4 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 35.7 m -142.71 162.7 17.99 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.705 0 N-CA-C 109.387 -0.597 . . . . 0.0 109.387 -178.206 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 45.3 tt0 -109.34 130.3 55.5 Favored 'General case' 0 N--CA 1.492 1.661 0 C-N-CA 119.838 -0.745 . . . . 0.0 109.863 176.918 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 60.0 t -106.69 126.67 62.54 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.679 0 O-C-N 121.623 -0.673 . . . . 0.0 109.841 -179.597 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 27.1 tp -95.93 130.22 42.96 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.697 -0.627 . . . . 0.0 109.358 176.512 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 86.3 mt -97.38 160.12 14.51 Favored 'General case' 0 N--CA 1.496 1.875 0 O-C-N 121.59 -0.694 . . . . 0.0 111.067 -174.25 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 24.4 p30 -58.24 -21.87 49.95 Favored 'General case' 0 N--CA 1.506 2.345 0 O-C-N 121.756 -0.59 . . . . 0.0 111.503 -178.477 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 38.3 p-10 -93.14 23.93 4.07 Favored 'General case' 0 N--CA 1.498 1.927 0 O-C-N 121.5 -0.75 . . . . 0.0 110.778 -177.154 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 74.3 m-20 59.42 28.08 17.35 Favored 'General case' 0 N--CA 1.505 2.322 0 O-C-N 121.493 -0.754 . . . . 0.0 110.644 175.8 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 51.0 m -104.04 141.43 36.22 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.57 -0.706 . . . . 0.0 109.516 171.964 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 52.8 mttp -109.69 143.43 39.47 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.593 -0.692 . . . . 0.0 110.553 -176.013 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -153.1 154.6 35.16 Favored 'General case' 0 N--CA 1.497 1.889 0 O-C-N 121.722 -0.612 . . . . 0.0 110.3 176.477 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 31.0 ptt180 -144.07 154.98 43.78 Favored 'General case' 0 N--CA 1.498 1.947 0 O-C-N 121.705 -0.622 . . . . 0.0 110.463 177.573 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -171.93 171.18 44.0 Favored Glycine 0 N--CA 1.494 2.522 0 N-CA-C 109.237 -1.545 . . . . 0.0 109.237 -178.967 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 41.0 t -94.5 119.51 42.58 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.926 0 O-C-N 121.596 -0.944 . . . . 0.0 109.02 174.252 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 76.0 mt -63.52 143.75 15.31 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.23 0 CA-C-O 121.304 0.573 . . . . 0.0 110.66 -167.749 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 2.3 p -121.15 -25.87 5.21 Favored 'General case' 0 N--CA 1.494 1.768 0 O-C-N 121.831 -0.543 . . . . 0.0 111.379 179.934 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 7.3 t30 -163.94 160.0 21.5 Favored 'General case' 0 N--CA 1.501 2.091 0 O-C-N 120.952 -1.092 . . . . 0.0 111.774 -179.844 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 91.5 t80 -150.1 128.78 12.37 Favored 'General case' 0 N--CA 1.5 2.028 0 N-CA-C 109.223 -0.658 . . . . 0.0 109.223 170.279 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 20.2 t0 -98.86 130.84 45.29 Favored 'General case' 0 N--CA 1.49 1.559 0 N-CA-C 108.941 -0.763 . . . . 0.0 108.941 179.994 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 88.6 p -70.84 -51.48 26.31 Favored 'General case' 0 N--CA 1.497 1.922 0 C-N-CA 119.98 -0.688 . . . . 0.0 110.686 -175.175 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 6.3 t -61.25 -40.47 94.18 Favored 'General case' 0 N--CA 1.501 2.124 0 O-C-N 121.517 -0.74 . . . . 0.0 110.718 -175.737 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 28.8 m120 -103.27 -9.07 19.83 Favored 'General case' 0 N--CA 1.498 1.941 0 O-C-N 121.738 -0.601 . . . . 0.0 111.615 -176.877 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 28.6 p 46.79 67.13 0.83 Allowed 'General case' 0 N--CA 1.509 2.477 0 O-C-N 121.385 -0.822 . . . . 0.0 111.266 -175.009 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 46.0 mm -122.53 125.83 73.2 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.059 0 N-CA-C 109.138 -0.69 . . . . 0.0 109.138 -176.881 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 12.5 tp -115.98 122.25 44.69 Favored 'General case' 0 N--CA 1.495 1.776 0 O-C-N 121.677 -0.639 . . . . 0.0 110.7 -169.888 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 77.9 mt-30 -90.93 142.1 28.13 Favored 'General case' 0 N--CA 1.489 1.524 0 N-CA-C 109.358 -0.608 . . . . 0.0 109.358 171.097 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 6.4 mt -133.53 123.57 25.41 Favored 'General case' 0 N--CA 1.495 1.803 0 O-C-N 121.76 -0.588 . . . . 0.0 109.783 178.846 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 23.2 mtm180 -102.25 104.83 15.41 Favored 'General case' 0 N--CA 1.496 1.863 0 O-C-N 121.738 -0.601 . . . . 0.0 110.38 173.392 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 62.8 tp -84.19 157.33 21.68 Favored 'General case' 0 N--CA 1.497 1.901 0 O-C-N 121.509 -0.744 . . . . 0.0 110.49 -177.946 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -66.43 -2.91 5.09 Favored 'General case' 0 N--CA 1.504 2.227 0 O-C-N 121.911 -0.493 . . . . 0.0 112.126 -171.154 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 91.4 m-20 -84.87 28.98 0.65 Allowed 'General case' 0 N--CA 1.499 1.993 0 O-C-N 121.112 -0.993 . . . . 0.0 110.856 172.267 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 74.4 m-20 59.43 31.17 20.87 Favored 'General case' 0 N--CA 1.504 2.272 0 O-C-N 121.108 -0.995 . . . . 0.0 110.433 174.148 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 50.8 m -126.26 137.76 53.55 Favored 'General case' 0 N--CA 1.496 1.847 0 O-C-N 121.498 -0.751 . . . . 0.0 110.517 178.99 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 10.0 t -102.36 151.11 22.65 Favored 'General case' 0 N--CA 1.497 1.882 0 O-C-N 121.864 -0.523 . . . . 0.0 110.105 174.629 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 69.5 mttt -149.04 123.79 9.87 Favored 'General case' 0 N--CA 1.496 1.87 0 O-C-N 121.574 -0.704 . . . . 0.0 110.741 178.939 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 92.6 p -97.45 118.52 34.11 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.792 -0.568 . . . . 0.0 110.122 177.551 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 82.6 mt -129.34 140.1 50.03 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.842 0 O-C-N 121.675 -0.641 . . . . 0.0 109.369 179.665 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 58.1 t -81.85 127.65 39.42 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.863 0 C-N-CA 119.981 -0.688 . . . . 0.0 109.164 178.694 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 38.7 p -60.42 -27.18 67.27 Favored 'General case' 0 N--CA 1.502 2.128 0 O-C-N 121.62 -0.675 . . . . 0.0 111.926 -171.005 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 50.3 mmtt -58.58 -25.03 62.13 Favored 'General case' 0 N--CA 1.501 2.122 0 O-C-N 121.531 -0.731 . . . . 0.0 111.363 -173.776 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 6.4 p30 -82.44 -1.16 49.3 Favored 'General case' 0 N--CA 1.498 1.967 0 C-N-CA 119.635 -0.826 . . . . 0.0 111.084 176.41 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 75.3 mt -79.66 133.92 28.74 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.102 0 O-C-N 121.185 -0.947 . . . . 0.0 110.131 177.317 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 47.2 tptt -92.38 -27.51 17.48 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.854 -0.529 . . . . 0.0 109.928 171.412 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -164.34 155.5 15.53 Favored 'General case' 0 N--CA 1.502 2.17 0 O-C-N 121.684 -0.635 . . . . 0.0 110.47 -176.211 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 4.7 mp -132.91 155.36 49.2 Favored 'General case' 0 N--CA 1.497 1.88 0 O-C-N 121.877 -0.514 . . . . 0.0 110.175 178.191 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 19.6 ptp180 -151.6 148.93 28.57 Favored 'General case' 0 N--CA 1.497 1.891 0 O-C-N 121.693 -0.629 . . . . 0.0 109.976 175.801 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 67.5 mt -86.01 133.33 29.91 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.871 0 C-N-CA 119.944 -0.702 . . . . 0.0 109.868 172.808 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 72.7 mt . . . . . 0 N--CA 1.498 1.928 0 O-C-N 121.613 -0.68 . . . . 0.0 110.045 -178.299 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' B' B ' 257' ' ' SER . . . . . . . . . . . . . 22.0 m . . . . . 0 N--CA 1.503 2.185 0 CA-C-O 121.207 0.527 . . . . 0.0 110.361 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' B' B ' 258' ' ' SER . . . . . . . . . . . . . 23.8 m -69.33 -34.28 74.41 Favored 'General case' 0 N--CA 1.498 1.95 0 C-N-CA 120.402 -0.519 . . . . 0.0 110.176 179.303 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 259' ' ' GLN . . . . . . . . . . . . . 78.2 mt-30 -64.66 -34.47 78.36 Favored 'General case' 0 N--CA 1.5 2.058 0 O-C-N 121.606 -0.684 . . . . 0.0 110.407 -179.931 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 260' ' ' LEU . . . . . . . . . . . . . 77.9 mt -66.57 -41.57 88.39 Favored 'General case' 0 N--CA 1.5 2.028 0 O-C-N 121.716 -0.615 . . . . 0.0 110.223 179.371 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 261' ' ' LEU . . . . . . . . . . . . . 33.5 tp -70.03 -35.67 74.49 Favored 'General case' 0 N--CA 1.498 1.973 0 C-N-CA 120.132 -0.627 . . . . 0.0 109.798 176.997 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 262' ' ' SER . . . . . . . . . . . . . 23.2 m -62.47 -37.68 86.89 Favored 'General case' 0 N--CA 1.5 2.067 0 O-C-N 121.683 -0.636 . . . . 0.0 110.468 177.241 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 263' ' ' LEU . . . . . . . . . . . . . 21.6 mt . . . . . 0 N--CA 1.5 2.067 0 O-C-N 121.718 -0.613 . . . . 0.0 110.292 179.195 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 63.5 m . . . . . 0 N--CA 1.495 1.79 0 CA-C-O 121.02 0.438 . . . . 0.0 110.076 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 74.6 t -66.77 -27.71 40.79 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.014 0 O-C-N 121.65 -0.656 . . . . 0.0 110.099 179.798 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -55.12 -30.94 60.79 Favored 'General case' 0 N--CA 1.504 2.228 0 O-C-N 121.434 -0.791 . . . . 0.0 110.369 -179.854 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -68.76 -30.88 69.57 Favored 'General case' 0 N--CA 1.499 1.991 0 O-C-N 121.783 -0.573 . . . . 0.0 110.24 174.676 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 91.1 m-85 -95.81 10.11 38.21 Favored 'General case' 0 N--CA 1.497 1.895 0 O-C-N 121.584 -0.697 . . . . 0.0 111.637 -178.0 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 3.1 m-30 -67.35 133.36 49.48 Favored 'General case' 0 N--CA 1.502 2.174 0 O-C-N 121.088 -1.007 . . . . 0.0 110.043 173.801 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 82.38 1.88 90.51 Favored Glycine 0 N--CA 1.496 2.644 0 N-CA-C 110.625 -0.99 . . . . 0.0 110.625 -176.854 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 52.8 m -77.42 137.13 38.52 Favored 'General case' 0 N--CA 1.498 1.955 0 O-C-N 121.111 -1.229 . . . . 0.0 110.476 176.365 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 2.6 m-20 -85.24 121.85 28.57 Favored 'General case' 0 N--CA 1.499 1.981 0 O-C-N 121.606 -0.684 . . . . 0.0 109.506 173.739 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 30.9 m -144.0 161.08 15.77 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.774 0 C-N-CA 120.151 -0.62 . . . . 0.0 109.885 -179.403 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 48.1 tt0 -109.33 147.23 33.03 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.737 -0.602 . . . . 0.0 109.6 177.124 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 60.1 t -135.74 126.96 44.37 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.825 0 O-C-N 121.559 -0.713 . . . . 0.0 109.924 -173.758 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 26.3 tp -95.91 125.6 40.58 Favored 'General case' 0 N--CA 1.492 1.665 0 N-CA-C 109.192 -0.67 . . . . 0.0 109.192 173.955 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 87.5 mt -93.12 170.51 9.59 Favored 'General case' 0 N--CA 1.497 1.889 0 O-C-N 121.67 -0.644 . . . . 0.0 110.951 -174.372 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 24.7 p30 -57.19 -21.55 34.15 Favored 'General case' 0 N--CA 1.505 2.309 0 O-C-N 121.738 -0.601 . . . . 0.0 111.575 -178.213 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 53.1 p-10 -91.6 22.04 4.31 Favored 'General case' 0 N--CA 1.499 1.975 0 O-C-N 121.571 -0.706 . . . . 0.0 110.933 -177.989 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 74.4 m-20 58.9 27.92 16.85 Favored 'General case' 0 N--CA 1.506 2.331 0 O-C-N 121.433 -0.792 . . . . 0.0 110.714 175.399 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 50.7 m -108.98 145.84 34.85 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.494 -0.754 . . . . 0.0 109.674 173.128 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 80.3 mttt -109.68 140.03 44.02 Favored 'General case' 0 N--CA 1.495 1.777 0 O-C-N 121.57 -0.706 . . . . 0.0 110.481 -177.342 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -153.14 137.83 16.95 Favored 'General case' 0 N--CA 1.497 1.878 0 O-C-N 121.785 -0.572 . . . . 0.0 110.178 177.008 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 9.7 ptp180 -124.37 158.59 32.32 Favored 'General case' 0 N--CA 1.497 1.899 0 O-C-N 121.575 -0.703 . . . . 0.0 110.197 -179.219 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -171.82 171.24 44.01 Favored Glycine 0 N--CA 1.493 2.447 0 N-CA-C 109.087 -1.605 . . . . 0.0 109.087 -178.337 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 20.0 t -94.69 122.15 45.9 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.878 0 O-C-N 121.626 -0.926 . . . . 0.0 109.162 175.803 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 87.9 mt -63.05 141.39 18.18 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.272 0 O-C-N 121.508 -0.745 . . . . 0.0 110.351 -171.988 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 13.7 p -121.11 -26.04 5.19 Favored 'General case' 0 N--CA 1.495 1.785 0 O-C-N 121.728 -0.607 . . . . 0.0 111.304 -179.906 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 26.9 t30 -162.87 160.24 24.78 Favored 'General case' 0 N--CA 1.5 2.062 0 O-C-N 120.965 -1.084 . . . . 0.0 111.789 179.936 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 87.8 t80 -150.09 127.1 11.18 Favored 'General case' 0 N--CA 1.498 1.96 0 N-CA-C 109.468 -0.568 . . . . 0.0 109.468 169.804 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 21.7 t70 -97.89 127.73 44.03 Favored 'General case' 0 N--CA 1.493 1.681 0 N-CA-C 109.111 -0.7 . . . . 0.0 109.111 -178.675 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 88.3 p -65.82 -44.62 85.03 Favored 'General case' 0 N--CA 1.499 1.985 0 O-C-N 121.607 -0.683 . . . . 0.0 110.755 -174.745 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 22.4 t -58.86 -48.1 82.57 Favored 'General case' 0 N--CA 1.502 2.158 0 O-C-N 121.446 -0.784 . . . . 0.0 111.002 -173.372 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 91.4 m-20 -107.03 -2.66 20.87 Favored 'General case' 0 N--CA 1.498 1.963 0 O-C-N 121.616 -0.678 . . . . 0.0 111.62 -178.932 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 3.4 m 49.2 67.24 0.91 Allowed 'General case' 0 N--CA 1.507 2.416 0 O-C-N 121.058 -1.026 . . . . 0.0 110.903 -174.027 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 44.8 mm -116.22 125.83 73.45 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.025 0 O-C-N 121.512 -0.743 . . . . 0.0 109.162 -175.656 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 8.1 tp -115.83 121.53 42.69 Favored 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.636 -0.665 . . . . 0.0 110.569 -167.805 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 98.5 mt-30 -91.0 133.16 35.52 Favored 'General case' 0 N--CA 1.489 1.515 0 N-CA-C 109.351 -0.611 . . . . 0.0 109.351 172.392 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 19.2 mt -117.84 123.58 46.25 Favored 'General case' 0 N--CA 1.495 1.793 0 C-N-CA 120.294 -0.562 . . . . 0.0 110.086 175.579 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 56.3 ttt85 -103.86 104.93 14.99 Favored 'General case' 0 N--CA 1.496 1.843 0 O-C-N 121.803 -0.561 . . . . 0.0 110.125 173.632 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 61.1 tp -84.38 155.66 22.2 Favored 'General case' 0 N--CA 1.498 1.938 0 O-C-N 121.577 -0.702 . . . . 0.0 110.639 -176.647 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -68.3 -2.93 9.32 Favored 'General case' 0 N--CA 1.502 2.141 0 O-C-N 121.865 -0.522 . . . . 0.0 112.213 -170.548 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 7.0 m120 -86.7 28.16 0.91 Allowed 'General case' 0 N--CA 1.497 1.925 0 O-C-N 121.039 -1.038 . . . . 0.0 110.954 174.551 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 13.4 t0 64.9 28.77 12.64 Favored 'General case' 0 N--CA 1.505 2.298 0 O-C-N 121.205 -0.934 . . . . 0.0 110.388 175.528 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 66.5 m -125.92 138.03 53.75 Favored 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.437 -0.79 . . . . 0.0 110.113 178.633 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 9.8 t -128.29 146.78 50.65 Favored 'General case' 0 N--CA 1.495 1.813 0 O-C-N 121.702 -0.624 . . . . 0.0 109.928 178.197 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 46.3 mtmt -150.18 141.84 23.6 Favored 'General case' 0 N--CA 1.497 1.894 0 C-N-CA 120.129 -0.628 . . . . 0.0 110.655 -177.812 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 89.8 p -95.84 121.95 38.11 Favored 'General case' 0 N--CA 1.495 1.799 0 O-C-N 121.839 -0.538 . . . . 0.0 110.089 176.771 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 83.1 mt -129.32 135.8 60.92 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.789 0 O-C-N 121.616 -0.677 . . . . 0.0 109.349 -179.76 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 65.4 t -81.84 127.69 39.38 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.861 0 O-C-N 121.577 -0.702 . . . . 0.0 109.224 179.755 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 37.5 p -58.7 -24.87 62.21 Favored 'General case' 0 N--CA 1.505 2.298 0 O-C-N 121.547 -0.721 . . . . 0.0 111.915 -169.959 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 33.5 tttp -56.46 -23.14 36.98 Favored 'General case' 0 N--CA 1.503 2.214 0 O-C-N 121.485 -0.759 . . . . 0.0 111.09 -177.141 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 51.7 p30 -83.05 0.73 43.55 Favored 'General case' 0 N--CA 1.5 2.029 0 C-N-CA 119.762 -0.775 . . . . 0.0 111.24 176.199 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 98.8 mt -75.81 126.79 36.92 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.038 0 O-C-N 121.193 -0.942 . . . . 0.0 109.955 177.829 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 79.6 tttt -91.28 -29.5 17.13 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.829 -0.545 . . . . 0.0 109.849 171.165 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 5.4 m-20 -164.15 157.3 17.9 Favored 'General case' 0 N--CA 1.5 2.063 0 O-C-N 121.768 -0.582 . . . . 0.0 110.093 -178.585 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 84.6 mt -133.01 151.24 52.09 Favored 'General case' 0 N--CA 1.497 1.894 0 O-C-N 121.674 -0.641 . . . . 0.0 110.576 -179.525 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 6.2 ptm180 -152.63 136.87 16.56 Favored 'General case' 0 N--CA 1.495 1.798 0 O-C-N 121.833 -0.542 . . . . 0.0 109.732 174.818 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 64.6 mt -83.51 133.17 29.74 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.846 0 O-C-N 121.522 -0.736 . . . . 0.0 109.81 176.212 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 22.6 mt . . . . . 0 N--CA 1.497 1.915 0 O-C-N 121.633 -0.667 . . . . 0.0 109.964 -179.301 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' B' B ' 257' ' ' SER . . . . . . . . . . . . . 54.6 p . . . . . 0 N--CA 1.503 2.199 0 CA-C-O 121.285 0.564 . . . . 0.0 110.462 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' B' B ' 258' ' ' SER . . . . . . . . . . . . . 23.8 m -70.21 -31.95 69.62 Favored 'General case' 0 N--CA 1.498 1.955 0 C-N-CA 120.383 -0.527 . . . . 0.0 110.47 -179.335 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 259' ' ' GLN . . . . . . . . . . . . . 98.6 mt-30 -63.66 -40.84 97.85 Favored 'General case' 0 N--CA 1.501 2.109 0 O-C-N 121.511 -0.743 . . . . 0.0 110.542 -178.536 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 260' ' ' LEU . . . . . . . . . . . . . 84.2 mt -72.96 -41.63 64.21 Favored 'General case' 0 N--CA 1.498 1.955 0 O-C-N 121.635 -0.666 . . . . 0.0 110.295 -179.587 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 261' ' ' LEU . . . . . . . . . . . . . 20.7 tp -69.75 -38.46 76.82 Favored 'General case' 0 N--CA 1.497 1.909 0 O-C-N 121.655 -0.653 . . . . 0.0 109.884 178.857 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 262' ' ' SER . . . . . . . . . . . . . 88.8 p -63.32 -35.5 80.58 Favored 'General case' 0 N--CA 1.499 1.987 0 O-C-N 121.71 -0.619 . . . . 0.0 110.674 177.263 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 263' ' ' LEU . . . . . . . . . . . . . 26.7 mt . . . . . 0 N--CA 1.501 2.098 0 O-C-N 121.564 -0.71 . . . . 0.0 110.366 -179.734 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 70.0 m . . . . . 0 N--CA 1.496 1.833 0 CA-C-O 121.035 0.445 . . . . 0.0 110.245 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 49.9 t -65.74 -27.92 42.68 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.198 0 O-C-N 121.654 -0.654 . . . . 0.0 110.138 179.595 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -55.58 -31.99 62.68 Favored 'General case' 0 N--CA 1.501 2.123 0 O-C-N 121.394 -0.816 . . . . 0.0 110.334 -179.838 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 74.2 m-20 -68.65 -35.38 77.18 Favored 'General case' 0 N--CA 1.498 1.937 0 O-C-N 121.809 -0.557 . . . . 0.0 109.956 175.387 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 97.6 m-85 -97.9 10.06 41.18 Favored 'General case' 0 N--CA 1.498 1.965 0 O-C-N 121.746 -0.596 . . . . 0.0 111.226 178.812 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -67.49 126.95 30.91 Favored 'General case' 0 N--CA 1.501 2.095 0 O-C-N 121.241 -0.912 . . . . 0.0 110.052 178.752 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 81.95 2.11 90.47 Favored Glycine 0 N--CA 1.497 2.716 0 N-CA-C 110.695 -0.962 . . . . 0.0 110.695 -176.938 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 59.6 p -77.86 142.66 38.37 Favored 'General case' 0 N--CA 1.497 1.924 0 O-C-N 121.061 -1.258 . . . . 0.0 110.065 175.31 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 1.9 m120 -85.27 117.53 24.26 Favored 'General case' 0 N--CA 1.5 2.028 0 N-CA-C 109.064 -0.717 . . . . 0.0 109.064 176.303 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 29.8 m -142.21 158.88 20.08 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.89 0 C-N-CA 120.164 -0.614 . . . . 0.0 109.983 -179.152 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 12' ' ' GLU . . . . . 0.447 ' HA ' ' HA ' ' A' ' 22' ' ' ARG . 46.4 tt0 -109.4 129.53 55.54 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.619 -0.676 . . . . 0.0 110.107 178.772 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 58.9 t -106.68 127.59 62.04 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.733 0 O-C-N 121.589 -0.695 . . . . 0.0 109.961 -178.917 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 28.3 tp -95.84 127.67 42.06 Favored 'General case' 0 N--CA 1.493 1.689 0 N-CA-C 109.096 -0.705 . . . . 0.0 109.096 173.947 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 87.9 mt -96.47 169.26 10.03 Favored 'General case' 0 N--CA 1.495 1.814 0 O-C-N 121.567 -0.708 . . . . 0.0 111.168 -172.793 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 24.2 p30 -57.59 -22.14 43.21 Favored 'General case' 0 N--CA 1.507 2.398 0 O-C-N 121.94 -0.475 . . . . 0.0 111.636 -177.123 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 44.6 p-10 -92.53 22.83 4.36 Favored 'General case' 0 N--CA 1.498 1.943 0 O-C-N 121.522 -0.736 . . . . 0.0 110.905 -176.995 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 74.5 m-20 58.56 27.5 15.77 Favored 'General case' 0 N--CA 1.505 2.312 0 O-C-N 121.465 -0.772 . . . . 0.0 110.637 176.078 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 48.0 m -106.29 143.6 34.18 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.519 -0.738 . . . . 0.0 109.597 172.859 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 66.5 mttt -109.73 148.86 30.66 Favored 'General case' 0 N--CA 1.494 1.749 0 O-C-N 121.579 -0.701 . . . . 0.0 110.556 -176.229 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -153.07 154.21 34.41 Favored 'General case' 0 N--CA 1.496 1.834 0 O-C-N 121.729 -0.607 . . . . 0.0 110.105 176.066 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . 0.447 ' HA ' ' HA ' ' A' ' 12' ' ' GLU . 30.8 ptt180 -138.69 151.17 46.94 Favored 'General case' 0 N--CA 1.497 1.913 0 O-C-N 121.597 -0.689 . . . . 0.0 110.466 179.341 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -171.9 171.27 44.04 Favored Glycine 0 N--CA 1.492 2.394 0 N-CA-C 108.956 -1.658 . . . . 0.0 108.956 -178.71 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 30.3 t -94.56 124.85 47.21 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.815 0 O-C-N 121.571 -0.958 . . . . 0.0 109.125 175.498 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 51.0 mt -61.87 134.77 27.07 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.171 0 O-C-N 121.428 -0.795 . . . . 0.0 110.834 -171.839 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 11.0 p -121.21 -16.94 7.84 Favored 'General case' 0 N--CA 1.494 1.765 0 O-C-N 121.916 -0.49 . . . . 0.0 111.61 -177.844 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 13.5 t30 -166.09 157.38 13.49 Favored 'General case' 0 N--CA 1.504 2.251 0 O-C-N 120.927 -1.108 . . . . 0.0 111.75 175.61 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 72.0 t80 -150.28 122.15 8.15 Favored 'General case' 0 N--CA 1.496 1.855 0 N-CA-C 109.225 -0.657 . . . . 0.0 109.225 173.459 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 26.6 t0 -99.12 130.45 45.44 Favored 'General case' 0 N--CA 1.491 1.614 0 N-CA-C 109.139 -0.689 . . . . 0.0 109.139 -178.022 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 19.3 m -70.55 -51.88 25.53 Favored 'General case' 0 N--CA 1.497 1.916 0 C-N-CA 120.0 -0.68 . . . . 0.0 110.54 -176.081 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 31.5 m -60.71 -40.79 93.6 Favored 'General case' 0 N--CA 1.501 2.116 0 O-C-N 121.617 -0.677 . . . . 0.0 110.847 -174.813 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 91.6 m-20 -103.85 -9.97 18.57 Favored 'General case' 0 N--CA 1.497 1.914 0 O-C-N 121.678 -0.639 . . . . 0.0 111.616 -177.579 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 15.0 m 49.83 67.26 0.93 Allowed 'General case' 0 N--CA 1.508 2.468 0 O-C-N 121.142 -0.974 . . . . 0.0 110.899 -174.665 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 43.9 mm -120.8 125.93 74.64 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.997 0 O-C-N 121.623 -0.673 . . . . 0.0 109.26 -175.645 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 14.8 tp -115.93 118.89 34.22 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.691 -0.63 . . . . 0.0 110.451 -170.659 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 78.4 mt-30 -90.96 132.75 35.77 Favored 'General case' 0 N--CA 1.489 1.517 0 N-CA-C 109.21 -0.663 . . . . 0.0 109.21 171.863 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 56.7 mt -117.77 123.57 46.32 Favored 'General case' 0 N--CA 1.493 1.693 0 C-N-CA 120.214 -0.594 . . . . 0.0 109.946 175.435 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 74.2 ttt-85 -104.27 104.87 14.84 Favored 'General case' 0 N--CA 1.496 1.835 0 O-C-N 121.716 -0.615 . . . . 0.0 109.97 173.643 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 63.7 tp -85.01 156.76 20.98 Favored 'General case' 0 N--CA 1.498 1.926 0 O-C-N 121.622 -0.674 . . . . 0.0 110.607 -176.339 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -66.82 -3.0 5.79 Favored 'General case' 0 N--CA 1.502 2.168 0 O-C-N 121.927 -0.483 . . . . 0.0 112.203 -170.954 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 91.6 m-20 -86.01 28.94 0.76 Allowed 'General case' 0 N--CA 1.498 1.946 0 O-C-N 120.97 -1.081 . . . . 0.0 110.765 172.364 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 10.2 m-20 59.34 31.4 21.1 Favored 'General case' 0 N--CA 1.504 2.243 0 O-C-N 121.244 -0.91 . . . . 0.0 110.419 174.372 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 66.2 m -124.64 137.83 54.35 Favored 'General case' 0 N--CA 1.496 1.865 0 O-C-N 121.486 -0.759 . . . . 0.0 110.439 178.877 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 8.5 t -103.93 151.13 23.53 Favored 'General case' 0 N--CA 1.498 1.933 0 O-C-N 121.816 -0.553 . . . . 0.0 110.262 176.32 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 39.0 ttmt -149.81 119.15 6.85 Favored 'General case' 0 N--CA 1.495 1.819 0 O-C-N 121.616 -0.677 . . . . 0.0 110.365 178.224 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 88.6 p -94.93 121.4 36.49 Favored 'General case' 0 N--CA 1.495 1.811 0 O-C-N 121.781 -0.575 . . . . 0.0 110.264 179.936 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 81.7 mt -129.28 135.14 62.5 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.853 0 O-C-N 121.686 -0.634 . . . . 0.0 109.342 179.572 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 67.6 t -81.61 127.63 39.42 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.862 0 N-CA-C 109.069 -0.715 . . . . 0.0 109.069 177.35 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 59.6 p -58.28 -24.85 60.82 Favored 'General case' 0 N--CA 1.503 2.2 0 O-C-N 121.492 -0.755 . . . . 0.0 111.855 -168.337 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 19.0 tptm -56.89 -26.65 59.4 Favored 'General case' 0 N--CA 1.501 2.118 0 O-C-N 121.531 -0.731 . . . . 0.0 111.024 -177.12 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 4.9 p30 -85.1 6.85 23.81 Favored 'General case' 0 N--CA 1.498 1.958 0 C-N-CA 119.748 -0.781 . . . . 0.0 111.42 176.562 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 98.4 mt -75.34 124.25 32.86 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.115 0 O-C-N 121.171 -0.956 . . . . 0.0 109.849 175.704 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 23.2 tptp -92.06 -29.11 16.74 Favored 'General case' 0 N--CA 1.494 1.774 0 O-C-N 121.801 -0.562 . . . . 0.0 109.879 171.081 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 5.2 m-20 -163.62 155.08 16.76 Favored 'General case' 0 N--CA 1.5 2.052 0 O-C-N 121.813 -0.554 . . . . 0.0 110.11 -178.145 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 85.1 mt -132.99 149.65 52.22 Favored 'General case' 0 N--CA 1.497 1.903 0 O-C-N 121.736 -0.603 . . . . 0.0 110.432 -179.04 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 7.7 ptm180 -151.74 141.59 21.98 Favored 'General case' 0 N--CA 1.494 1.757 0 O-C-N 121.706 -0.621 . . . . 0.0 109.925 175.861 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 69.5 mt -85.65 133.13 30.27 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.881 0 O-C-N 121.482 -0.762 . . . . 0.0 109.776 173.78 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 79.2 mt . . . . . 0 N--CA 1.496 1.869 0 O-C-N 121.616 -0.677 . . . . 0.0 110.07 178.611 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' B' B ' 257' ' ' SER . . . . . . . . . . . . . 32.2 t . . . . . 0 N--CA 1.505 2.28 0 CA-C-O 121.255 0.55 . . . . 0.0 110.327 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' B' B ' 258' ' ' SER . . . . . . . . . . . . . 24.1 m -68.01 -31.39 71.05 Favored 'General case' 0 N--CA 1.497 1.919 0 C-N-CA 120.513 -0.475 . . . . 0.0 110.225 178.87 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 259' ' ' GLN . . . . . . . . . . . . . 48.7 tt0 -63.26 -37.12 86.01 Favored 'General case' 0 N--CA 1.5 2.027 0 O-C-N 121.647 -0.658 . . . . 0.0 110.37 178.714 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 260' ' ' LEU . . . . . . . . . . . . . 82.1 mt -64.18 -43.75 94.14 Favored 'General case' 0 N--CA 1.501 2.079 0 O-C-N 121.628 -0.67 . . . . 0.0 110.248 179.184 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 261' ' ' LEU . . . . . . . . . . . . . 17.5 tp -70.69 -38.36 73.68 Favored 'General case' 0 N--CA 1.497 1.915 0 O-C-N 121.662 -0.649 . . . . 0.0 109.733 175.919 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 262' ' ' SER . . . . . . . . . . . . . 23.1 t -62.38 -35.56 79.56 Favored 'General case' 0 N--CA 1.501 2.093 0 O-C-N 121.681 -0.637 . . . . 0.0 110.52 176.639 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 263' ' ' LEU . . . . . . . . . . . . . 18.3 mt . . . . . 0 N--CA 1.501 2.101 0 O-C-N 121.689 -0.632 . . . . 0.0 110.254 179.679 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 69.7 m . . . . . 0 N--CA 1.494 1.725 0 CA-C-O 120.969 0.414 . . . . 0.0 110.146 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 61.3 t -65.92 -27.86 42.3 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.111 0 O-C-N 121.707 -0.621 . . . . 0.0 110.241 -178.798 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -55.19 -30.84 60.73 Favored 'General case' 0 N--CA 1.504 2.255 0 O-C-N 121.4 -0.813 . . . . 0.0 110.44 -178.64 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 74.4 m-20 -68.77 -30.98 69.69 Favored 'General case' 0 N--CA 1.5 2.032 0 C-N-CA 120.33 -0.548 . . . . 0.0 110.252 174.854 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 96.7 m-85 -96.09 10.04 38.89 Favored 'General case' 0 N--CA 1.497 1.889 0 O-C-N 121.653 -0.655 . . . . 0.0 111.512 -178.168 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 3.3 m-30 -67.24 137.53 56.23 Favored 'General case' 0 N--CA 1.501 2.105 0 O-C-N 121.093 -1.004 . . . . 0.0 110.014 174.189 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 82.72 -0.64 89.3 Favored Glycine 0 N--CA 1.498 2.796 0 N-CA-C 110.704 -0.959 . . . . 0.0 110.704 -176.294 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 31.8 t -77.02 133.96 38.96 Favored 'General case' 0 N--CA 1.498 1.937 0 O-C-N 121.113 -1.228 . . . . 0.0 110.488 178.928 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 13.6 t-20 -83.13 120.53 25.89 Favored 'General case' 0 N--CA 1.497 1.887 0 O-C-N 121.694 -0.628 . . . . 0.0 109.526 173.399 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 35.2 m -143.15 165.42 15.45 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.734 0 N-CA-C 109.527 -0.546 . . . . 0.0 109.527 -178.329 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 47.0 tt0 -109.35 126.38 53.34 Favored 'General case' 0 N--CA 1.494 1.729 0 C-N-CA 119.897 -0.721 . . . . 0.0 109.752 176.54 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 54.1 t -106.79 125.1 62.77 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.745 0 O-C-N 121.614 -0.679 . . . . 0.0 109.891 -178.098 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 25.0 tp -95.94 128.59 42.97 Favored 'General case' 0 N--CA 1.494 1.734 0 N-CA-C 109.326 -0.62 . . . . 0.0 109.326 174.838 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 87.6 mt -96.68 169.5 9.83 Favored 'General case' 0 N--CA 1.496 1.837 0 O-C-N 121.677 -0.64 . . . . 0.0 111.004 -173.846 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 24.3 p30 -57.71 -22.2 44.94 Favored 'General case' 0 N--CA 1.505 2.307 0 O-C-N 121.701 -0.625 . . . . 0.0 111.615 -176.984 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 43.7 p-10 -93.05 23.16 4.44 Favored 'General case' 0 N--CA 1.497 1.902 0 O-C-N 121.523 -0.736 . . . . 0.0 110.867 -177.001 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 74.4 m-20 58.72 27.54 16.06 Favored 'General case' 0 N--CA 1.506 2.344 0 O-C-N 121.435 -0.79 . . . . 0.0 110.594 176.155 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 51.0 m -106.86 146.06 31.42 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.502 -0.749 . . . . 0.0 109.563 173.109 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 48.6 mttm -109.6 143.74 38.89 Favored 'General case' 0 N--CA 1.495 1.776 0 O-C-N 121.599 -0.688 . . . . 0.0 110.63 -176.599 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -153.07 123.64 7.23 Favored 'General case' 0 N--CA 1.497 1.876 0 O-C-N 121.778 -0.576 . . . . 0.0 110.048 176.575 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 8.9 ptp85 -118.32 147.61 43.31 Favored 'General case' 0 N--CA 1.498 1.96 0 O-C-N 121.615 -0.678 . . . . 0.0 110.375 -176.483 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -171.79 171.44 44.1 Favored Glycine 0 N--CA 1.495 2.63 0 N-CA-C 108.975 -1.65 . . . . 0.0 108.975 -176.148 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 47.2 t -94.58 119.41 42.53 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.925 0 O-C-N 121.433 -1.039 . . . . 0.0 109.355 -177.462 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 74.9 mt -64.25 143.58 15.55 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.155 0 O-C-N 121.7 -0.625 . . . . 0.0 110.449 -171.975 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 20.7 p -121.3 -27.31 4.88 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.785 -0.572 . . . . 0.0 111.233 179.176 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 26.9 t30 -161.39 160.91 30.06 Favored 'General case' 0 N--CA 1.501 2.078 0 C-N-CA 118.95 -1.1 . . . . 0.0 111.814 -178.854 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 69.5 t80 -150.02 128.37 12.14 Favored 'General case' 0 N--CA 1.496 1.86 0 N-CA-C 109.301 -0.629 . . . . 0.0 109.301 169.107 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 17.9 t70 -100.2 130.56 46.34 Favored 'General case' 0 N--CA 1.492 1.659 0 N-CA-C 109.04 -0.726 . . . . 0.0 109.04 -178.351 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 87.1 p -68.87 -48.59 63.03 Favored 'General case' 0 N--CA 1.498 1.963 0 C-N-CA 120.016 -0.674 . . . . 0.0 110.649 -175.925 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 23.0 m -59.76 -43.77 94.15 Favored 'General case' 0 N--CA 1.502 2.16 0 O-C-N 121.636 -0.665 . . . . 0.0 110.907 -174.221 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 91.5 m-20 -104.24 -8.66 19.18 Favored 'General case' 0 N--CA 1.497 1.919 0 O-C-N 121.687 -0.633 . . . . 0.0 111.619 -178.252 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 24.8 m 49.71 67.22 0.93 Allowed 'General case' 0 N--CA 1.508 2.442 0 O-C-N 121.131 -0.98 . . . . 0.0 110.929 -174.403 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 42.6 mm -122.52 126.1 73.6 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.028 0 O-C-N 121.635 -0.666 . . . . 0.0 109.356 -175.45 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 12.3 tp -115.78 120.47 39.41 Favored 'General case' 0 N--CA 1.494 1.739 0 O-C-N 121.699 -0.626 . . . . 0.0 110.589 -169.464 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 99.0 mt-30 -91.08 132.96 35.71 Favored 'General case' 0 N--CA 1.49 1.538 0 N-CA-C 109.517 -0.549 . . . . 0.0 109.517 174.506 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 15.5 mt -117.95 123.84 46.76 Favored 'General case' 0 N--CA 1.495 1.811 0 O-C-N 121.902 -0.498 . . . . 0.0 109.964 176.034 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 11.6 mtt85 -96.83 106.91 19.31 Favored 'General case' 0 N--CA 1.498 1.934 0 O-C-N 121.646 -0.659 . . . . 0.0 109.924 175.792 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 16.8 tp -84.67 152.48 23.75 Favored 'General case' 0 N--CA 1.495 1.777 0 C-N-CA 120.24 -0.584 . . . . 0.0 110.813 -174.807 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -66.8 -5.44 12.19 Favored 'General case' 0 N--CA 1.502 2.146 0 O-C-N 121.941 -0.474 . . . . 0.0 112.041 -171.658 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 91.6 m-20 -86.99 28.09 0.95 Allowed 'General case' 0 N--CA 1.499 2.001 0 O-C-N 121.115 -0.991 . . . . 0.0 110.879 174.547 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 8.5 t70 62.91 29.27 16.55 Favored 'General case' 0 N--CA 1.505 2.278 0 O-C-N 120.981 -1.074 . . . . 0.0 110.462 175.769 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 50.1 m -124.5 137.86 54.39 Favored 'General case' 0 N--CA 1.496 1.838 0 O-C-N 121.401 -0.812 . . . . 0.0 110.49 -179.438 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 9.8 t -97.7 150.99 20.59 Favored 'General case' 0 N--CA 1.497 1.911 0 O-C-N 121.818 -0.552 . . . . 0.0 110.194 175.47 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 41.3 tttp -149.3 119.13 7.07 Favored 'General case' 0 N--CA 1.495 1.786 0 O-C-N 121.546 -0.721 . . . . 0.0 110.313 178.679 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 90.2 p -95.61 122.27 38.18 Favored 'General case' 0 N--CA 1.494 1.769 0 O-C-N 121.701 -0.625 . . . . 0.0 110.194 179.005 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 82.3 mt -129.21 134.38 64.0 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.924 0 O-C-N 121.717 -0.614 . . . . 0.0 109.423 179.396 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 49.1 t -82.62 127.88 39.24 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.941 0 O-C-N 121.66 -0.65 . . . . 0.0 109.321 179.14 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 33.9 p -58.53 -24.98 61.93 Favored 'General case' 0 N--CA 1.505 2.285 0 O-C-N 121.649 -0.657 . . . . 0.0 112.332 -166.013 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 24.6 pttm -56.34 -22.59 31.87 Favored 'General case' 0 N--CA 1.505 2.278 0 O-C-N 121.488 -0.757 . . . . 0.0 111.239 -175.779 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 9.9 p30 -82.51 -0.53 46.98 Favored 'General case' 0 N--CA 1.5 2.042 0 O-C-N 121.563 -0.711 . . . . 0.0 111.199 176.253 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 94.1 mt -77.0 126.96 38.06 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.069 0 O-C-N 121.176 -0.953 . . . . 0.0 110.012 177.585 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 41.1 tttp -92.02 -29.84 16.38 Favored 'General case' 0 N--CA 1.494 1.765 0 O-C-N 121.809 -0.557 . . . . 0.0 109.822 170.592 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 5.3 m-20 -164.24 156.97 17.31 Favored 'General case' 0 N--CA 1.5 2.026 0 O-C-N 121.717 -0.614 . . . . 0.0 110.058 -177.923 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 74.4 mt -132.9 148.73 52.29 Favored 'General case' 0 N--CA 1.497 1.902 0 O-C-N 121.721 -0.612 . . . . 0.0 110.429 -179.287 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 7.0 ptm180 -151.06 141.53 22.5 Favored 'General case' 0 N--CA 1.496 1.863 0 O-C-N 121.694 -0.629 . . . . 0.0 109.868 175.634 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 59.1 mt -85.74 133.36 29.74 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.888 0 O-C-N 121.47 -0.769 . . . . 0.0 110.012 176.205 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 20.8 mt . . . . . 0 N--CA 1.498 1.962 0 O-C-N 121.606 -0.684 . . . . 0.0 109.942 -179.202 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' B' B ' 257' ' ' SER . . . . . . . . . . . . . 58.4 m . . . . . 0 N--CA 1.502 2.173 0 CA-C-O 121.359 0.6 . . . . 0.0 110.465 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' B' B ' 258' ' ' SER . . . . . . . . . . . . . 25.4 m -67.75 -33.19 74.36 Favored 'General case' 0 N--CA 1.498 1.936 0 O-C-N 121.827 -0.545 . . . . 0.0 110.204 -179.684 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 259' ' ' GLN . . . . . . . . . . . . . 98.4 mt-30 -64.76 -33.51 76.15 Favored 'General case' 0 N--CA 1.5 2.05 0 O-C-N 121.632 -0.668 . . . . 0.0 110.323 178.883 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 260' ' ' LEU . . . . . . . . . . . . . 82.2 mt -65.38 -40.05 93.01 Favored 'General case' 0 N--CA 1.5 2.071 0 O-C-N 121.636 -0.665 . . . . 0.0 110.181 178.808 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 261' ' ' LEU . . . . . . . . . . . . . 25.5 tp -69.15 -39.93 78.5 Favored 'General case' 0 N--CA 1.499 2.015 0 O-C-N 121.671 -0.643 . . . . 0.0 109.862 176.634 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 262' ' ' SER . . . . . . . . . . . . . 22.7 m -62.55 -37.14 84.98 Favored 'General case' 0 N--CA 1.502 2.136 0 O-C-N 121.74 -0.6 . . . . 0.0 110.493 177.853 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 263' ' ' LEU . . . . . . . . . . . . . 30.2 mt . . . . . 0 N--CA 1.501 2.085 0 O-C-N 121.649 -0.657 . . . . 0.0 110.315 179.46 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 70.4 m . . . . . 0 N--CA 1.493 1.715 0 CA-C-O 120.935 0.398 . . . . 0.0 110.179 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 63.2 t -66.35 -27.85 41.75 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.093 0 O-C-N 121.644 -0.66 . . . . 0.0 110.188 -179.467 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -55.06 -30.98 60.75 Favored 'General case' 0 N--CA 1.505 2.275 0 O-C-N 121.394 -0.816 . . . . 0.0 110.439 -179.214 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 74.3 m-20 -68.57 -30.8 69.65 Favored 'General case' 0 N--CA 1.499 1.996 0 O-C-N 121.81 -0.556 . . . . 0.0 110.226 174.776 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 96.7 m-85 -95.8 10.15 38.06 Favored 'General case' 0 N--CA 1.496 1.859 0 O-C-N 121.574 -0.704 . . . . 0.0 111.524 -178.589 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 4.0 m-30 -67.34 139.43 57.22 Favored 'General case' 0 N--CA 1.504 2.228 0 O-C-N 121.211 -0.931 . . . . 0.0 109.964 174.123 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 82.06 3.14 90.67 Favored Glycine 0 N--CA 1.497 2.727 0 N-CA-C 110.56 -1.016 . . . . 0.0 110.56 -176.595 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 73.9 m -78.12 135.74 37.74 Favored 'General case' 0 N--CA 1.498 1.929 0 O-C-N 121.114 -1.227 . . . . 0.0 110.524 175.943 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 14.0 t-20 -83.92 117.43 23.34 Favored 'General case' 0 N--CA 1.497 1.91 0 O-C-N 121.6 -0.687 . . . . 0.0 109.588 172.169 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 35.4 m -142.29 164.39 17.9 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.691 0 N-CA-C 109.319 -0.622 . . . . 0.0 109.319 -179.275 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 44.8 tt0 -109.36 129.04 55.54 Favored 'General case' 0 N--CA 1.492 1.666 0 C-N-CA 119.739 -0.785 . . . . 0.0 109.914 177.453 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 58.3 t -106.74 125.14 62.69 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.697 0 O-C-N 121.575 -0.703 . . . . 0.0 109.873 -179.566 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 30.2 tp -95.85 128.43 42.72 Favored 'General case' 0 N--CA 1.494 1.728 0 N-CA-C 109.272 -0.64 . . . . 0.0 109.272 175.124 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 84.8 mt -98.28 166.31 11.45 Favored 'General case' 0 N--CA 1.496 1.846 0 O-C-N 121.683 -0.636 . . . . 0.0 111.047 -173.304 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 24.3 p30 -58.86 -21.66 57.55 Favored 'General case' 0 N--CA 1.504 2.271 0 O-C-N 121.769 -0.582 . . . . 0.0 111.64 -176.833 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 43.5 p-10 -92.64 23.4 4.09 Favored 'General case' 0 N--CA 1.498 1.953 0 O-C-N 121.547 -0.72 . . . . 0.0 110.905 -175.725 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 74.3 m-20 58.5 27.1 15.12 Favored 'General case' 0 N--CA 1.506 2.339 0 O-C-N 121.406 -0.809 . . . . 0.0 110.65 176.306 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 51.1 m -106.51 145.85 31.32 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.587 -0.696 . . . . 0.0 109.55 172.531 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 49.7 mttp -109.7 150.26 28.55 Favored 'General case' 0 N--CA 1.494 1.759 0 O-C-N 121.625 -0.672 . . . . 0.0 110.573 -175.531 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -152.97 150.37 29.16 Favored 'General case' 0 N--CA 1.496 1.861 0 O-C-N 121.682 -0.636 . . . . 0.0 110.111 176.05 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 5.8 ptm180 -144.06 140.26 29.4 Favored 'General case' 0 N--CA 1.498 1.934 0 O-C-N 121.614 -0.679 . . . . 0.0 110.509 179.407 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -171.8 171.4 44.09 Favored Glycine 0 N--CA 1.496 2.678 0 N-CA-C 109.085 -1.606 . . . . 0.0 109.085 -176.051 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 60.4 t -94.59 121.57 45.31 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.91 0 O-C-N 121.511 -0.993 . . . . 0.0 109.357 -177.338 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 91.9 mt -65.09 144.04 15.19 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.066 0 O-C-N 121.636 -0.665 . . . . 0.0 110.65 -171.332 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 7.0 p -121.23 -27.56 4.86 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.78 -0.575 . . . . 0.0 111.133 178.807 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 8.0 t30 -161.56 160.94 29.59 Favored 'General case' 0 N--CA 1.5 2.044 0 C-N-CA 118.985 -1.086 . . . . 0.0 111.904 -178.547 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 84.5 t80 -150.15 125.09 9.9 Favored 'General case' 0 N--CA 1.498 1.934 0 N-CA-C 108.87 -0.789 . . . . 0.0 108.87 170.366 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 18.0 t70 -99.44 130.31 45.69 Favored 'General case' 0 N--CA 1.491 1.591 0 N-CA-C 108.986 -0.746 . . . . 0.0 108.986 -176.449 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 20.1 m -69.75 -50.88 39.11 Favored 'General case' 0 N--CA 1.498 1.935 0 C-N-CA 120.004 -0.678 . . . . 0.0 110.449 -177.142 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 23.2 m -59.88 -41.95 92.71 Favored 'General case' 0 N--CA 1.501 2.104 0 O-C-N 121.597 -0.689 . . . . 0.0 110.781 -174.771 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 29.7 m120 -103.93 -10.13 18.38 Favored 'General case' 0 N--CA 1.497 1.915 0 O-C-N 121.676 -0.64 . . . . 0.0 111.644 -177.766 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 1.8 m 49.94 67.31 0.93 Allowed 'General case' 0 N--CA 1.508 2.442 0 O-C-N 121.046 -1.034 . . . . 0.0 111.037 -175.003 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 47.7 mm -126.26 127.39 70.66 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.089 0 O-C-N 121.51 -0.744 . . . . 0.0 109.46 -175.864 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 11.2 tp -115.89 120.59 39.7 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.742 -0.599 . . . . 0.0 110.511 -170.832 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 58.6 mt-30 -91.55 134.59 34.53 Favored 'General case' 0 N--CA 1.492 1.65 0 N-CA-C 109.481 -0.563 . . . . 0.0 109.481 174.639 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 89.4 mt -117.87 123.94 47.11 Favored 'General case' 0 N--CA 1.497 1.895 0 C-N-CA 120.406 -0.518 . . . . 0.0 109.929 174.641 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 57.7 ttt85 -96.34 107.21 19.54 Favored 'General case' 0 N--CA 1.497 1.914 0 O-C-N 121.596 -0.69 . . . . 0.0 109.736 175.79 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 18.4 tp -85.36 153.58 22.44 Favored 'General case' 0 N--CA 1.495 1.811 0 O-C-N 121.693 -0.629 . . . . 0.0 111.085 -173.65 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -62.99 -9.76 11.24 Favored 'General case' 0 N--CA 1.503 2.186 0 O-C-N 122.031 -0.418 . . . . 0.0 112.045 -170.475 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 53.6 p-10 -85.12 28.94 0.68 Allowed 'General case' 0 N--CA 1.499 2.011 0 O-C-N 121.024 -1.048 . . . . 0.0 111.049 175.064 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 74.4 m-20 57.95 29.59 17.88 Favored 'General case' 0 N--CA 1.504 2.252 0 O-C-N 121.112 -0.992 . . . . 0.0 110.404 176.619 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 28.2 m -119.71 137.9 53.63 Favored 'General case' 0 N--CA 1.496 1.852 0 O-C-N 121.518 -0.739 . . . . 0.0 110.306 178.604 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 9.8 t -97.86 150.07 21.69 Favored 'General case' 0 N--CA 1.495 1.79 0 O-C-N 121.728 -0.608 . . . . 0.0 110.327 176.608 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 19.9 mtpp -148.93 122.25 9.01 Favored 'General case' 0 N--CA 1.495 1.815 0 O-C-N 121.714 -0.616 . . . . 0.0 110.423 178.207 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 90.6 p -96.37 123.79 40.14 Favored 'General case' 0 N--CA 1.496 1.85 0 O-C-N 121.815 -0.553 . . . . 0.0 110.202 179.802 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 82.0 mt -129.28 134.23 64.18 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.858 0 O-C-N 121.673 -0.642 . . . . 0.0 109.269 179.111 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 57.8 t -81.93 127.61 39.46 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.9 0 C-N-CA 120.036 -0.666 . . . . 0.0 109.306 179.989 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 39.3 p -59.91 -24.79 64.6 Favored 'General case' 0 N--CA 1.504 2.241 0 O-C-N 121.582 -0.698 . . . . 0.0 112.054 -170.415 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 32.3 ttpt -56.25 -23.29 35.12 Favored 'General case' 0 N--CA 1.503 2.214 0 O-C-N 121.43 -0.794 . . . . 0.0 111.138 -177.037 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 48.5 p30 -84.16 1.95 41.94 Favored 'General case' 0 N--CA 1.498 1.933 0 O-C-N 121.463 -0.773 . . . . 0.0 111.342 176.61 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 97.4 mt -75.55 127.84 37.09 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.145 0 O-C-N 121.154 -0.966 . . . . 0.0 110.084 178.66 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 52.3 tttm -92.6 -30.4 15.64 Favored 'General case' 0 N--CA 1.494 1.77 0 O-C-N 121.843 -0.536 . . . . 0.0 109.687 169.379 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 5.1 m-20 -163.9 158.04 19.39 Favored 'General case' 0 N--CA 1.5 2.038 0 O-C-N 121.785 -0.572 . . . . 0.0 109.994 -178.304 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 83.4 mt -132.94 149.59 52.23 Favored 'General case' 0 N--CA 1.496 1.863 0 O-C-N 121.656 -0.653 . . . . 0.0 110.38 -179.201 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 20.1 ptp180 -151.51 144.84 24.76 Favored 'General case' 0 N--CA 1.497 1.895 0 O-C-N 121.705 -0.622 . . . . 0.0 110.16 175.813 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 66.4 mt -86.59 133.41 29.91 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.88 0 O-C-N 121.661 -0.649 . . . . 0.0 110.042 174.221 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 16.6 mt . . . . . 0 N--CA 1.498 1.935 0 O-C-N 121.64 -0.662 . . . . 0.0 109.894 -179.092 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' B' B ' 257' ' ' SER . . . . . . . . . . . . . 59.2 m . . . . . 0 N--CA 1.502 2.157 0 CA-C-O 121.232 0.539 . . . . 0.0 110.594 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' B' B ' 258' ' ' SER . . . . . . . . . . . . . 68.9 p -69.93 -31.86 69.83 Favored 'General case' 0 N--CA 1.498 1.96 0 C-N-CA 120.248 -0.581 . . . . 0.0 110.302 -178.983 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 259' ' ' GLN . . . . . . . . . . . . . 98.8 mt-30 -64.61 -37.02 86.13 Favored 'General case' 0 N--CA 1.501 2.081 0 O-C-N 121.54 -0.725 . . . . 0.0 110.39 -179.888 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 260' ' ' LEU . . . . . . . . . . . . . 47.1 mt -66.24 -42.22 88.92 Favored 'General case' 0 N--CA 1.501 2.075 0 O-C-N 121.699 -0.625 . . . . 0.0 110.199 179.637 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 261' ' ' LEU . . . . . . . . . . . . . 21.5 tp -70.57 -38.05 74.05 Favored 'General case' 0 N--CA 1.497 1.887 0 O-C-N 121.704 -0.623 . . . . 0.0 109.762 176.561 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 262' ' ' SER . . . . . . . . . . . . . 66.6 m -62.51 -36.04 81.3 Favored 'General case' 0 N--CA 1.501 2.124 0 O-C-N 121.733 -0.604 . . . . 0.0 110.444 176.724 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 263' ' ' LEU . . . . . . . . . . . . . 22.5 mt . . . . . 0 N--CA 1.501 2.098 0 O-C-N 121.669 -0.644 . . . . 0.0 110.241 179.803 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 75.5 m . . . . . 0 N--CA 1.494 1.758 0 CA-C-O 120.985 0.421 . . . . 0.0 110.222 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 58.1 t -65.78 -27.98 42.79 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.176 0 O-C-N 121.721 -0.612 . . . . 0.0 110.326 -179.146 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -55.63 -32.45 63.17 Favored 'General case' 0 N--CA 1.504 2.24 0 O-C-N 121.427 -0.796 . . . . 0.0 110.424 -178.319 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -68.7 -34.4 75.58 Favored 'General case' 0 N--CA 1.498 1.937 0 C-N-CA 120.389 -0.524 . . . . 0.0 109.971 174.79 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 96.2 m-85 -97.37 10.21 40.25 Favored 'General case' 0 N--CA 1.498 1.958 0 O-C-N 121.767 -0.583 . . . . 0.0 111.166 178.798 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -67.43 128.88 38.06 Favored 'General case' 0 N--CA 1.5 2.071 0 O-C-N 121.247 -0.908 . . . . 0.0 110.006 -179.832 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 82.77 -0.82 89.23 Favored Glycine 0 N--CA 1.497 2.723 0 N-CA-C 110.839 -0.904 . . . . 0.0 110.839 -176.463 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 57.7 p -76.37 138.7 40.59 Favored 'General case' 0 N--CA 1.497 1.918 0 O-C-N 121.07 -1.253 . . . . 0.0 110.335 177.171 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 11.3 t-20 -84.55 119.17 24.87 Favored 'General case' 0 N--CA 1.496 1.844 0 O-C-N 121.666 -0.646 . . . . 0.0 109.784 174.154 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 35.1 m -141.75 163.99 19.38 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.717 0 O-C-N 121.737 -0.602 . . . . 0.0 109.427 -179.41 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 12' ' ' GLU . . . . . 0.407 ' HA ' ' HA ' ' A' ' 22' ' ' ARG . 37.7 tt0 -109.37 130.15 55.51 Favored 'General case' 0 N--CA 1.492 1.649 0 C-N-CA 119.855 -0.738 . . . . 0.0 109.996 177.574 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 58.4 t -106.78 127.35 62.39 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.692 0 O-C-N 121.551 -0.718 . . . . 0.0 109.827 -179.799 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 29.4 tp -95.81 125.85 40.66 Favored 'General case' 0 N--CA 1.494 1.769 0 N-CA-C 109.102 -0.703 . . . . 0.0 109.102 174.344 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 85.0 mt -97.07 166.79 11.42 Favored 'General case' 0 N--CA 1.495 1.792 0 O-C-N 121.624 -0.672 . . . . 0.0 111.293 -171.968 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 24.4 p30 -58.0 -21.49 45.08 Favored 'General case' 0 N--CA 1.507 2.382 0 O-C-N 121.83 -0.544 . . . . 0.0 111.569 -177.296 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 43.5 p-10 -93.54 27.1 2.74 Favored 'General case' 0 N--CA 1.497 1.887 0 O-C-N 121.537 -0.727 . . . . 0.0 110.539 -178.135 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 1.1 p30 53.08 27.28 5.6 Favored 'General case' 0 N--CA 1.506 2.345 0 CA-C-O 121.173 0.511 . . . . 0.0 111.042 172.249 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 51.1 m -107.62 147.33 30.79 Favored 'General case' 0 N--CA 1.491 1.585 0 N-CA-C 109.149 -0.685 . . . . 0.0 109.149 171.026 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 49.6 mttp -109.62 147.81 32.4 Favored 'General case' 0 N--CA 1.495 1.784 0 O-C-N 121.595 -0.691 . . . . 0.0 110.62 -174.744 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -153.02 156.61 39.13 Favored 'General case' 0 N--CA 1.496 1.826 0 O-C-N 121.742 -0.599 . . . . 0.0 110.129 176.18 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . 0.407 ' HA ' ' HA ' ' A' ' 12' ' ' GLU . 30.8 ptt180 -144.07 152.84 41.52 Favored 'General case' 0 N--CA 1.496 1.838 0 O-C-N 121.679 -0.638 . . . . 0.0 110.416 178.464 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -171.9 171.07 43.93 Favored Glycine 0 N--CA 1.493 2.453 0 N-CA-C 109.184 -1.566 . . . . 0.0 109.184 179.597 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 45.4 t -94.57 126.31 47.02 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.925 0 O-C-N 121.643 -0.916 . . . . 0.0 109.178 175.498 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 52.7 mt -62.86 138.36 22.97 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.147 0 O-C-N 121.589 -0.694 . . . . 0.0 111.012 -170.806 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 18.1 p -121.25 -19.09 7.19 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.861 -0.524 . . . . 0.0 111.563 179.501 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 2.2 t-20 -165.26 157.94 15.87 Favored 'General case' 0 N--CA 1.504 2.263 0 O-C-N 120.949 -1.095 . . . . 0.0 111.732 175.329 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 64.3 t80 -150.29 121.11 7.58 Favored 'General case' 0 N--CA 1.495 1.79 0 N-CA-C 109.246 -0.65 . . . . 0.0 109.246 173.683 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 17.8 t70 -98.28 130.42 44.98 Favored 'General case' 0 N--CA 1.492 1.645 0 N-CA-C 109.114 -0.699 . . . . 0.0 109.114 -176.708 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 23.2 t -70.22 -52.32 24.07 Favored 'General case' 0 N--CA 1.497 1.91 0 C-N-CA 119.977 -0.689 . . . . 0.0 110.618 -176.653 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 22.5 m -60.42 -40.69 91.91 Favored 'General case' 0 N--CA 1.502 2.171 0 O-C-N 121.654 -0.654 . . . . 0.0 110.798 -174.993 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 29.8 m120 -104.0 -10.09 18.35 Favored 'General case' 0 N--CA 1.497 1.914 0 O-C-N 121.578 -0.701 . . . . 0.0 111.601 -177.266 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 7.7 m 49.54 67.22 0.93 Allowed 'General case' 0 N--CA 1.508 2.441 0 O-C-N 121.114 -0.991 . . . . 0.0 110.886 -174.606 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 44.7 mm -121.41 125.9 74.23 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.001 0 O-C-N 121.603 -0.686 . . . . 0.0 109.329 -175.886 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 15.8 tp -116.19 118.91 34.12 Favored 'General case' 0 N--CA 1.494 1.743 0 O-C-N 121.617 -0.677 . . . . 0.0 110.537 -171.088 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 92.1 mt-30 -91.35 131.24 36.97 Favored 'General case' 0 N--CA 1.491 1.624 0 N-CA-C 109.391 -0.596 . . . . 0.0 109.391 171.299 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 44.6 mt -117.81 123.54 46.2 Favored 'General case' 0 N--CA 1.494 1.764 0 O-C-N 121.752 -0.592 . . . . 0.0 110.15 176.41 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 66.0 mtt-85 -103.18 106.59 17.14 Favored 'General case' 0 N--CA 1.498 1.942 0 O-C-N 121.688 -0.632 . . . . 0.0 110.246 171.583 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 56.9 tp -83.53 151.76 25.24 Favored 'General case' 0 N--CA 1.497 1.925 0 O-C-N 121.527 -0.733 . . . . 0.0 110.488 -178.256 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -68.69 -2.95 10.37 Favored 'General case' 0 N--CA 1.503 2.202 0 O-C-N 121.722 -0.611 . . . . 0.0 112.172 -170.641 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 91.4 m-20 -87.89 28.83 0.98 Allowed 'General case' 0 N--CA 1.498 1.938 0 O-C-N 121.033 -1.042 . . . . 0.0 110.74 174.769 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 6.3 t70 64.99 28.8 12.46 Favored 'General case' 0 N--CA 1.506 2.326 0 O-C-N 121.205 -0.934 . . . . 0.0 110.397 175.771 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 67.2 m -123.97 139.72 53.67 Favored 'General case' 0 N--CA 1.495 1.777 0 O-C-N 121.449 -0.782 . . . . 0.0 110.035 177.869 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 7.6 t -128.16 147.1 50.54 Favored 'General case' 0 N--CA 1.496 1.861 0 O-C-N 121.736 -0.603 . . . . 0.0 109.939 179.486 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 21.8 ttpt -152.25 132.4 13.54 Favored 'General case' 0 N--CA 1.496 1.869 0 C-N-CA 120.1 -0.64 . . . . 0.0 110.686 -177.526 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 86.9 p -95.27 124.33 39.25 Favored 'General case' 0 N--CA 1.495 1.779 0 O-C-N 121.75 -0.594 . . . . 0.0 110.108 177.574 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 77.8 mt -129.25 134.94 62.97 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.855 0 O-C-N 121.651 -0.655 . . . . 0.0 109.333 179.724 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 64.2 t -81.78 127.67 39.39 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.916 0 N-CA-C 109.074 -0.713 . . . . 0.0 109.074 177.646 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 61.0 p -58.03 -24.96 60.41 Favored 'General case' 0 N--CA 1.506 2.365 0 O-C-N 121.49 -0.756 . . . . 0.0 111.872 -167.763 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 33.5 tttp -56.65 -24.8 50.95 Favored 'General case' 0 N--CA 1.503 2.196 0 O-C-N 121.444 -0.785 . . . . 0.0 111.014 -177.228 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 46.3 p30 -84.06 3.28 35.31 Favored 'General case' 0 N--CA 1.499 1.992 0 C-N-CA 119.725 -0.79 . . . . 0.0 111.363 176.691 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 98.9 mt -75.2 124.38 32.94 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.104 0 O-C-N 121.185 -0.947 . . . . 0.0 109.926 177.976 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 74.7 tttt -93.26 -28.59 16.15 Favored 'General case' 0 N--CA 1.495 1.786 0 O-C-N 121.81 -0.556 . . . . 0.0 109.959 171.227 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 5.0 m-20 -163.3 153.58 15.89 Favored 'General case' 0 N--CA 1.499 2.02 0 O-C-N 121.707 -0.62 . . . . 0.0 110.068 -178.094 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 83.8 mt -132.96 148.8 52.27 Favored 'General case' 0 N--CA 1.497 1.902 0 O-C-N 121.681 -0.637 . . . . 0.0 110.512 -178.535 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 20.2 ptp180 -151.97 145.19 24.66 Favored 'General case' 0 N--CA 1.495 1.799 0 O-C-N 121.7 -0.625 . . . . 0.0 110.123 175.152 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 67.1 mt -85.84 133.48 29.5 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.822 0 O-C-N 121.539 -0.726 . . . . 0.0 109.765 172.405 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 30.5 mt . . . . . 0 N--CA 1.497 1.898 0 O-C-N 121.446 -0.784 . . . . 0.0 109.802 -177.215 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' B' B ' 257' ' ' SER . . . . . . . . . . . . . 50.0 m . . . . . 0 N--CA 1.503 2.224 0 CA-C-O 121.268 0.556 . . . . 0.0 110.518 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' B' B ' 258' ' ' SER . . . . . . . . . . . . . 23.4 t -68.23 -33.04 73.66 Favored 'General case' 0 N--CA 1.499 2.0 0 C-N-CA 120.463 -0.495 . . . . 0.0 110.242 -179.814 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 259' ' ' GLN . . . . . . . . . . . . . 78.3 mt-30 -64.65 -34.91 79.4 Favored 'General case' 0 N--CA 1.5 2.031 0 O-C-N 121.665 -0.647 . . . . 0.0 110.37 179.717 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 260' ' ' LEU . . . . . . . . . . . . . 85.7 mt -65.66 -42.6 91.17 Favored 'General case' 0 N--CA 1.501 2.082 0 O-C-N 121.728 -0.608 . . . . 0.0 110.259 179.288 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 261' ' ' LEU . . . . . . . . . . . . . 22.5 tp -69.79 -36.91 76.1 Favored 'General case' 0 N--CA 1.498 1.943 0 C-N-CA 120.175 -0.61 . . . . 0.0 109.73 176.391 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 262' ' ' SER . . . . . . . . . . . . . 22.8 t -62.33 -36.4 82.08 Favored 'General case' 0 N--CA 1.5 2.07 0 O-C-N 121.756 -0.59 . . . . 0.0 110.516 177.198 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 263' ' ' LEU . . . . . . . . . . . . . 18.2 mt . . . . . 0 N--CA 1.501 2.076 0 O-C-N 121.654 -0.654 . . . . 0.0 110.154 179.764 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 70.3 m . . . . . 0 N--CA 1.494 1.733 0 CA-C-O 120.936 0.398 . . . . 0.0 110.124 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 65.7 t -66.33 -27.81 41.64 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.131 0 O-C-N 121.792 -0.568 . . . . 0.0 110.249 -179.771 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -55.14 -30.94 60.85 Favored 'General case' 0 N--CA 1.505 2.292 0 O-C-N 121.462 -0.774 . . . . 0.0 110.449 -178.671 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 9.7 m-20 -68.66 -30.87 69.66 Favored 'General case' 0 N--CA 1.499 2.024 0 O-C-N 121.88 -0.513 . . . . 0.0 110.24 174.789 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 96.5 m-85 -95.84 10.1 38.28 Favored 'General case' 0 N--CA 1.497 1.921 0 O-C-N 121.679 -0.638 . . . . 0.0 111.449 -178.398 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 3.7 m-30 -67.16 141.81 57.24 Favored 'General case' 0 N--CA 1.501 2.105 0 O-C-N 121.147 -0.971 . . . . 0.0 110.112 174.966 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 82.95 -1.39 88.66 Favored Glycine 0 N--CA 1.498 2.776 0 N-CA-C 110.745 -0.942 . . . . 0.0 110.745 -177.056 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 88.5 p -77.34 141.01 40.09 Favored 'General case' 0 N--CA 1.498 1.972 0 O-C-N 121.125 -1.221 . . . . 0.0 110.509 -179.454 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 2.5 m120 -85.16 118.53 24.78 Favored 'General case' 0 N--CA 1.498 1.943 0 O-C-N 121.669 -0.644 . . . . 0.0 109.646 174.323 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 35.8 m -143.12 160.94 17.6 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.796 0 O-C-N 121.732 -0.605 . . . . 0.0 109.76 -178.746 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 12' ' ' GLU . . . . . 0.421 ' HA ' ' HA ' ' A' ' 22' ' ' ARG . 44.6 tt0 -109.43 125.36 52.34 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.575 -0.703 . . . . 0.0 110.16 178.142 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 59.6 t -106.87 123.17 61.74 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.839 0 O-C-N 121.565 -0.709 . . . . 0.0 109.946 -177.629 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 27.6 tp -96.2 128.95 43.58 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.726 -0.609 . . . . 0.0 109.636 175.222 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 82.8 mt -99.04 167.16 10.9 Favored 'General case' 0 N--CA 1.497 1.922 0 O-C-N 121.609 -0.682 . . . . 0.0 110.97 -171.799 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 9.5 p30 -57.77 -22.11 45.23 Favored 'General case' 0 N--CA 1.505 2.294 0 O-C-N 121.76 -0.587 . . . . 0.0 111.39 -179.961 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 24.6 p30 -90.03 21.3 3.75 Favored 'General case' 0 N--CA 1.5 2.063 0 O-C-N 121.59 -0.694 . . . . 0.0 111.163 -177.721 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 74.4 m-20 59.87 28.8 18.35 Favored 'General case' 0 N--CA 1.506 2.36 0 O-C-N 121.339 -0.851 . . . . 0.0 110.813 172.675 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 18.0 m -111.66 133.94 53.57 Favored 'General case' 0 N--CA 1.494 1.769 0 O-C-N 121.494 -0.754 . . . . 0.0 109.573 170.617 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 5.3 ttpm? -109.84 142.15 41.52 Favored 'General case' 0 N--CA 1.494 1.731 0 O-C-N 121.647 -0.658 . . . . 0.0 110.523 -177.114 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -152.99 160.27 43.0 Favored 'General case' 0 N--CA 1.496 1.828 0 O-C-N 121.773 -0.579 . . . . 0.0 110.09 179.562 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . 0.421 ' HA ' ' HA ' ' A' ' 12' ' ' GLU . 30.9 ptt180 -140.28 148.57 41.63 Favored 'General case' 0 N--CA 1.497 1.916 0 O-C-N 121.622 -0.674 . . . . 0.0 110.8 -178.844 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -171.71 171.44 44.08 Favored Glycine 0 N--CA 1.495 2.617 0 N-CA-C 108.701 -1.759 . . . . 0.0 108.701 -176.332 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 39.0 t -94.6 118.84 41.6 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.925 0 O-C-N 121.462 -1.022 . . . . 0.0 109.314 -175.913 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 95.3 mt -63.95 143.41 15.7 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.142 0 O-C-N 121.665 -0.647 . . . . 0.0 110.333 -172.073 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 7.5 p -121.25 -27.01 4.95 Favored 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.721 -0.612 . . . . 0.0 111.336 -179.887 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 27.2 t30 -162.03 160.67 27.84 Favored 'General case' 0 N--CA 1.499 1.991 0 C-N-CA 119.002 -1.079 . . . . 0.0 111.814 -179.109 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 83.3 t80 -150.19 126.73 10.86 Favored 'General case' 0 N--CA 1.497 1.901 0 N-CA-C 108.964 -0.754 . . . . 0.0 108.964 170.599 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 21.3 t70 -99.73 130.51 45.95 Favored 'General case' 0 N--CA 1.491 1.597 0 N-CA-C 108.955 -0.757 . . . . 0.0 108.955 -177.431 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 20.1 m -70.31 -51.68 28.4 Favored 'General case' 0 N--CA 1.498 1.946 0 C-N-CA 119.999 -0.681 . . . . 0.0 110.394 -176.9 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 23.1 m -60.07 -41.25 92.02 Favored 'General case' 0 N--CA 1.502 2.17 0 O-C-N 121.619 -0.676 . . . . 0.0 110.829 -174.967 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 29.8 m120 -103.91 -10.14 18.4 Favored 'General case' 0 N--CA 1.496 1.87 0 O-C-N 121.624 -0.673 . . . . 0.0 111.613 -177.662 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 1.8 m 49.91 67.34 0.92 Allowed 'General case' 0 N--CA 1.509 2.51 0 O-C-N 121.098 -1.001 . . . . 0.0 111.07 -175.776 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 47.4 mm -126.69 127.03 69.76 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.167 0 O-C-N 121.597 -0.689 . . . . 0.0 109.479 -176.066 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 11.7 tp -115.88 121.61 42.87 Favored 'General case' 0 N--CA 1.494 1.765 0 O-C-N 121.708 -0.62 . . . . 0.0 110.521 -170.432 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 79.5 mt-30 -91.61 134.19 34.9 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.829 -0.544 . . . . 0.0 109.539 173.83 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 13.9 mt -117.82 123.81 46.83 Favored 'General case' 0 N--CA 1.493 1.725 0 O-C-N 121.798 -0.564 . . . . 0.0 109.989 174.52 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 56.6 ttt85 -98.42 107.69 20.2 Favored 'General case' 0 N--CA 1.497 1.878 0 O-C-N 121.63 -0.669 . . . . 0.0 109.756 175.986 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 18.9 tp -85.1 150.75 24.63 Favored 'General case' 0 N--CA 1.495 1.797 0 O-C-N 121.697 -0.627 . . . . 0.0 110.993 -173.933 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -63.15 -9.17 9.83 Favored 'General case' 0 N--CA 1.503 2.184 0 O-C-N 121.922 -0.486 . . . . 0.0 111.962 -173.223 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 37.7 t30 -85.01 29.08 0.66 Allowed 'General case' 0 N--CA 1.499 2.018 0 O-C-N 121.146 -0.971 . . . . 0.0 110.952 174.202 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 74.4 m-20 59.67 31.81 21.1 Favored 'General case' 0 N--CA 1.504 2.27 0 O-C-N 121.257 -0.902 . . . . 0.0 110.428 174.176 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 48.9 m -123.92 137.78 54.58 Favored 'General case' 0 N--CA 1.496 1.859 0 O-C-N 121.394 -0.816 . . . . 0.0 110.374 178.836 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 9.0 t -97.55 150.21 21.35 Favored 'General case' 0 N--CA 1.497 1.906 0 O-C-N 121.735 -0.603 . . . . 0.0 110.212 176.244 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 42.1 tttp -149.81 119.16 6.85 Favored 'General case' 0 N--CA 1.496 1.861 0 O-C-N 121.662 -0.649 . . . . 0.0 110.255 178.466 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 90.3 p -96.07 122.63 39.12 Favored 'General case' 0 N--CA 1.495 1.807 0 O-C-N 121.676 -0.64 . . . . 0.0 110.21 178.431 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 82.5 mt -129.27 135.68 61.24 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.845 0 O-C-N 121.565 -0.709 . . . . 0.0 109.328 179.835 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 58.7 t -81.95 127.57 39.5 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.902 0 O-C-N 121.531 -0.731 . . . . 0.0 109.232 179.56 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 37.4 p -59.41 -24.81 63.78 Favored 'General case' 0 N--CA 1.504 2.273 0 O-C-N 121.659 -0.651 . . . . 0.0 112.055 -170.101 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 73.5 tttt -56.23 -22.78 31.62 Favored 'General case' 0 N--CA 1.503 2.183 0 O-C-N 121.401 -0.812 . . . . 0.0 111.1 -177.161 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 51.4 p30 -83.8 0.92 45.42 Favored 'General case' 0 N--CA 1.499 1.985 0 O-C-N 121.443 -0.786 . . . . 0.0 111.358 176.369 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 96.3 mt -75.99 127.76 37.36 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.089 0 O-C-N 121.162 -0.961 . . . . 0.0 110.084 178.72 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 75.0 tttt -91.76 -32.39 15.41 Favored 'General case' 0 N--CA 1.493 1.711 0 N-CA-C 109.443 -0.577 . . . . 0.0 109.443 169.901 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -161.47 157.29 24.79 Favored 'General case' 0 N--CA 1.497 1.898 0 O-C-N 121.723 -0.611 . . . . 0.0 109.815 -177.037 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 85.2 mt -132.92 148.55 52.28 Favored 'General case' 0 N--CA 1.497 1.904 0 O-C-N 121.65 -0.656 . . . . 0.0 110.462 -179.851 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 6.5 ptm180 -150.76 139.6 20.85 Favored 'General case' 0 N--CA 1.495 1.782 0 O-C-N 121.765 -0.584 . . . . 0.0 109.94 176.335 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 67.7 mt -84.98 133.26 29.73 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.872 0 O-C-N 121.522 -0.736 . . . . 0.0 109.671 174.079 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 45.1 mt . . . . . 0 N--CA 1.498 1.952 0 O-C-N 121.566 -0.709 . . . . 0.0 110.255 -178.462 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' B' B ' 257' ' ' SER . . . . . . . . . . . . . 6.6 t . . . . . 0 N--CA 1.503 2.198 0 CA-C-O 121.324 0.583 . . . . 0.0 110.421 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' B' B ' 258' ' ' SER . . . . . . . . . . . . . 24.8 m -68.09 -32.53 72.91 Favored 'General case' 0 N--CA 1.497 1.908 0 O-C-N 121.864 -0.522 . . . . 0.0 110.239 179.983 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 259' ' ' GLN . . . . . . . . . . . . . 78.1 mt-30 -64.64 -35.03 79.71 Favored 'General case' 0 N--CA 1.5 2.028 0 O-C-N 121.593 -0.692 . . . . 0.0 110.367 179.782 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 260' ' ' LEU . . . . . . . . . . . . . 51.4 mt -65.52 -43.4 90.17 Favored 'General case' 0 N--CA 1.501 2.082 0 O-C-N 121.67 -0.644 . . . . 0.0 110.281 179.045 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 261' ' ' LEU . . . . . . . . . . . . . 21.5 tp -71.05 -36.94 72.5 Favored 'General case' 0 N--CA 1.498 1.932 0 C-N-CA 120.088 -0.645 . . . . 0.0 109.586 174.97 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 262' ' ' SER . . . . . . . . . . . . . 22.6 t -62.25 -35.69 79.73 Favored 'General case' 0 N--CA 1.501 2.09 0 O-C-N 121.714 -0.616 . . . . 0.0 110.438 175.893 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 263' ' ' LEU . . . . . . . . . . . . . 16.2 mt . . . . . 0 N--CA 1.5 2.068 0 O-C-N 121.683 -0.635 . . . . 0.0 110.242 179.433 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 66.2 m . . . . . 0 N--CA 1.495 1.786 0 CA-C-O 121.046 0.451 . . . . 0.0 110.181 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 69.5 t -66.46 -27.82 41.51 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.048 0 O-C-N 121.652 -0.655 . . . . 0.0 110.254 -179.265 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -55.17 -31.27 61.23 Favored 'General case' 0 N--CA 1.504 2.273 0 O-C-N 121.499 -0.751 . . . . 0.0 110.42 -178.891 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 74.5 m-20 -68.63 -31.33 70.4 Favored 'General case' 0 N--CA 1.499 1.99 0 O-C-N 121.883 -0.511 . . . . 0.0 110.131 174.714 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 87.4 m-85 -95.59 10.05 38.07 Favored 'General case' 0 N--CA 1.497 1.887 0 O-C-N 121.641 -0.662 . . . . 0.0 111.398 -179.573 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 3.1 m-30 -67.24 144.05 56.16 Favored 'General case' 0 N--CA 1.502 2.128 0 O-C-N 121.154 -0.966 . . . . 0.0 110.042 175.52 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 82.06 0.71 89.88 Favored Glycine 0 N--CA 1.497 2.717 0 N-CA-C 110.483 -1.047 . . . . 0.0 110.483 -175.766 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 89.2 p -77.75 141.04 39.52 Favored 'General case' 0 N--CA 1.497 1.889 0 O-C-N 121.079 -1.248 . . . . 0.0 110.514 -178.851 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 2.6 m120 -85.08 120.2 26.32 Favored 'General case' 0 N--CA 1.497 1.92 0 O-C-N 121.665 -0.647 . . . . 0.0 109.495 173.532 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 35.5 m -143.5 162.93 16.21 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.78 0 O-C-N 121.715 -0.616 . . . . 0.0 109.566 -178.838 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 33.3 tt0 -109.4 127.87 54.7 Favored 'General case' 0 N--CA 1.494 1.729 0 C-N-CA 119.896 -0.722 . . . . 0.0 109.952 177.539 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 60.5 t -106.92 124.1 62.4 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.863 0 O-C-N 121.673 -0.642 . . . . 0.0 109.808 -179.67 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 15.4 tp -96.03 125.96 40.94 Favored 'General case' 0 N--CA 1.494 1.749 0 O-C-N 121.761 -0.587 . . . . 0.0 109.47 175.144 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 83.1 mt -97.44 163.17 12.99 Favored 'General case' 0 N--CA 1.498 1.937 0 O-C-N 121.553 -0.717 . . . . 0.0 111.054 -172.594 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 24.9 p30 -59.21 -21.64 59.81 Favored 'General case' 0 N--CA 1.505 2.294 0 O-C-N 121.722 -0.611 . . . . 0.0 111.489 -177.961 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 25.5 p30 -92.19 23.52 3.79 Favored 'General case' 0 N--CA 1.498 1.959 0 O-C-N 121.532 -0.73 . . . . 0.0 110.977 -176.571 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 74.4 m-20 60.18 28.63 18.22 Favored 'General case' 0 N--CA 1.504 2.265 0 O-C-N 121.414 -0.804 . . . . 0.0 110.836 173.07 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 43.2 m -107.99 134.94 50.18 Favored 'General case' 0 N--CA 1.495 1.793 0 O-C-N 121.491 -0.755 . . . . 0.0 109.567 170.395 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 37.4 ttmt -109.64 137.73 47.04 Favored 'General case' 0 N--CA 1.494 1.761 0 O-C-N 121.756 -0.59 . . . . 0.0 110.345 -176.137 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -153.05 158.86 42.58 Favored 'General case' 0 N--CA 1.496 1.836 0 O-C-N 121.686 -0.634 . . . . 0.0 110.498 -179.782 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 42.9 ptt85 -144.02 150.88 38.92 Favored 'General case' 0 N--CA 1.496 1.836 0 O-C-N 121.683 -0.635 . . . . 0.0 110.5 178.838 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -171.64 171.42 44.06 Favored Glycine 0 N--CA 1.494 2.535 0 N-CA-C 108.872 -1.691 . . . . 0.0 108.872 -174.493 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 38.5 t -94.49 117.17 37.58 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.933 0 O-C-N 121.522 -0.987 . . . . 0.0 109.402 -176.519 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 92.0 mt -63.93 143.16 15.94 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.154 0 O-C-N 121.642 -0.661 . . . . 0.0 110.397 -172.157 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 7.8 p -121.21 -26.76 5.01 Favored 'General case' 0 N--CA 1.495 1.785 0 O-C-N 121.685 -0.634 . . . . 0.0 111.245 -179.669 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 7.6 t30 -161.94 156.9 23.01 Favored 'General case' 0 N--CA 1.5 2.051 0 C-N-CA 118.88 -1.128 . . . . 0.0 111.726 -178.17 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 28' ' ' PHE . . . . . 0.4 ' HA ' ' O ' ' A' ' 34' ' ' ILE . 62.8 t80 -150.07 123.56 9.07 Favored 'General case' 0 N--CA 1.498 1.949 0 N-CA-C 109.373 -0.602 . . . . 0.0 109.373 170.433 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 17.8 t70 -99.3 127.06 45.26 Favored 'General case' 0 N--CA 1.492 1.638 0 N-CA-C 109.162 -0.681 . . . . 0.0 109.162 -178.541 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 22.6 t -64.68 -43.53 93.23 Favored 'General case' 0 N--CA 1.5 2.044 0 O-C-N 121.72 -0.612 . . . . 0.0 110.907 -174.709 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 21.1 m -59.7 -48.09 83.06 Favored 'General case' 0 N--CA 1.502 2.166 0 O-C-N 121.539 -0.726 . . . . 0.0 110.984 -173.444 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 91.5 m-20 -106.99 -0.31 23.15 Favored 'General case' 0 N--CA 1.498 1.966 0 O-C-N 121.613 -0.679 . . . . 0.0 111.675 -179.364 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 45.2 p 45.26 67.02 0.78 Allowed 'General case' 0 N--CA 1.507 2.391 0 O-C-N 121.494 -0.754 . . . . 0.0 111.212 -174.986 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 34' ' ' ILE . . . . . 0.4 ' O ' ' HA ' ' A' ' 28' ' ' PHE . 41.3 mm -114.48 125.86 71.88 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.963 0 O-C-N 121.629 -0.669 . . . . 0.0 109.213 -176.047 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 10.2 tp -115.75 118.84 34.16 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.604 -0.685 . . . . 0.0 110.416 -169.554 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 99.3 mt-30 -91.38 133.13 35.72 Favored 'General case' 0 N--CA 1.49 1.528 0 N-CA-C 109.381 -0.6 . . . . 0.0 109.381 173.731 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 14.6 mt -117.88 123.8 46.76 Favored 'General case' 0 N--CA 1.494 1.753 0 O-C-N 121.837 -0.539 . . . . 0.0 109.945 175.107 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 72.5 ttt180 -97.36 105.01 17.08 Favored 'General case' 0 N--CA 1.495 1.813 0 O-C-N 121.672 -0.643 . . . . 0.0 109.783 176.001 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 22.0 tp -85.16 154.3 22.1 Favored 'General case' 0 N--CA 1.494 1.765 0 O-C-N 121.716 -0.615 . . . . 0.0 111.075 -173.624 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -65.54 -6.48 10.94 Favored 'General case' 0 N--CA 1.503 2.179 0 O-C-N 121.955 -0.466 . . . . 0.0 112.149 -169.961 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 49.4 p-10 -86.17 29.15 0.76 Allowed 'General case' 0 N--CA 1.5 2.064 0 O-C-N 121.12 -0.987 . . . . 0.0 110.873 174.199 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 74.3 m-20 57.65 29.68 17.66 Favored 'General case' 0 N--CA 1.504 2.24 0 O-C-N 121.252 -0.905 . . . . 0.0 110.36 177.126 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 37.8 m -120.62 137.87 54.2 Favored 'General case' 0 N--CA 1.496 1.852 0 O-C-N 121.458 -0.776 . . . . 0.0 110.397 178.996 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 9.7 t -97.47 150.99 20.45 Favored 'General case' 0 N--CA 1.497 1.878 0 O-C-N 121.76 -0.588 . . . . 0.0 110.222 176.46 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 40.9 tttp -148.61 119.14 7.42 Favored 'General case' 0 N--CA 1.497 1.886 0 O-C-N 121.591 -0.693 . . . . 0.0 110.269 178.05 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 91.0 p -96.59 122.12 39.16 Favored 'General case' 0 N--CA 1.494 1.736 0 O-C-N 121.635 -0.666 . . . . 0.0 110.284 179.027 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 82.8 mt -129.32 133.94 64.65 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.909 0 O-C-N 121.628 -0.67 . . . . 0.0 109.422 178.974 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 60.3 t -82.0 127.9 39.2 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.959 0 C-N-CA 120.103 -0.639 . . . . 0.0 109.404 179.41 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 37.5 p -57.86 -24.83 59.35 Favored 'General case' 0 N--CA 1.505 2.3 0 O-C-N 121.734 -0.604 . . . . 0.0 112.281 -165.869 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 16.6 pttp -56.14 -22.47 28.74 Favored 'General case' 0 N--CA 1.506 2.337 0 O-C-N 121.515 -0.741 . . . . 0.0 111.238 -176.016 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 10.3 p30 -82.01 -1.06 47.0 Favored 'General case' 0 N--CA 1.5 2.046 0 C-N-CA 119.889 -0.724 . . . . 0.0 111.194 176.398 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 89.6 mt -77.37 130.24 36.48 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.082 0 O-C-N 121.223 -0.923 . . . . 0.0 110.129 177.812 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 40.4 tttp -91.53 -31.73 15.83 Favored 'General case' 0 N--CA 1.494 1.766 0 O-C-N 121.772 -0.58 . . . . 0.0 109.496 168.778 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 5.3 m-20 -164.27 159.64 20.19 Favored 'General case' 0 N--CA 1.5 2.052 0 O-C-N 121.832 -0.542 . . . . 0.0 110.063 -177.869 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 83.1 mt -132.99 150.21 52.18 Favored 'General case' 0 N--CA 1.495 1.802 0 O-C-N 121.752 -0.592 . . . . 0.0 110.395 -179.44 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 19.9 ptp180 -150.39 141.39 22.96 Favored 'General case' 0 N--CA 1.495 1.803 0 O-C-N 121.7 -0.625 . . . . 0.0 109.998 175.336 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 67.0 mt -85.15 133.21 29.89 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.822 0 O-C-N 121.541 -0.724 . . . . 0.0 109.884 173.702 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 25.2 mt . . . . . 0 N--CA 1.497 1.901 0 O-C-N 121.652 -0.655 . . . . 0.0 110.095 -179.337 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' B' B ' 257' ' ' SER . . . . . . . . . . . . . 44.9 t . . . . . 0 N--CA 1.502 2.16 0 CA-C-O 121.264 0.554 . . . . 0.0 110.563 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' B' B ' 258' ' ' SER . . . . . . . . . . . . . 83.9 p -69.54 -30.76 68.66 Favored 'General case' 0 N--CA 1.498 1.945 0 C-N-CA 120.359 -0.536 . . . . 0.0 110.295 -178.724 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 259' ' ' GLN . . . . . . . . . . . . . 46.4 tt0 -63.25 -37.81 88.7 Favored 'General case' 0 N--CA 1.501 2.091 0 O-C-N 121.614 -0.679 . . . . 0.0 110.378 179.373 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 260' ' ' LEU . . . . . . . . . . . . . 83.3 mt -66.09 -42.45 89.28 Favored 'General case' 0 N--CA 1.5 2.041 0 O-C-N 121.67 -0.644 . . . . 0.0 110.249 179.627 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 261' ' ' LEU . . . . . . . . . . . . . 22.5 tp -70.32 -38.14 74.84 Favored 'General case' 0 N--CA 1.497 1.921 0 O-C-N 121.679 -0.638 . . . . 0.0 109.772 176.292 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 262' ' ' SER . . . . . . . . . . . . . 69.7 m -62.51 -35.87 80.75 Favored 'General case' 0 N--CA 1.501 2.097 0 O-C-N 121.767 -0.583 . . . . 0.0 110.533 176.916 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 263' ' ' LEU . . . . . . . . . . . . . 21.4 mt . . . . . 0 N--CA 1.501 2.116 0 O-C-N 121.602 -0.686 . . . . 0.0 110.235 -179.822 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 68.4 m . . . . . 0 N--CA 1.495 1.782 0 CA-C-O 121.049 0.452 . . . . 0.0 110.256 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 67.3 t -66.45 -27.78 41.4 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.085 0 O-C-N 121.676 -0.64 . . . . 0.0 110.379 -178.98 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -54.91 -30.67 58.9 Favored 'General case' 0 N--CA 1.505 2.296 0 O-C-N 121.451 -0.781 . . . . 0.0 110.538 -177.906 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 74.5 m-20 -69.01 -30.55 68.95 Favored 'General case' 0 N--CA 1.499 1.982 0 O-C-N 121.827 -0.546 . . . . 0.0 110.321 175.018 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 97.2 m-85 -95.49 10.12 37.64 Favored 'General case' 0 N--CA 1.497 1.898 0 O-C-N 121.628 -0.67 . . . . 0.0 111.512 -178.208 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 3.8 m-30 -67.18 140.25 57.46 Favored 'General case' 0 N--CA 1.502 2.156 0 O-C-N 121.158 -0.964 . . . . 0.0 110.134 174.735 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 83.15 -2.04 87.66 Favored Glycine 0 N--CA 1.498 2.79 0 N-CA-C 110.67 -0.972 . . . . 0.0 110.67 -176.118 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 67.1 m -75.31 140.95 43.43 Favored 'General case' 0 N--CA 1.497 1.902 0 O-C-N 121.11 -1.229 . . . . 0.0 110.554 -179.536 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 4.3 m-80 -85.63 117.82 24.76 Favored 'General case' 0 N--CA 1.497 1.893 0 N-CA-C 109.492 -0.558 . . . . 0.0 109.492 173.525 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 35.3 m -142.55 162.32 18.52 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.889 0 O-C-N 121.675 -0.641 . . . . 0.0 109.746 179.591 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 12' ' ' GLU . . . . . 0.408 ' HA ' ' HA ' ' A' ' 22' ' ' ARG . 45.3 tt0 -109.41 129.98 55.52 Favored 'General case' 0 N--CA 1.492 1.65 0 C-N-CA 119.851 -0.74 . . . . 0.0 109.887 176.069 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 60.3 t -106.74 125.58 62.67 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.714 0 O-C-N 121.725 -0.61 . . . . 0.0 109.831 179.731 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 28.6 tp -95.82 126.28 40.97 Favored 'General case' 0 N--CA 1.493 1.707 0 N-CA-C 109.128 -0.693 . . . . 0.0 109.128 175.225 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 87.1 mt -95.85 168.05 10.88 Favored 'General case' 0 N--CA 1.496 1.839 0 O-C-N 121.689 -0.632 . . . . 0.0 111.087 -172.989 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 24.3 p30 -58.15 -21.86 48.77 Favored 'General case' 0 N--CA 1.507 2.39 0 O-C-N 121.835 -0.54 . . . . 0.0 111.583 -176.896 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 44.0 p-10 -92.2 22.79 4.19 Favored 'General case' 0 N--CA 1.498 1.973 0 O-C-N 121.561 -0.712 . . . . 0.0 110.968 -176.636 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 74.3 m-20 58.75 27.52 16.08 Favored 'General case' 0 N--CA 1.505 2.298 0 O-C-N 121.364 -0.835 . . . . 0.0 110.662 175.77 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 51.1 m -106.86 142.01 37.17 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.473 -0.767 . . . . 0.0 109.568 172.645 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 94.6 mttt -109.62 146.42 34.78 Favored 'General case' 0 N--CA 1.496 1.83 0 O-C-N 121.611 -0.681 . . . . 0.0 110.646 -176.183 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -153.11 151.16 29.86 Favored 'General case' 0 N--CA 1.497 1.877 0 O-C-N 121.825 -0.547 . . . . 0.0 109.991 175.277 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . 0.408 ' HA ' ' HA ' ' A' ' 12' ' ' GLU . 31.0 ptt180 -140.02 146.17 38.69 Favored 'General case' 0 N--CA 1.499 2.001 0 O-C-N 121.568 -0.707 . . . . 0.0 110.654 -179.853 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -171.77 171.49 44.13 Favored Glycine 0 N--CA 1.495 2.609 0 N-CA-C 108.768 -1.733 . . . . 0.0 108.768 -174.378 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 25.2 t -94.55 120.1 43.48 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.907 0 O-C-N 121.49 -1.006 . . . . 0.0 109.34 -176.119 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 87.2 mt -63.45 143.33 15.72 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.24 0 O-C-N 121.479 -0.763 . . . . 0.0 110.462 -172.729 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 6.7 p -121.15 -28.73 4.67 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.671 -0.643 . . . . 0.0 111.329 179.079 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 26.9 t30 -161.97 158.78 25.67 Favored 'General case' 0 N--CA 1.499 2.004 0 O-C-N 120.985 -1.072 . . . . 0.0 111.661 -177.095 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 84.3 t80 -150.08 126.86 11.03 Favored 'General case' 0 N--CA 1.497 1.882 0 N-CA-C 109.132 -0.692 . . . . 0.0 109.132 170.78 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 21.3 t70 -100.53 130.92 46.67 Favored 'General case' 0 N--CA 1.491 1.581 0 N-CA-C 109.04 -0.726 . . . . 0.0 109.04 -176.772 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 20.9 m -69.29 -49.99 50.87 Favored 'General case' 0 N--CA 1.498 1.946 0 C-N-CA 120.062 -0.655 . . . . 0.0 110.504 -176.679 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 22.6 m -59.76 -42.72 93.88 Favored 'General case' 0 N--CA 1.502 2.135 0 O-C-N 121.648 -0.658 . . . . 0.0 110.84 -174.478 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 29.6 m120 -103.71 -10.1 18.61 Favored 'General case' 0 N--CA 1.496 1.873 0 O-C-N 121.667 -0.646 . . . . 0.0 111.553 -178.069 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 1.8 m 49.88 67.38 0.91 Allowed 'General case' 0 N--CA 1.507 2.424 0 O-C-N 121.103 -0.998 . . . . 0.0 110.87 -174.795 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 47.4 mm -125.43 126.86 71.25 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.006 0 O-C-N 121.557 -0.715 . . . . 0.0 109.469 -176.061 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 6.7 tp -115.85 120.03 37.93 Favored 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.678 -0.639 . . . . 0.0 110.335 -169.237 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 99.5 mt-30 -90.98 134.68 34.29 Favored 'General case' 0 N--CA 1.492 1.63 0 C-N-CA 120.268 -0.573 . . . . 0.0 109.477 175.386 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 17.2 mt -117.82 123.87 46.98 Favored 'General case' 0 N--CA 1.495 1.781 0 O-C-N 121.854 -0.529 . . . . 0.0 110.023 174.818 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 74.9 ttt-85 -97.26 108.5 21.25 Favored 'General case' 0 N--CA 1.497 1.88 0 O-C-N 121.756 -0.59 . . . . 0.0 109.778 175.215 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 17.8 tp -85.28 151.67 23.88 Favored 'General case' 0 N--CA 1.495 1.797 0 O-C-N 121.703 -0.623 . . . . 0.0 110.981 -174.206 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -62.99 -9.25 9.31 Favored 'General case' 0 N--CA 1.503 2.193 0 O-C-N 121.965 -0.459 . . . . 0.0 111.895 -172.668 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 30.1 m120 -85.38 29.05 0.69 Allowed 'General case' 0 N--CA 1.499 1.981 0 O-C-N 121.086 -1.009 . . . . 0.0 110.95 174.33 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 74.4 m-20 59.33 31.15 20.92 Favored 'General case' 0 N--CA 1.505 2.302 0 O-C-N 121.136 -0.978 . . . . 0.0 110.366 174.378 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 48.7 m -122.81 137.93 54.79 Favored 'General case' 0 N--CA 1.495 1.795 0 O-C-N 121.42 -0.8 . . . . 0.0 110.395 179.121 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 9.0 t -97.19 149.41 22.04 Favored 'General case' 0 N--CA 1.498 1.949 0 O-C-N 121.814 -0.554 . . . . 0.0 110.233 176.77 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 74.7 tttt -149.89 119.2 6.83 Favored 'General case' 0 N--CA 1.494 1.755 0 O-C-N 121.602 -0.687 . . . . 0.0 110.255 178.515 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 88.7 p -95.0 123.97 38.78 Favored 'General case' 0 N--CA 1.496 1.828 0 O-C-N 121.694 -0.629 . . . . 0.0 110.175 179.214 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 82.4 mt -129.32 134.47 63.71 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.9 0 N-CA-C 109.246 -0.649 . . . . 0.0 109.246 -179.967 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 63.1 t -82.11 127.59 39.49 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.891 0 O-C-N 121.574 -0.704 . . . . 0.0 109.268 179.668 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 38.6 p -59.97 -24.93 64.82 Favored 'General case' 0 N--CA 1.503 2.216 0 O-C-N 121.592 -0.692 . . . . 0.0 112.065 -171.141 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 80.8 mttt -56.82 -25.29 55.65 Favored 'General case' 0 N--CA 1.502 2.174 0 O-C-N 121.445 -0.784 . . . . 0.0 111.03 -176.405 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 6.3 p30 -84.62 5.2 28.91 Favored 'General case' 0 N--CA 1.498 1.947 0 C-N-CA 119.726 -0.79 . . . . 0.0 111.441 176.318 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 98.6 mt -75.56 127.94 37.12 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.146 0 O-C-N 121.136 -0.977 . . . . 0.0 109.92 175.972 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 40.0 tttp -91.92 -32.76 15.15 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.782 -0.573 . . . . 0.0 109.528 168.942 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -161.46 156.82 24.12 Favored 'General case' 0 N--CA 1.499 1.977 0 O-C-N 121.76 -0.587 . . . . 0.0 109.958 -176.936 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 86.2 mt -133.05 150.09 52.14 Favored 'General case' 0 N--CA 1.497 1.922 0 O-C-N 121.639 -0.663 . . . . 0.0 110.517 -179.425 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 20.1 ptp180 -151.86 142.85 23.09 Favored 'General case' 0 N--CA 1.495 1.81 0 O-C-N 121.741 -0.599 . . . . 0.0 110.065 175.518 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 66.5 mt -86.49 133.19 30.41 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.912 0 O-C-N 121.558 -0.714 . . . . 0.0 109.835 173.428 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 50.8 mt . . . . . 0 N--CA 1.497 1.924 0 O-C-N 121.583 -0.698 . . . . 0.0 110.091 179.41 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' B' B ' 257' ' ' SER . . . . . . . . . . . . . 43.2 t . . . . . 0 N--CA 1.503 2.195 0 CA-C-O 121.258 0.552 . . . . 0.0 110.499 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' B' B ' 258' ' ' SER . . . . . . . . . . . . . 25.2 m -68.89 -30.87 69.45 Favored 'General case' 0 N--CA 1.498 1.968 0 C-N-CA 120.436 -0.506 . . . . 0.0 110.389 -179.769 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 259' ' ' GLN . . . . . . . . . . . . . 48.9 tt0 -63.56 -39.98 95.81 Favored 'General case' 0 N--CA 1.501 2.108 0 O-C-N 121.589 -0.694 . . . . 0.0 110.43 -179.903 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 260' ' ' LEU . . . . . . . . . . . . . 83.7 mt -67.37 -43.53 81.18 Favored 'General case' 0 N--CA 1.5 2.055 0 O-C-N 121.609 -0.682 . . . . 0.0 110.247 -179.661 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 261' ' ' LEU . . . . . . . . . . . . . 17.1 tp -70.38 -36.77 74.33 Favored 'General case' 0 N--CA 1.498 1.962 0 O-C-N 121.634 -0.666 . . . . 0.0 109.629 177.078 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 262' ' ' SER . . . . . . . . . . . . . 22.8 t -62.79 -35.84 81.2 Favored 'General case' 0 N--CA 1.501 2.076 0 O-C-N 121.776 -0.578 . . . . 0.0 110.565 176.671 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 263' ' ' LEU . . . . . . . . . . . . . 19.9 mt . . . . . 0 N--CA 1.501 2.078 0 O-C-N 121.598 -0.689 . . . . 0.0 110.247 -179.331 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 65.5 m . . . . . 0 N--CA 1.494 1.77 0 CA-C-O 120.956 0.408 . . . . 0.0 109.976 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 69.3 t -66.81 -27.82 41.09 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.082 0 O-C-N 121.596 -0.69 . . . . 0.0 110.097 179.823 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -55.21 -30.62 60.33 Favored 'General case' 0 N--CA 1.504 2.25 0 O-C-N 121.401 -0.812 . . . . 0.0 110.313 179.711 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -68.17 -31.48 71.06 Favored 'General case' 0 N--CA 1.498 1.948 0 O-C-N 121.847 -0.533 . . . . 0.0 110.151 174.533 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 88.2 m-85 -95.73 9.53 40.08 Favored 'General case' 0 N--CA 1.497 1.888 0 O-C-N 121.711 -0.618 . . . . 0.0 111.342 179.869 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 3.5 m-30 -67.3 142.15 56.94 Favored 'General case' 0 N--CA 1.501 2.123 0 O-C-N 121.181 -0.949 . . . . 0.0 110.113 174.324 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 82.45 -0.2 89.32 Favored Glycine 0 N--CA 1.498 2.769 0 N-CA-C 110.648 -0.981 . . . . 0.0 110.648 -176.746 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 84.5 p -77.4 137.37 38.68 Favored 'General case' 0 N--CA 1.497 1.909 0 O-C-N 121.081 -1.247 . . . . 0.0 110.478 179.32 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 12.1 t-20 -84.05 119.09 24.54 Favored 'General case' 0 N--CA 1.497 1.923 0 O-C-N 121.644 -0.66 . . . . 0.0 109.45 172.944 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 35.6 m -142.64 164.0 17.39 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.63 0 O-C-N 121.829 -0.545 . . . . 0.0 109.541 -179.166 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 35.6 tt0 -109.32 129.13 55.53 Favored 'General case' 0 N--CA 1.493 1.687 0 C-N-CA 119.929 -0.708 . . . . 0.0 109.916 177.183 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 61.4 t -106.69 127.92 61.78 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.713 0 O-C-N 121.581 -0.7 . . . . 0.0 109.818 179.763 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 29.9 tp -95.94 128.33 42.74 Favored 'General case' 0 N--CA 1.493 1.718 0 N-CA-C 109.26 -0.644 . . . . 0.0 109.26 176.511 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 86.1 mt -95.02 160.94 14.34 Favored 'General case' 0 N--CA 1.495 1.813 0 O-C-N 121.615 -0.678 . . . . 0.0 111.015 -173.687 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 24.3 p30 -58.05 -21.87 47.56 Favored 'General case' 0 N--CA 1.506 2.343 0 O-C-N 121.819 -0.55 . . . . 0.0 111.571 -178.166 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 38.3 p-10 -93.28 24.02 4.1 Favored 'General case' 0 N--CA 1.497 1.923 0 O-C-N 121.507 -0.745 . . . . 0.0 110.782 -177.378 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 74.2 m-20 59.24 27.88 17.04 Favored 'General case' 0 N--CA 1.505 2.311 0 O-C-N 121.437 -0.789 . . . . 0.0 110.661 175.812 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 50.8 m -103.65 142.3 34.55 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.551 -0.718 . . . . 0.0 109.517 172.182 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 96.5 mttt -109.6 142.75 40.28 Favored 'General case' 0 N--CA 1.494 1.77 0 O-C-N 121.633 -0.667 . . . . 0.0 110.581 -175.806 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -153.07 152.82 31.77 Favored 'General case' 0 N--CA 1.497 1.897 0 O-C-N 121.725 -0.609 . . . . 0.0 110.304 176.376 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 32.9 ptt180 -144.08 149.13 36.11 Favored 'General case' 0 N--CA 1.498 1.951 0 O-C-N 121.691 -0.631 . . . . 0.0 110.519 177.574 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -171.77 171.46 44.11 Favored Glycine 0 N--CA 1.496 2.656 0 N-CA-C 108.954 -1.658 . . . . 0.0 108.954 -176.365 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 46.7 t -94.62 119.32 42.44 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.909 0 O-C-N 121.444 -1.033 . . . . 0.0 109.298 -177.27 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 95.8 mt -64.39 143.59 15.56 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.179 0 O-C-N 121.69 -0.631 . . . . 0.0 110.601 -171.312 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 7.9 p -121.17 -26.91 5.0 Favored 'General case' 0 N--CA 1.494 1.758 0 O-C-N 121.779 -0.575 . . . . 0.0 111.258 178.988 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 6.4 t30 -161.9 159.25 26.5 Favored 'General case' 0 N--CA 1.499 2.02 0 C-N-CA 118.969 -1.092 . . . . 0.0 111.671 -179.08 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 75.6 t80 -150.13 125.93 10.42 Favored 'General case' 0 N--CA 1.497 1.876 0 N-CA-C 109.089 -0.708 . . . . 0.0 109.089 170.478 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 17.9 t70 -99.64 130.61 45.88 Favored 'General case' 0 N--CA 1.491 1.605 0 N-CA-C 108.981 -0.748 . . . . 0.0 108.981 -177.395 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 34.7 m -69.64 -50.94 39.46 Favored 'General case' 0 N--CA 1.498 1.944 0 C-N-CA 120.01 -0.676 . . . . 0.0 110.534 -176.349 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 5.4 t -59.58 -42.74 93.21 Favored 'General case' 0 N--CA 1.502 2.138 0 O-C-N 121.477 -0.764 . . . . 0.0 110.791 -174.818 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 28.6 m120 -103.27 -10.06 19.03 Favored 'General case' 0 N--CA 1.497 1.893 0 O-C-N 121.573 -0.705 . . . . 0.0 111.446 -177.416 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 1.8 m 49.72 67.29 0.92 Allowed 'General case' 0 N--CA 1.507 2.407 0 O-C-N 121.054 -1.029 . . . . 0.0 111.08 -175.202 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 47.6 mm -124.91 126.19 70.9 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.092 0 O-C-N 121.595 -0.691 . . . . 0.0 109.438 -175.899 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 11.5 tp -115.86 121.07 41.28 Favored 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.596 -0.69 . . . . 0.0 110.622 -169.897 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 58.1 mt-30 -91.78 133.83 35.28 Favored 'General case' 0 N--CA 1.491 1.618 0 N-CA-C 109.435 -0.58 . . . . 0.0 109.435 173.49 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 90.5 mt -117.96 123.8 46.66 Favored 'General case' 0 N--CA 1.497 1.884 0 O-C-N 121.801 -0.562 . . . . 0.0 109.921 174.963 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 64.9 ttt180 -96.07 105.06 17.05 Favored 'General case' 0 N--CA 1.497 1.877 0 O-C-N 121.682 -0.636 . . . . 0.0 109.777 175.99 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 20.1 tp -85.0 155.31 21.62 Favored 'General case' 0 N--CA 1.495 1.791 0 O-C-N 121.701 -0.624 . . . . 0.0 110.951 -173.692 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -68.63 -2.99 10.31 Favored 'General case' 0 N--CA 1.503 2.178 0 O-C-N 121.943 -0.473 . . . . 0.0 112.203 -169.494 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 43.3 p-10 -86.91 25.78 1.25 Allowed 'General case' 0 N--CA 1.499 1.994 0 O-C-N 121.004 -1.06 . . . . 0.0 110.853 173.637 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 7.8 t70 61.74 28.07 17.25 Favored 'General case' 0 N--CA 1.504 2.267 0 O-C-N 121.115 -0.991 . . . . 0.0 110.484 178.717 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 36.7 m -120.54 137.93 54.13 Favored 'General case' 0 N--CA 1.496 1.87 0 O-C-N 121.396 -0.815 . . . . 0.0 110.431 -179.893 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 8.7 t -97.86 151.01 20.67 Favored 'General case' 0 N--CA 1.496 1.864 0 O-C-N 121.719 -0.613 . . . . 0.0 110.172 175.98 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 70.3 tttt -149.44 119.13 7.0 Favored 'General case' 0 N--CA 1.496 1.847 0 O-C-N 121.612 -0.68 . . . . 0.0 110.27 178.762 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 88.4 p -95.71 122.8 38.88 Favored 'General case' 0 N--CA 1.495 1.801 0 O-C-N 121.713 -0.617 . . . . 0.0 110.208 179.057 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 81.7 mt -129.39 136.48 59.27 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.813 0 O-C-N 121.584 -0.697 . . . . 0.0 109.385 179.64 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 57.8 t -81.8 127.53 39.52 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.896 0 N-CA-C 109.1 -0.704 . . . . 0.0 109.1 178.276 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 42.2 p -59.49 -25.74 64.7 Favored 'General case' 0 N--CA 1.504 2.229 0 O-C-N 121.558 -0.714 . . . . 0.0 112.071 -169.029 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 19.2 tptm -57.93 -23.39 53.3 Favored 'General case' 0 N--CA 1.502 2.154 0 O-C-N 121.512 -0.742 . . . . 0.0 111.346 -174.95 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 9.8 p30 -80.95 -4.32 54.61 Favored 'General case' 0 N--CA 1.499 2.02 0 C-N-CA 119.734 -0.786 . . . . 0.0 110.993 176.135 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 85.5 mt -80.57 135.58 24.98 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.056 0 O-C-N 121.209 -0.932 . . . . 0.0 110.127 178.329 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 62.0 tttt -91.32 -30.66 16.45 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.84 -0.537 . . . . 0.0 109.62 169.567 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -165.31 159.97 17.78 Favored 'General case' 0 N--CA 1.502 2.156 0 O-C-N 121.833 -0.542 . . . . 0.0 110.505 -176.53 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 4.4 mp -132.96 157.37 45.34 Favored 'General case' 0 N--CA 1.496 1.845 0 O-C-N 121.726 -0.609 . . . . 0.0 110.227 177.179 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 7.9 ptm180 -150.61 146.58 26.61 Favored 'General case' 0 N--CA 1.495 1.813 0 O-C-N 121.634 -0.666 . . . . 0.0 109.672 174.538 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 55.9 mt -86.04 133.31 29.96 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.876 0 O-C-N 121.508 -0.745 . . . . 0.0 109.952 175.49 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 79.2 mt . . . . . 0 N--CA 1.498 1.942 0 O-C-N 121.589 -0.695 . . . . 0.0 110.076 -178.932 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' B' B ' 257' ' ' SER . . . . . . . . . . . . . 24.2 m . . . . . 0 N--CA 1.503 2.204 0 CA-C-O 121.181 0.515 . . . . 0.0 110.521 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' B' B ' 258' ' ' SER . . . . . . . . . . . . . 22.7 t -69.46 -38.25 77.66 Favored 'General case' 0 N--CA 1.498 1.925 0 C-N-CA 120.481 -0.487 . . . . 0.0 110.317 -179.04 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 259' ' ' GLN . . . . . . . . . . . . . 88.7 mm-40 -64.73 -35.44 81.07 Favored 'General case' 0 N--CA 1.501 2.087 0 O-C-N 121.6 -0.687 . . . . 0.0 110.407 -179.748 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 260' ' ' LEU . . . . . . . . . . . . . 83.6 mt -67.56 -38.62 84.38 Favored 'General case' 0 N--CA 1.498 1.971 0 O-C-N 121.639 -0.663 . . . . 0.0 110.27 179.269 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 261' ' ' LEU . . . . . . . . . . . . . 47.9 tp -67.99 -39.89 83.19 Favored 'General case' 0 N--CA 1.498 1.957 0 O-C-N 121.57 -0.706 . . . . 0.0 109.994 178.668 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 262' ' ' SER . . . . . . . . . . . . . 21.0 m -63.18 -40.65 98.14 Favored 'General case' 0 N--CA 1.5 2.072 0 O-C-N 121.695 -0.628 . . . . 0.0 110.488 177.323 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 263' ' ' LEU . . . . . . . . . . . . . 51.5 mt . . . . . 0 N--CA 1.501 2.083 0 O-C-N 121.715 -0.615 . . . . 0.0 110.23 179.327 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 70.5 m . . . . . 0 N--CA 1.494 1.768 0 CA-C-O 120.945 0.402 . . . . 0.0 110.067 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 51.0 t -64.7 -28.33 44.56 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.207 0 O-C-N 121.625 -0.672 . . . . 0.0 110.245 -179.283 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -56.09 -32.55 64.26 Favored 'General case' 0 N--CA 1.503 2.215 0 O-C-N 121.479 -0.763 . . . . 0.0 110.35 179.609 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 9.7 m-20 -68.8 -35.63 77.25 Favored 'General case' 0 N--CA 1.498 1.958 0 O-C-N 121.862 -0.524 . . . . 0.0 109.932 175.725 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 97.0 m-85 -97.94 10.08 41.17 Favored 'General case' 0 N--CA 1.497 1.891 0 O-C-N 121.723 -0.611 . . . . 0.0 111.24 178.904 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -67.51 128.2 35.56 Favored 'General case' 0 N--CA 1.5 2.047 0 O-C-N 121.294 -0.879 . . . . 0.0 109.927 179.134 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 82.27 -0.33 88.99 Favored Glycine 0 N--CA 1.496 2.694 0 N-CA-C 110.616 -0.994 . . . . 0.0 110.616 -174.976 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 32.0 t -77.17 137.69 39.03 Favored 'General case' 0 N--CA 1.498 1.93 0 O-C-N 121.144 -1.21 . . . . 0.0 110.432 177.599 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 14.6 t-20 -83.96 119.23 24.65 Favored 'General case' 0 N--CA 1.498 1.953 0 O-C-N 121.671 -0.643 . . . . 0.0 109.782 174.642 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 34.6 m -143.01 161.83 17.54 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.811 0 N-CA-C 109.567 -0.531 . . . . 0.0 109.567 -179.854 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 12' ' ' GLU . . . . . 0.416 ' HA ' ' HA ' ' A' ' 22' ' ' ARG . 35.4 tt0 -109.41 129.59 55.54 Favored 'General case' 0 N--CA 1.493 1.685 0 C-N-CA 119.87 -0.732 . . . . 0.0 110.126 178.448 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 58.9 t -106.74 127.65 62.08 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.772 0 O-C-N 121.68 -0.638 . . . . 0.0 109.827 -179.402 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 28.5 tp -95.86 126.05 40.85 Favored 'General case' 0 N--CA 1.494 1.746 0 N-CA-C 109.077 -0.712 . . . . 0.0 109.077 174.485 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 86.7 mt -96.01 166.93 11.53 Favored 'General case' 0 N--CA 1.495 1.794 0 C-N-CA 120.087 -0.645 . . . . 0.0 111.166 -172.496 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 24.1 p30 -58.4 -21.82 51.82 Favored 'General case' 0 N--CA 1.505 2.323 0 O-C-N 121.82 -0.55 . . . . 0.0 111.668 -177.029 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 42.5 p-10 -92.73 23.45 4.11 Favored 'General case' 0 N--CA 1.498 1.966 0 O-C-N 121.576 -0.703 . . . . 0.0 110.811 -176.041 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 74.4 m-20 58.85 27.29 15.93 Favored 'General case' 0 N--CA 1.507 2.379 0 O-C-N 121.558 -0.714 . . . . 0.0 110.608 175.805 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 50.5 m -106.96 145.44 32.25 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.526 -0.734 . . . . 0.0 109.575 172.831 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 98.1 mttt -109.61 147.72 32.55 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.59 -0.694 . . . . 0.0 110.571 -176.345 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -153.08 153.97 33.91 Favored 'General case' 0 N--CA 1.497 1.911 0 O-C-N 121.796 -0.565 . . . . 0.0 110.254 176.204 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . 0.416 ' HA ' ' HA ' ' A' ' 12' ' ' GLU . 33.0 ptt180 -142.69 150.35 40.04 Favored 'General case' 0 N--CA 1.496 1.842 0 O-C-N 121.648 -0.658 . . . . 0.0 110.308 178.364 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -171.9 171.17 43.98 Favored Glycine 0 N--CA 1.492 2.429 0 N-CA-C 109.167 -1.573 . . . . 0.0 109.167 -179.871 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 45.2 t -94.61 126.65 46.99 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.88 0 O-C-N 121.7 -0.882 . . . . 0.0 109.237 176.363 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 47.7 mt -61.73 138.0 22.94 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.249 0 O-C-N 121.57 -0.706 . . . . 0.0 110.854 -170.373 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 13.2 p -121.24 -19.65 7.0 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.9 -0.5 . . . . 0.0 111.515 -179.937 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 33.0 t30 -165.98 158.18 14.47 Favored 'General case' 0 N--CA 1.504 2.25 0 O-C-N 120.826 -1.172 . . . . 0.0 111.922 176.221 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 65.0 t80 -150.3 120.7 7.37 Favored 'General case' 0 N--CA 1.495 1.818 0 N-CA-C 109.166 -0.679 . . . . 0.0 109.166 173.431 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 17.9 t70 -97.81 127.42 43.75 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.593 -0.692 . . . . 0.0 109.212 -177.713 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 22.1 m -66.41 -46.53 76.24 Favored 'General case' 0 N--CA 1.499 2.0 0 O-C-N 121.524 -0.735 . . . . 0.0 110.772 -175.174 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 21.1 m -58.92 -47.36 85.3 Favored 'General case' 0 N--CA 1.502 2.174 0 O-C-N 121.602 -0.686 . . . . 0.0 110.957 -173.796 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 92.4 m-20 -106.29 -3.22 21.45 Favored 'General case' 0 N--CA 1.497 1.889 0 O-C-N 121.536 -0.727 . . . . 0.0 111.711 -178.188 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 15.3 m 49.14 67.15 0.92 Allowed 'General case' 0 N--CA 1.507 2.419 0 O-C-N 121.049 -1.032 . . . . 0.0 110.907 -174.314 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 43.7 mm -114.64 125.78 72.04 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.936 0 O-C-N 121.545 -0.722 . . . . 0.0 109.21 -175.55 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 14.5 tp -115.98 119.03 34.6 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.609 -0.682 . . . . 0.0 110.47 -169.858 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 55.4 mt-30 -91.04 131.94 36.32 Favored 'General case' 0 N--CA 1.491 1.593 0 N-CA-C 109.182 -0.673 . . . . 0.0 109.182 170.838 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 49.4 mt -117.73 123.49 46.17 Favored 'General case' 0 N--CA 1.493 1.707 0 C-N-CA 120.177 -0.609 . . . . 0.0 110.041 175.926 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 57.2 ttt85 -105.0 104.95 14.78 Favored 'General case' 0 N--CA 1.495 1.782 0 O-C-N 121.77 -0.582 . . . . 0.0 110.076 173.877 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 65.3 tp -83.29 157.23 22.71 Favored 'General case' 0 N--CA 1.497 1.923 0 O-C-N 121.626 -0.671 . . . . 0.0 110.669 -176.344 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -67.89 -2.94 8.28 Favored 'General case' 0 N--CA 1.503 2.193 0 O-C-N 121.823 -0.548 . . . . 0.0 112.208 -170.819 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 29.9 m120 -86.63 29.21 0.8 Allowed 'General case' 0 N--CA 1.498 1.971 0 O-C-N 121.05 -1.031 . . . . 0.0 110.789 173.591 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 73.7 m-20 60.33 31.47 20.42 Favored 'General case' 0 N--CA 1.506 2.334 0 O-C-N 121.164 -0.96 . . . . 0.0 110.258 175.699 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 68.1 m -126.05 144.72 50.61 Favored 'General case' 0 N--CA 1.494 1.755 0 O-C-N 121.477 -0.765 . . . . 0.0 110.112 177.873 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 9.8 t -128.17 147.82 50.58 Favored 'General case' 0 N--CA 1.496 1.828 0 O-C-N 121.653 -0.654 . . . . 0.0 109.919 179.604 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 6.0 ttpm? -150.38 130.04 13.15 Favored 'General case' 0 N--CA 1.495 1.82 0 O-C-N 121.716 -0.615 . . . . 0.0 110.505 -177.369 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 88.5 p -95.89 123.47 39.49 Favored 'General case' 0 N--CA 1.494 1.77 0 O-C-N 121.683 -0.635 . . . . 0.0 110.396 179.748 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 80.6 mt -129.31 138.25 54.86 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.889 0 N-CA-C 109.19 -0.67 . . . . 0.0 109.19 177.647 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 67.9 t -82.05 127.65 39.43 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.876 0 O-C-N 121.6 -0.687 . . . . 0.0 109.183 177.766 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 47.3 p -58.13 -24.92 60.59 Favored 'General case' 0 N--CA 1.505 2.283 0 O-C-N 121.539 -0.726 . . . . 0.0 111.964 -169.142 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 31.5 tttp -56.92 -26.87 60.17 Favored 'General case' 0 N--CA 1.502 2.131 0 O-C-N 121.529 -0.732 . . . . 0.0 110.963 -177.08 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 4.7 p30 -85.21 7.37 22.23 Favored 'General case' 0 N--CA 1.499 1.99 0 C-N-CA 119.677 -0.809 . . . . 0.0 111.353 176.538 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 98.2 mt -75.04 125.59 34.78 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.111 0 O-C-N 121.119 -0.988 . . . . 0.0 109.878 175.186 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 50.4 tttm -92.16 -31.34 15.52 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.812 -0.555 . . . . 0.0 109.718 170.68 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -161.11 153.38 20.17 Favored 'General case' 0 N--CA 1.499 1.991 0 O-C-N 121.699 -0.626 . . . . 0.0 110.072 -176.418 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 85.2 mt -132.92 149.92 52.2 Favored 'General case' 0 N--CA 1.497 1.925 0 O-C-N 121.745 -0.597 . . . . 0.0 110.523 -179.311 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 4.9 ptm180 -152.27 140.86 20.79 Favored 'General case' 0 N--CA 1.496 1.869 0 O-C-N 121.783 -0.573 . . . . 0.0 109.856 175.118 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 59.3 mt -85.28 133.3 29.73 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.863 0 O-C-N 121.428 -0.795 . . . . 0.0 109.856 174.667 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 83.1 mt . . . . . 0 N--CA 1.498 1.942 0 O-C-N 121.631 -0.668 . . . . 0.0 110.051 -179.09 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' B' B ' 257' ' ' SER . . . . . . . . . . . . . 49.0 m . . . . . 0 N--CA 1.503 2.21 0 CA-C-O 121.3 0.572 . . . . 0.0 110.482 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' B' B ' 258' ' ' SER . . . . . . . . . . . . . 25.1 m -69.29 -31.79 70.52 Favored 'General case' 0 N--CA 1.497 1.892 0 O-C-N 121.864 -0.523 . . . . 0.0 110.351 -179.937 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 259' ' ' GLN . . . . . . . . . . . . . 58.2 tp60 -62.65 -40.04 95.78 Favored 'General case' 0 N--CA 1.501 2.1 0 O-C-N 121.601 -0.687 . . . . 0.0 110.494 -178.665 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 260' ' ' LEU . . . . . . . . . . . . . 82.8 mt -68.83 -43.04 76.36 Favored 'General case' 0 N--CA 1.499 1.996 0 O-C-N 121.691 -0.631 . . . . 0.0 110.293 179.958 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 261' ' ' LEU . . . . . . . . . . . . . 17.6 tp -69.24 -36.22 76.94 Favored 'General case' 0 N--CA 1.498 1.941 0 O-C-N 121.586 -0.696 . . . . 0.0 109.768 177.87 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 262' ' ' SER . . . . . . . . . . . . . 22.7 t -62.33 -37.33 85.22 Favored 'General case' 0 N--CA 1.501 2.105 0 O-C-N 121.762 -0.586 . . . . 0.0 110.424 176.864 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 263' ' ' LEU . . . . . . . . . . . . . 33.0 mt . . . . . 0 N--CA 1.5 2.068 0 O-C-N 121.726 -0.609 . . . . 0.0 110.31 179.552 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 73.1 m . . . . . 0 N--CA 1.494 1.751 0 CA-C-O 121.036 0.446 . . . . 0.0 110.285 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 83.2 t -67.74 -27.64 38.78 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.095 0 O-C-N 121.754 -0.591 . . . . 0.0 110.251 -179.407 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -54.99 -30.33 59.12 Favored 'General case' 0 N--CA 1.505 2.281 0 O-C-N 121.446 -0.783 . . . . 0.0 110.533 -178.196 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 74.5 m-20 -68.74 -30.69 69.36 Favored 'General case' 0 N--CA 1.499 1.998 0 O-C-N 121.82 -0.55 . . . . 0.0 110.298 174.859 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 96.0 m-85 -95.59 10.03 38.14 Favored 'General case' 0 N--CA 1.497 1.903 0 O-C-N 121.538 -0.726 . . . . 0.0 111.485 -178.24 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 3.6 m-30 -67.3 138.6 56.95 Favored 'General case' 0 N--CA 1.501 2.095 0 O-C-N 121.154 -0.966 . . . . 0.0 110.166 174.27 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 83.3 -2.27 87.35 Favored Glycine 0 N--CA 1.498 2.8 0 N-CA-C 110.757 -0.937 . . . . 0.0 110.757 -177.289 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 27.7 t -76.24 138.2 40.44 Favored 'General case' 0 N--CA 1.497 1.878 0 O-C-N 121.117 -1.225 . . . . 0.0 110.446 179.581 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 2.5 m120 -83.4 118.37 23.67 Favored 'General case' 0 N--CA 1.498 1.937 0 O-C-N 121.629 -0.669 . . . . 0.0 109.411 173.882 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 35.2 m -143.21 161.0 17.42 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.836 0 O-C-N 121.812 -0.555 . . . . 0.0 109.638 -178.361 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 12' ' ' GLU . . . . . 0.4 ' HA ' ' HA ' ' A' ' 22' ' ' ARG . 40.6 tt0 -109.48 126.02 53.08 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.481 -0.762 . . . . 0.0 110.111 178.075 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 60.0 t -106.81 124.4 62.44 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.782 0 O-C-N 121.663 -0.648 . . . . 0.0 110.005 -178.521 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 21.9 tp -95.96 129.27 43.26 Favored 'General case' 0 N--CA 1.494 1.758 0 O-C-N 121.697 -0.627 . . . . 0.0 109.495 174.073 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 85.9 mt -98.86 167.24 10.88 Favored 'General case' 0 N--CA 1.495 1.803 0 O-C-N 121.607 -0.683 . . . . 0.0 111.052 -172.75 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 9.6 p30 -57.95 -22.35 48.63 Favored 'General case' 0 N--CA 1.505 2.313 0 O-C-N 121.832 -0.543 . . . . 0.0 111.555 -177.412 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 43.5 p-10 -92.46 23.28 4.05 Favored 'General case' 0 N--CA 1.498 1.97 0 O-C-N 121.428 -0.795 . . . . 0.0 110.847 -176.823 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 58.77 27.83 16.52 Favored 'General case' 0 N--CA 1.505 2.279 0 O-C-N 121.498 -0.751 . . . . 0.0 110.714 175.194 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 50.8 m -105.54 133.98 49.4 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.531 -0.731 . . . . 0.0 109.542 171.754 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 33.0 ttmt -109.81 141.86 41.88 Favored 'General case' 0 N--CA 1.495 1.799 0 O-C-N 121.714 -0.616 . . . . 0.0 110.46 -176.044 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -153.12 156.09 37.99 Favored 'General case' 0 N--CA 1.496 1.836 0 O-C-N 121.625 -0.672 . . . . 0.0 110.267 178.941 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . 0.4 ' HA ' ' HA ' ' A' ' 12' ' ' GLU . 31.1 ptt180 -140.55 146.58 38.25 Favored 'General case' 0 N--CA 1.497 1.9 0 O-C-N 121.623 -0.673 . . . . 0.0 110.558 179.832 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -171.73 171.48 44.11 Favored Glycine 0 N--CA 1.495 2.589 0 N-CA-C 108.829 -1.709 . . . . 0.0 108.829 -175.132 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 39.8 t -94.56 120.54 44.13 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.874 0 O-C-N 121.419 -1.048 . . . . 0.0 109.309 -175.904 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 75.2 mt -64.31 141.98 17.47 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.102 0 O-C-N 121.545 -0.722 . . . . 0.0 110.402 -172.093 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 5.7 p -121.26 -26.44 5.06 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.653 -0.654 . . . . 0.0 111.345 -179.949 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 2.1 t-20 -162.09 160.41 27.34 Favored 'General case' 0 N--CA 1.5 2.053 0 C-N-CA 118.877 -1.129 . . . . 0.0 111.872 -179.244 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 85.0 t80 -150.01 126.57 10.9 Favored 'General case' 0 N--CA 1.497 1.904 0 N-CA-C 109.116 -0.698 . . . . 0.0 109.116 169.436 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 26.7 t0 -99.77 130.4 45.97 Favored 'General case' 0 N--CA 1.491 1.599 0 N-CA-C 109.064 -0.717 . . . . 0.0 109.064 -177.019 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 22.8 t -68.85 -50.15 52.39 Favored 'General case' 0 N--CA 1.498 1.962 0 C-N-CA 120.037 -0.665 . . . . 0.0 110.597 -176.662 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 19.8 m -59.7 -42.55 93.26 Favored 'General case' 0 N--CA 1.502 2.146 0 O-C-N 121.614 -0.679 . . . . 0.0 110.915 -174.366 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 91.4 m-20 -103.97 -10.08 18.38 Favored 'General case' 0 N--CA 1.497 1.921 0 O-C-N 121.565 -0.709 . . . . 0.0 111.66 -178.136 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 3.0 m 50.09 67.21 0.95 Allowed 'General case' 0 N--CA 1.508 2.443 0 O-C-N 121.0 -1.062 . . . . 0.0 110.943 -174.345 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 47.4 mm -124.72 126.95 72.36 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.072 0 O-C-N 121.541 -0.724 . . . . 0.0 109.469 -175.711 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 11.7 tp -115.78 120.57 39.73 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.675 -0.641 . . . . 0.0 110.501 -169.851 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 99.1 mt-30 -91.06 134.66 34.33 Favored 'General case' 0 N--CA 1.491 1.607 0 N-CA-C 109.39 -0.596 . . . . 0.0 109.39 174.24 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 88.8 mt -117.87 123.8 46.75 Favored 'General case' 0 N--CA 1.497 1.915 0 O-C-N 121.772 -0.58 . . . . 0.0 109.896 173.527 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 73.3 ttt-85 -97.11 109.09 21.91 Favored 'General case' 0 N--CA 1.497 1.877 0 O-C-N 121.699 -0.626 . . . . 0.0 109.8 175.863 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 17.6 tp -85.07 150.63 24.73 Favored 'General case' 0 N--CA 1.494 1.774 0 O-C-N 121.706 -0.621 . . . . 0.0 110.928 -173.91 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -62.3 -10.39 10.86 Favored 'General case' 0 N--CA 1.504 2.233 0 O-C-N 121.907 -0.495 . . . . 0.0 111.892 -173.059 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 39.7 t30 -85.16 29.14 0.67 Allowed 'General case' 0 N--CA 1.499 2.008 0 O-C-N 121.151 -0.968 . . . . 0.0 110.94 174.651 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 74.3 m-20 59.68 31.69 21.03 Favored 'General case' 0 N--CA 1.505 2.307 0 O-C-N 121.213 -0.929 . . . . 0.0 110.424 174.031 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 52.2 m -123.3 137.91 54.74 Favored 'General case' 0 N--CA 1.495 1.797 0 O-C-N 121.413 -0.805 . . . . 0.0 110.348 178.609 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 8.9 t -98.06 149.5 22.42 Favored 'General case' 0 N--CA 1.497 1.902 0 O-C-N 121.694 -0.629 . . . . 0.0 110.274 176.937 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 78.0 tttt -149.72 119.16 6.89 Favored 'General case' 0 N--CA 1.495 1.805 0 O-C-N 121.577 -0.702 . . . . 0.0 110.33 177.897 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 88.7 p -95.52 123.98 39.33 Favored 'General case' 0 N--CA 1.494 1.767 0 O-C-N 121.673 -0.642 . . . . 0.0 110.24 179.009 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 81.4 mt -129.35 135.3 62.05 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.838 0 O-C-N 121.621 -0.674 . . . . 0.0 109.311 179.555 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 59.7 t -82.21 127.59 39.49 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.883 0 O-C-N 121.581 -0.699 . . . . 0.0 109.265 179.122 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 37.7 p -59.21 -24.95 63.57 Favored 'General case' 0 N--CA 1.504 2.25 0 O-C-N 121.611 -0.681 . . . . 0.0 112.06 -169.721 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 57.9 mttm -56.55 -22.91 36.5 Favored 'General case' 0 N--CA 1.503 2.213 0 O-C-N 121.466 -0.771 . . . . 0.0 110.991 -176.833 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 51.0 p30 -83.98 1.26 44.49 Favored 'General case' 0 N--CA 1.499 1.995 0 O-C-N 121.406 -0.809 . . . . 0.0 111.288 176.376 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 99.0 mt -75.63 126.66 36.63 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.066 0 O-C-N 121.171 -0.956 . . . . 0.0 110.042 178.883 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 37.6 ttpt -93.08 -29.27 15.88 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.851 -0.53 . . . . 0.0 109.893 170.562 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 5.1 m-20 -164.07 155.86 16.57 Favored 'General case' 0 N--CA 1.5 2.056 0 O-C-N 121.748 -0.595 . . . . 0.0 109.952 -178.251 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 82.7 mt -132.89 149.69 52.23 Favored 'General case' 0 N--CA 1.496 1.849 0 O-C-N 121.645 -0.659 . . . . 0.0 110.62 -178.804 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 9.5 ptp85 -151.43 144.55 24.63 Favored 'General case' 0 N--CA 1.496 1.838 0 O-C-N 121.71 -0.619 . . . . 0.0 110.083 174.438 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 66.6 mt -86.33 133.16 30.43 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.745 0 O-C-N 121.523 -0.736 . . . . 0.0 109.66 171.697 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 61.8 mt . . . . . 0 N--CA 1.497 1.884 0 O-C-N 121.626 -0.671 . . . . 0.0 109.981 -179.781 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' B' B ' 257' ' ' SER . . . . . . . . . . . . . 74.2 m . . . . . 0 N--CA 1.503 2.208 0 CA-C-O 121.259 0.552 . . . . 0.0 110.499 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' B' B ' 258' ' ' SER . . . . . . . . . . . . . 24.9 m -68.16 -33.25 74.11 Favored 'General case' 0 N--CA 1.498 1.949 0 O-C-N 121.914 -0.491 . . . . 0.0 110.248 -179.468 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 259' ' ' GLN . . . . . . . . . . . . . 94.0 mm-40 -63.24 -36.79 84.83 Favored 'General case' 0 N--CA 1.501 2.109 0 O-C-N 121.648 -0.658 . . . . 0.0 110.463 -179.138 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 260' ' ' LEU . . . . . . . . . . . . . 81.9 mt -67.28 -42.43 83.84 Favored 'General case' 0 N--CA 1.499 2.025 0 O-C-N 121.646 -0.659 . . . . 0.0 110.191 178.989 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 261' ' ' LEU . . . . . . . . . . . . . 24.0 tp -69.79 -36.18 75.48 Favored 'General case' 0 N--CA 1.497 1.893 0 O-C-N 121.615 -0.678 . . . . 0.0 109.736 176.407 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 262' ' ' SER . . . . . . . . . . . . . 69.4 m -62.3 -36.34 81.84 Favored 'General case' 0 N--CA 1.5 2.066 0 O-C-N 121.761 -0.587 . . . . 0.0 110.465 177.41 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 263' ' ' LEU . . . . . . . . . . . . . 20.7 mt . . . . . 0 N--CA 1.501 2.076 0 O-C-N 121.679 -0.638 . . . . 0.0 110.116 179.779 . . . . . . . . 0 0 . 1 . 021 nuclear orig core ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 69.1 m . . . . . 0 N--CA 1.495 1.825 0 CA-C-O 121.131 0.491 . . . . 0.0 110.545 . . . . . . . . . 0 0 . 1 . 021 nuclear orig core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 52.2 t -66.13 -27.84 41.97 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.153 0 O-C-N 121.667 -0.645 . . . . 0.0 110.344 -179.059 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -55.43 -31.81 62.19 Favored 'General case' 0 N--CA 1.505 2.29 0 O-C-N 121.538 -0.726 . . . . 0.0 110.371 -178.057 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 73.7 m-20 -68.84 -35.16 76.62 Favored 'General case' 0 N--CA 1.498 1.951 0 O-C-N 121.747 -0.596 . . . . 0.0 109.912 175.24 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 97.8 m-85 -97.93 10.02 41.31 Favored 'General case' 0 N--CA 1.497 1.9 0 O-C-N 121.751 -0.593 . . . . 0.0 111.284 178.826 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -67.41 129.53 40.19 Favored 'General case' 0 N--CA 1.501 2.114 0 O-C-N 121.208 -0.932 . . . . 0.0 109.975 178.694 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 82.08 0.93 90.14 Favored Glycine 0 N--CA 1.497 2.734 0 N-CA-C 110.647 -0.981 . . . . 0.0 110.647 -175.397 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 57.6 m -76.08 135.24 39.89 Favored 'General case' 0 N--CA 1.498 1.944 0 O-C-N 121.09 -1.241 . . . . 0.0 110.445 178.24 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -84.31 114.25 21.72 Favored 'General case' 0 N--CA 1.498 1.958 0 O-C-N 121.67 -0.644 . . . . 0.0 109.695 174.375 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 35.8 m -140.23 164.04 22.93 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.835 0 O-C-N 121.772 -0.58 . . . . 0.0 109.463 179.992 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 44.1 tt0 -109.36 129.6 55.53 Favored 'General case' 0 N--CA 1.492 1.654 0 C-N-CA 119.782 -0.767 . . . . 0.0 110.02 179.129 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 60.3 t -106.69 127.36 62.24 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.726 0 O-C-N 121.546 -0.721 . . . . 0.0 110.015 -179.042 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 27.1 tp -95.87 125.45 40.44 Favored 'General case' 0 N--CA 1.494 1.769 0 N-CA-C 109.031 -0.729 . . . . 0.0 109.031 173.42 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 87.0 mt -95.51 168.29 10.79 Favored 'General case' 0 N--CA 1.496 1.847 0 O-C-N 121.581 -0.7 . . . . 0.0 111.113 -172.73 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 24.4 p30 -58.02 -21.68 46.21 Favored 'General case' 0 N--CA 1.506 2.339 0 O-C-N 121.856 -0.528 . . . . 0.0 111.632 -176.94 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 46.0 p-10 -91.6 22.51 4.02 Favored 'General case' 0 N--CA 1.499 1.996 0 O-C-N 121.517 -0.739 . . . . 0.0 110.919 -176.641 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 74.4 m-20 58.55 27.37 15.56 Favored 'General case' 0 N--CA 1.506 2.35 0 O-C-N 121.469 -0.769 . . . . 0.0 110.712 175.738 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 49.9 m -108.18 144.39 35.68 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.579 -0.701 . . . . 0.0 109.578 172.887 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 48.2 mttm -109.57 145.47 36.32 Favored 'General case' 0 N--CA 1.495 1.806 0 O-C-N 121.61 -0.681 . . . . 0.0 110.615 -176.512 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -153.07 154.11 34.2 Favored 'General case' 0 N--CA 1.496 1.865 0 O-C-N 121.784 -0.573 . . . . 0.0 109.868 176.272 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 30.4 ptt180 -140.4 151.5 44.99 Favored 'General case' 0 N--CA 1.496 1.841 0 O-C-N 121.635 -0.666 . . . . 0.0 110.529 -179.513 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -171.85 171.09 43.93 Favored Glycine 0 N--CA 1.492 2.419 0 N-CA-C 109.037 -1.625 . . . . 0.0 109.037 -179.846 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 61.3 t -94.63 127.24 46.77 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.845 0 O-C-N 121.651 -0.911 . . . . 0.0 109.163 176.34 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 49.3 mt -61.37 138.4 22.12 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.185 0 O-C-N 121.594 -0.691 . . . . 0.0 110.874 -171.099 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 11.4 p -121.25 -20.59 6.66 Favored 'General case' 0 N--CA 1.493 1.717 0 O-C-N 121.876 -0.515 . . . . 0.0 111.49 -179.548 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 6.7 t30 -165.48 158.57 15.99 Favored 'General case' 0 N--CA 1.505 2.311 0 O-C-N 120.945 -1.097 . . . . 0.0 111.871 177.093 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 65.1 t80 -150.41 119.95 6.95 Favored 'General case' 0 N--CA 1.497 1.901 0 N-CA-C 109.226 -0.657 . . . . 0.0 109.226 173.766 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 17.9 t70 -97.14 127.2 42.88 Favored 'General case' 0 N--CA 1.494 1.757 0 O-C-N 121.641 -0.662 . . . . 0.0 109.293 -177.113 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 22.7 t -65.85 -46.34 78.82 Favored 'General case' 0 N--CA 1.5 2.042 0 O-C-N 121.557 -0.715 . . . . 0.0 110.865 -175.11 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 21.4 t -58.61 -48.06 82.25 Favored 'General case' 0 N--CA 1.502 2.13 0 O-C-N 121.505 -0.747 . . . . 0.0 111.0 -173.575 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 92.4 m-20 -107.02 -1.87 21.69 Favored 'General case' 0 N--CA 1.498 1.927 0 O-C-N 121.594 -0.691 . . . . 0.0 111.804 -178.316 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 69.1 m 49.18 67.18 0.92 Allowed 'General case' 0 N--CA 1.508 2.438 0 O-C-N 121.082 -1.011 . . . . 0.0 110.901 -174.437 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 44.2 mm -113.82 125.79 71.18 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.971 0 O-C-N 121.544 -0.723 . . . . 0.0 109.136 -175.215 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 10.9 tp -116.0 119.03 34.56 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.613 -0.679 . . . . 0.0 110.451 -169.816 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 78.2 mt-30 -90.98 132.39 36.0 Favored 'General case' 0 N--CA 1.489 1.523 0 N-CA-C 109.191 -0.67 . . . . 0.0 109.191 170.862 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 48.8 mt -117.81 123.47 46.03 Favored 'General case' 0 N--CA 1.493 1.71 0 C-N-CA 120.152 -0.619 . . . . 0.0 109.949 175.218 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 56.5 ttt85 -105.1 105.85 16.08 Favored 'General case' 0 N--CA 1.495 1.786 0 O-C-N 121.78 -0.575 . . . . 0.0 110.091 174.101 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 63.3 tp -83.37 155.04 23.72 Favored 'General case' 0 N--CA 1.498 1.949 0 O-C-N 121.609 -0.682 . . . . 0.0 110.515 -177.054 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -68.82 -2.91 10.61 Favored 'General case' 0 N--CA 1.504 2.243 0 O-C-N 121.885 -0.51 . . . . 0.0 112.131 -170.347 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 30.1 m120 -88.04 28.59 1.03 Allowed 'General case' 0 N--CA 1.497 1.907 0 O-C-N 121.029 -1.045 . . . . 0.0 110.795 174.878 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 13.5 t0 64.9 29.03 12.6 Favored 'General case' 0 N--CA 1.505 2.295 0 O-C-N 121.205 -0.934 . . . . 0.0 110.387 175.755 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 74.5 m -125.01 137.95 54.23 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.432 -0.792 . . . . 0.0 110.137 177.897 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 9.1 t -128.22 149.72 50.34 Favored 'General case' 0 N--CA 1.496 1.843 0 O-C-N 121.711 -0.618 . . . . 0.0 110.018 178.818 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 57.7 tttm -151.15 134.9 16.44 Favored 'General case' 0 N--CA 1.497 1.879 0 O-C-N 121.704 -0.623 . . . . 0.0 110.574 -178.339 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 91.0 p -95.0 120.99 36.15 Favored 'General case' 0 N--CA 1.495 1.796 0 O-C-N 121.727 -0.608 . . . . 0.0 110.215 177.556 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 80.9 mt -129.35 136.05 60.31 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.85 0 O-C-N 121.681 -0.637 . . . . 0.0 109.359 -179.597 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 66.4 t -81.71 127.79 39.28 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.001 0 O-C-N 121.631 -0.668 . . . . 0.0 109.202 179.204 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 51.6 p -57.99 -25.06 60.56 Favored 'General case' 0 N--CA 1.505 2.295 0 O-C-N 121.463 -0.773 . . . . 0.0 111.87 -168.97 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 43.4 tptt -57.19 -26.06 60.02 Favored 'General case' 0 N--CA 1.502 2.134 0 O-C-N 121.507 -0.745 . . . . 0.0 111.066 -176.805 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 5.0 p30 -84.69 5.72 27.08 Favored 'General case' 0 N--CA 1.498 1.95 0 C-N-CA 119.69 -0.804 . . . . 0.0 111.286 176.323 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 96.5 mt -75.77 124.41 33.76 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.144 0 O-C-N 121.146 -0.971 . . . . 0.0 109.837 175.461 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 42.5 tttp -92.36 -28.68 16.76 Favored 'General case' 0 N--CA 1.495 1.803 0 C-N-CA 120.396 -0.521 . . . . 0.0 109.953 171.962 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 5.4 m-20 -163.75 154.57 15.92 Favored 'General case' 0 N--CA 1.501 2.085 0 O-C-N 121.791 -0.568 . . . . 0.0 110.125 -178.461 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 84.4 mt -132.96 150.75 52.14 Favored 'General case' 0 N--CA 1.497 1.887 0 O-C-N 121.669 -0.645 . . . . 0.0 110.487 -179.181 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 19.6 ptp180 -151.59 145.71 25.31 Favored 'General case' 0 N--CA 1.495 1.797 0 O-C-N 121.688 -0.632 . . . . 0.0 110.009 174.824 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 64.8 mt -86.32 133.27 30.16 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.837 0 O-C-N 121.527 -0.733 . . . . 0.0 109.86 173.864 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 61.1 mt . . . . . 0 N--CA 1.497 1.893 0 O-C-N 121.594 -0.692 . . . . 0.0 110.145 -178.903 . . . . . . . . 0 0 . 1 . 021 nuclear orig core ' B' B ' 257' ' ' SER . . . . . . . . . . . . . 34.5 t . . . . . 0 N--CA 1.503 2.204 0 CA-C-O 121.325 0.583 . . . . 0.0 110.396 . . . . . . . . . 0 0 . 1 . 021 nuclear orig core ' B' B ' 258' ' ' SER . . . . . . . . . . . . . 25.3 m -67.99 -31.25 70.82 Favored 'General case' 0 N--CA 1.498 1.934 0 O-C-N 121.888 -0.507 . . . . 0.0 110.25 178.978 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B ' 259' ' ' GLN . . . . . . . . . . . . . 48.7 tt0 -61.47 -37.59 84.17 Favored 'General case' 0 N--CA 1.502 2.134 0 O-C-N 121.635 -0.666 . . . . 0.0 110.381 178.964 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B ' 260' ' ' LEU . . . . . . . . . . . . . 46.0 mt -65.93 -42.36 90.2 Favored 'General case' 0 N--CA 1.5 2.038 0 O-C-N 121.721 -0.612 . . . . 0.0 110.306 178.449 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B ' 261' ' ' LEU . . . . . . . . . . . . . 18.9 tp -69.89 -36.55 75.53 Favored 'General case' 0 N--CA 1.498 1.961 0 O-C-N 121.717 -0.614 . . . . 0.0 109.75 176.83 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B ' 262' ' ' SER . . . . . . . . . . . . . 49.1 m -62.16 -37.0 83.56 Favored 'General case' 0 N--CA 1.501 2.078 0 O-C-N 121.714 -0.616 . . . . 0.0 110.556 176.614 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B ' 263' ' ' LEU . . . . . . . . . . . . . 18.9 mt . . . . . 0 N--CA 1.502 2.133 0 O-C-N 121.698 -0.626 . . . . 0.0 110.186 179.64 . . . . . . . . 0 0 . 1 . 022 nuclear orig core ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 69.7 m . . . . . 0 N--CA 1.496 1.843 0 CA-C-O 121.021 0.439 . . . . 0.0 110.247 . . . . . . . . . 0 0 . 1 . 022 nuclear orig core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 65.6 t -66.4 -27.73 41.31 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.065 0 O-C-N 121.727 -0.608 . . . . 0.0 110.337 -178.887 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -54.98 -30.63 59.62 Favored 'General case' 0 N--CA 1.505 2.303 0 O-C-N 121.487 -0.758 . . . . 0.0 110.439 -178.422 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 9.7 m-20 -68.89 -30.72 69.27 Favored 'General case' 0 N--CA 1.499 1.995 0 O-C-N 121.753 -0.592 . . . . 0.0 110.244 174.981 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 97.4 m-85 -95.56 10.06 37.96 Favored 'General case' 0 N--CA 1.497 1.909 0 O-C-N 121.636 -0.665 . . . . 0.0 111.502 -178.16 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 3.9 m-30 -67.3 139.88 57.29 Favored 'General case' 0 N--CA 1.502 2.135 0 O-C-N 121.171 -0.955 . . . . 0.0 110.077 174.184 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 83.65 -3.14 86.13 Favored Glycine 0 N--CA 1.497 2.746 0 N-CA-C 110.768 -0.933 . . . . 0.0 110.768 -177.089 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 66.2 m -75.27 138.97 42.23 Favored 'General case' 0 N--CA 1.497 1.887 0 O-C-N 121.115 -1.227 . . . . 0.0 110.508 179.685 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 2.4 m120 -84.58 118.8 24.57 Favored 'General case' 0 N--CA 1.498 1.971 0 O-C-N 121.651 -0.656 . . . . 0.0 109.454 174.407 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 35.8 m -143.19 162.3 17.02 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.822 0 O-C-N 121.693 -0.629 . . . . 0.0 109.854 -179.116 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 12' ' ' GLU . . . . . 0.43 ' HA ' ' HA ' ' A' ' 22' ' ' ARG . 47.7 tt0 -109.47 127.22 54.26 Favored 'General case' 0 N--CA 1.493 1.692 0 O-C-N 121.56 -0.713 . . . . 0.0 110.047 176.331 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 58.0 t -106.89 123.52 62.0 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.747 0 O-C-N 121.48 -0.763 . . . . 0.0 109.951 -178.324 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 17.6 tp -96.0 135.1 38.22 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.663 -0.648 . . . . 0.0 109.472 175.737 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 86.2 mt -103.67 169.0 8.78 Favored 'General case' 0 N--CA 1.497 1.908 0 O-C-N 121.61 -0.681 . . . . 0.0 111.22 -172.605 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 24.1 p30 -59.05 -21.73 59.59 Favored 'General case' 0 N--CA 1.507 2.391 0 O-C-N 121.843 -0.535 . . . . 0.0 111.677 -177.507 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 47.7 p-10 -93.45 24.53 3.9 Favored 'General case' 0 N--CA 1.498 1.96 0 O-C-N 121.497 -0.752 . . . . 0.0 110.797 -175.309 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 74.3 m-20 59.31 25.64 14.33 Favored 'General case' 0 N--CA 1.505 2.298 0 O-C-N 121.523 -0.736 . . . . 0.0 110.73 176.834 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 70.7 m -97.67 163.07 12.98 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.631 -0.668 . . . . 0.0 109.274 170.657 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 13.0 ptmt -145.4 138.02 25.98 Favored 'General case' 0 N--CA 1.495 1.818 0 O-C-N 121.59 -0.694 . . . . 0.0 110.46 -176.688 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -153.02 161.62 42.31 Favored 'General case' 0 N--CA 1.496 1.863 0 O-C-N 121.728 -0.607 . . . . 0.0 110.299 179.893 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . 0.43 ' HA ' ' HA ' ' A' ' 12' ' ' GLU . 32.5 ptt180 -142.06 147.15 36.35 Favored 'General case' 0 N--CA 1.496 1.826 0 O-C-N 121.701 -0.624 . . . . 0.0 110.782 -179.751 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -171.73 171.42 44.08 Favored Glycine 0 N--CA 1.494 2.561 0 N-CA-C 108.76 -1.736 . . . . 0.0 108.76 -175.47 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 39.9 t -94.59 120.89 44.65 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.901 0 O-C-N 121.424 -1.045 . . . . 0.0 109.35 -175.451 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 92.6 mt -64.29 143.45 15.69 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.118 0 O-C-N 121.566 -0.709 . . . . 0.0 110.498 -171.899 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 6.3 p -121.23 -28.16 4.75 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.785 -0.572 . . . . 0.0 111.256 179.334 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 27.5 t30 -161.66 160.77 29.07 Favored 'General case' 0 N--CA 1.5 2.065 0 C-N-CA 118.919 -1.112 . . . . 0.0 111.899 -177.881 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 82.0 t80 -150.08 125.81 10.38 Favored 'General case' 0 N--CA 1.499 2.002 0 N-CA-C 109.052 -0.721 . . . . 0.0 109.052 169.724 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 17.8 t70 -99.68 128.56 45.78 Favored 'General case' 0 N--CA 1.492 1.664 0 N-CA-C 109.089 -0.708 . . . . 0.0 109.089 -177.484 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 21.8 m -66.43 -46.37 76.71 Favored 'General case' 0 N--CA 1.499 2.015 0 C-N-CA 120.053 -0.659 . . . . 0.0 110.673 -175.736 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 16.3 t -58.22 -48.06 81.55 Favored 'General case' 0 N--CA 1.503 2.206 0 O-C-N 121.485 -0.76 . . . . 0.0 110.957 -173.971 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 90.4 m-20 -104.59 -5.38 21.51 Favored 'General case' 0 N--CA 1.497 1.895 0 O-C-N 121.614 -0.679 . . . . 0.0 111.643 -178.486 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 71.0 m 49.36 67.25 0.91 Allowed 'General case' 0 N--CA 1.507 2.418 0 O-C-N 121.132 -0.98 . . . . 0.0 110.937 -174.32 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 45.5 mm -120.68 126.41 75.21 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.019 0 O-C-N 121.665 -0.647 . . . . 0.0 109.323 -174.959 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 11.9 tp -115.76 120.38 39.13 Favored 'General case' 0 N--CA 1.494 1.762 0 O-C-N 121.68 -0.637 . . . . 0.0 110.504 -169.065 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 99.0 mt-30 -90.99 134.68 34.29 Favored 'General case' 0 N--CA 1.491 1.593 0 N-CA-C 109.468 -0.568 . . . . 0.0 109.468 174.485 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 90.2 mt -117.82 123.82 46.86 Favored 'General case' 0 N--CA 1.496 1.842 0 O-C-N 121.841 -0.537 . . . . 0.0 109.915 174.342 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 58.0 ttt85 -96.64 108.54 21.17 Favored 'General case' 0 N--CA 1.496 1.83 0 O-C-N 121.669 -0.645 . . . . 0.0 109.829 175.283 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 17.9 tp -84.83 153.37 22.99 Favored 'General case' 0 N--CA 1.494 1.739 0 O-C-N 121.745 -0.597 . . . . 0.0 110.962 -174.155 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -63.57 -9.65 14.4 Favored 'General case' 0 N--CA 1.503 2.183 0 O-C-N 121.985 -0.447 . . . . 0.0 111.928 -171.781 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 30.0 m120 -86.14 27.47 0.91 Allowed 'General case' 0 N--CA 1.498 1.953 0 O-C-N 121.106 -0.996 . . . . 0.0 110.984 175.679 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 15.7 t0 62.89 29.23 16.57 Favored 'General case' 0 N--CA 1.504 2.235 0 O-C-N 120.975 -1.078 . . . . 0.0 110.595 175.481 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 63.8 m -123.14 137.81 54.81 Favored 'General case' 0 N--CA 1.496 1.872 0 O-C-N 121.344 -0.847 . . . . 0.0 110.402 -179.522 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 10.2 t -97.62 151.02 20.51 Favored 'General case' 0 N--CA 1.495 1.82 0 O-C-N 121.735 -0.603 . . . . 0.0 110.281 176.756 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 57.9 tttt -149.24 119.15 7.11 Favored 'General case' 0 N--CA 1.496 1.854 0 O-C-N 121.691 -0.631 . . . . 0.0 110.202 177.812 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 88.1 p -95.21 123.95 38.99 Favored 'General case' 0 N--CA 1.495 1.798 0 O-C-N 121.64 -0.662 . . . . 0.0 110.294 -179.831 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 82.7 mt -129.27 134.83 63.14 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.866 0 O-C-N 121.692 -0.63 . . . . 0.0 109.379 178.889 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 66.6 t -82.71 127.56 39.55 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.889 0 O-C-N 121.622 -0.674 . . . . 0.0 109.306 179.318 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 67.9 p -58.29 -24.93 61.09 Favored 'General case' 0 N--CA 1.507 2.408 0 O-C-N 121.545 -0.722 . . . . 0.0 111.916 -169.793 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 56.3 tttt -56.51 -23.26 38.39 Favored 'General case' 0 N--CA 1.502 2.135 0 O-C-N 121.464 -0.772 . . . . 0.0 111.149 -177.055 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 50.4 p30 -84.0 1.47 43.59 Favored 'General case' 0 N--CA 1.498 1.941 0 O-C-N 121.419 -0.8 . . . . 0.0 111.301 176.677 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 97.8 mt -76.13 127.56 37.44 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.074 0 O-C-N 121.163 -0.961 . . . . 0.0 110.055 179.05 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 45.8 tptt -92.14 -30.86 15.74 Favored 'General case' 0 N--CA 1.495 1.789 0 O-C-N 121.868 -0.52 . . . . 0.0 109.602 169.283 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 5.3 m-20 -163.91 159.37 20.86 Favored 'General case' 0 N--CA 1.499 2.007 0 O-C-N 121.87 -0.519 . . . . 0.0 109.89 -178.56 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 85.5 mt -132.94 149.33 52.25 Favored 'General case' 0 N--CA 1.496 1.868 0 O-C-N 121.699 -0.626 . . . . 0.0 110.342 -179.241 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 6.8 ptm180 -150.71 137.6 19.1 Favored 'General case' 0 N--CA 1.496 1.832 0 O-C-N 121.716 -0.615 . . . . 0.0 109.978 176.462 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 68.6 mt -84.77 133.18 29.89 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.795 0 O-C-N 121.503 -0.748 . . . . 0.0 109.843 175.182 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 56.4 mt . . . . . 0 N--CA 1.496 1.863 0 O-C-N 121.592 -0.693 . . . . 0.0 110.137 179.404 . . . . . . . . 0 0 . 1 . 022 nuclear orig core ' B' B ' 257' ' ' SER . . . . . . . . . . . . . 45.4 m . . . . . 0 N--CA 1.503 2.219 0 CA-C-O 121.223 0.535 . . . . 0.0 110.422 . . . . . . . . . 0 0 . 1 . 022 nuclear orig core ' B' B ' 258' ' ' SER . . . . . . . . . . . . . 25.6 t -69.51 -32.79 71.86 Favored 'General case' 0 N--CA 1.498 1.973 0 C-N-CA 120.365 -0.534 . . . . 0.0 110.274 179.171 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 259' ' ' GLN . . . . . . . . . . . . . 29.2 tt0 -63.27 -38.37 90.88 Favored 'General case' 0 N--CA 1.501 2.1 0 O-C-N 121.629 -0.669 . . . . 0.0 110.472 -179.37 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 260' ' ' LEU . . . . . . . . . . . . . 84.5 mt -67.16 -42.33 84.48 Favored 'General case' 0 N--CA 1.5 2.027 0 O-C-N 121.652 -0.655 . . . . 0.0 110.251 179.872 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 261' ' ' LEU . . . . . . . . . . . . . 21.6 tp -70.01 -36.61 75.24 Favored 'General case' 0 N--CA 1.496 1.873 0 O-C-N 121.668 -0.645 . . . . 0.0 109.757 176.852 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 262' ' ' SER . . . . . . . . . . . . . 22.6 t -62.25 -37.51 85.72 Favored 'General case' 0 N--CA 1.501 2.086 0 O-C-N 121.745 -0.597 . . . . 0.0 110.389 177.036 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 263' ' ' LEU . . . . . . . . . . . . . 28.2 mt . . . . . 0 N--CA 1.501 2.093 0 O-C-N 121.651 -0.655 . . . . 0.0 110.314 179.365 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' -1' ' ' MET . . . . . . . . . . . . . 61.1 mtt . . . . . 0 N--CA 1.493 1.724 0 CA-C-O 121.019 0.437 . . . . 7.1200000000000001 110.16 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 0' ' ' GLY . . . . . . . . . . . . . . . 159.21 127.5 0.92 Allowed Glycine 0 N--CA 1.493 2.486 0 N-CA-C 109.528 -1.429 . . . . 2.8500000000000001 109.528 179.944 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 74.1 mtm -129.59 163.5 25.88 Favored 'General case' 0 N--CA 1.496 1.826 0 O-C-N 121.723 -0.869 . . . . 2.9700000000000002 110.253 -179.571 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 73.0 m -94.8 174.51 7.06 Favored 'General case' 0 N--CA 1.496 1.829 0 O-C-N 121.727 -0.608 . . . . 1.1299999999999999 110.027 179.377 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 66.8 t -66.55 -27.82 41.43 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.13 0 O-C-N 121.675 -0.641 . . . . 1.4299999999999999 110.301 -178.486 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -55.18 -31.16 61.16 Favored 'General case' 0 N--CA 1.504 2.251 0 O-C-N 121.492 -0.755 . . . . 1.1699999999999999 110.504 -178.262 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 9.7 m-20 -69.05 -30.59 68.96 Favored 'General case' 0 N--CA 1.498 1.962 0 O-C-N 121.833 -0.542 . . . . 1.1699999999999999 110.304 174.903 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 95.4 m-85 -95.49 10.01 38.04 Favored 'General case' 0 N--CA 1.497 1.887 0 O-C-N 121.638 -0.664 . . . . 0.73999999999999999 111.537 -177.88 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 3.4 m-30 -67.1 136.1 54.64 Favored 'General case' 0 N--CA 1.502 2.144 0 O-C-N 121.2 -0.938 . . . . 2.6000000000000001 109.966 174.172 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 83.13 -0.9 89.5 Favored Glycine 0 N--CA 1.498 2.794 0 N-CA-C 110.583 -1.007 . . . . 0.26000000000000001 110.583 -175.711 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 27.4 t -77.24 134.77 38.49 Favored 'General case' 0 N--CA 1.498 1.951 0 O-C-N 121.2 -1.176 . . . . 1.6899999999999999 110.451 178.409 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 12.7 t-20 -83.52 120.03 25.43 Favored 'General case' 0 N--CA 1.497 1.896 0 O-C-N 121.623 -0.673 . . . . 2.0899999999999999 109.612 173.227 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 35.9 m -142.73 162.92 17.86 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.714 0 O-C-N 121.79 -0.569 . . . . 1.05 109.718 -178.89 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 49.4 tt0 -109.39 147.31 32.99 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.654 -0.654 . . . . 1.0600000000000001 109.533 177.04 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 57.7 t -136.07 125.16 38.77 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.79 0 O-C-N 121.642 -0.661 . . . . 1.1000000000000001 109.742 -174.259 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 24.1 tp -95.93 127.84 42.3 Favored 'General case' 0 N--CA 1.493 1.701 0 N-CA-C 109.238 -0.653 . . . . 1.1499999999999999 109.238 174.942 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 85.1 mt -92.78 171.83 8.73 Favored 'General case' 0 N--CA 1.496 1.83 0 O-C-N 121.659 -0.651 . . . . 1.1000000000000001 110.887 -173.961 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 24.0 p30 -56.89 -22.39 36.93 Favored 'General case' 0 N--CA 1.505 2.281 0 O-C-N 121.731 -0.606 . . . . 0.40000000000000002 111.518 -177.814 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 53.2 p-10 -92.99 22.92 4.55 Favored 'General case' 0 N--CA 1.498 1.972 0 O-C-N 121.613 -0.679 . . . . 1.0700000000000001 110.835 -178.038 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 74.3 m-20 58.73 27.81 16.44 Favored 'General case' 0 N--CA 1.506 2.334 0 O-C-N 121.446 -0.784 . . . . 1.0 110.647 176.279 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 49.9 m -105.81 146.9 29.28 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.511 -0.743 . . . . 0.89000000000000001 109.697 173.052 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 73.6 mttt -109.55 145.55 36.16 Favored 'General case' 0 N--CA 1.495 1.783 0 O-C-N 121.572 -0.705 . . . . 2.1699999999999999 110.609 -176.64 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -153.07 131.52 12.14 Favored 'General case' 0 N--CA 1.496 1.833 0 O-C-N 121.809 -0.557 . . . . 1.1000000000000001 110.266 176.74 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 16.6 ptp180 -126.17 144.26 50.82 Favored 'General case' 0 N--CA 1.497 1.92 0 O-C-N 121.659 -0.651 . . . . 2.7999999999999998 110.427 -178.133 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -171.77 171.4 44.08 Favored Glycine 0 N--CA 1.496 2.642 0 N-CA-C 109.189 -1.564 . . . . 0.28000000000000003 109.189 -176.101 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 47.2 t -94.67 119.9 43.32 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.958 0 O-C-N 121.593 -0.945 . . . . 1.04 109.375 -176.963 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 90.7 mt -64.21 144.16 14.98 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.139 0 O-C-N 121.658 -0.652 . . . . 1.23 110.531 -171.482 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 19.1 p -121.28 -27.28 4.89 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.823 -0.548 . . . . 1.1000000000000001 111.152 178.128 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 2.1 t-20 -161.37 160.79 29.98 Favored 'General case' 0 N--CA 1.5 2.029 0 C-N-CA 118.97 -1.092 . . . . 1.74 111.823 -178.921 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 84.1 t80 -150.11 126.97 11.07 Favored 'General case' 0 N--CA 1.498 1.954 0 N-CA-C 109.138 -0.689 . . . . 0.81999999999999995 109.138 170.234 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 17.9 t70 -99.7 129.16 45.8 Favored 'General case' 0 N--CA 1.491 1.619 0 N-CA-C 109.121 -0.696 . . . . 1.1499999999999999 109.121 -178.263 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 22.8 m -67.41 -47.67 69.58 Favored 'General case' 0 N--CA 1.498 1.949 0 O-C-N 121.647 -0.658 . . . . 1.6599999999999999 110.714 -175.609 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 22.1 m -59.47 -45.23 92.23 Favored 'General case' 0 N--CA 1.503 2.206 0 O-C-N 121.596 -0.69 . . . . 1.3300000000000001 110.892 -173.878 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 91.3 m-20 -104.69 -7.09 19.83 Favored 'General case' 0 N--CA 1.497 1.891 0 O-C-N 121.645 -0.659 . . . . 1.74 111.608 -178.386 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 16.7 m 49.64 67.23 0.93 Allowed 'General case' 0 N--CA 1.507 2.422 0 O-C-N 121.058 -1.026 . . . . 1.48 110.857 -174.378 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 45.5 mm -121.4 125.98 74.34 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.993 0 O-C-N 121.545 -0.722 . . . . 1.0600000000000001 109.333 -175.224 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 11.5 tp -115.87 120.76 40.27 Favored 'General case' 0 N--CA 1.494 1.748 0 O-C-N 121.735 -0.603 . . . . 1.0800000000000001 110.559 -168.865 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 98.8 mt-30 -91.03 132.8 35.79 Favored 'General case' 0 N--CA 1.49 1.563 0 N-CA-C 109.494 -0.558 . . . . 1.4099999999999999 109.494 173.87 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 16.3 mt -117.86 123.82 46.82 Favored 'General case' 0 N--CA 1.495 1.819 0 O-C-N 121.824 -0.547 . . . . 1.28 109.992 176.408 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 26.4 mtp85 -96.79 107.09 19.51 Favored 'General case' 0 N--CA 1.496 1.87 0 O-C-N 121.651 -0.656 . . . . 3.5699999999999998 109.935 175.545 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 17.2 tp -84.53 152.08 24.15 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.684 -0.635 . . . . 1.4099999999999999 110.911 -174.618 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -66.37 -5.83 12.18 Favored 'General case' 0 N--CA 1.502 2.143 0 O-C-N 121.946 -0.471 . . . . 1.1599999999999999 112.006 -172.251 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 91.1 m-20 -86.61 27.91 0.92 Allowed 'General case' 0 N--CA 1.498 1.946 0 O-C-N 121.107 -0.995 . . . . 3.02 110.925 174.504 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 8.0 t70 62.96 29.46 16.47 Favored 'General case' 0 N--CA 1.504 2.251 0 O-C-N 121.099 -1.0 . . . . 2.02 110.524 175.687 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 49.9 m -124.51 137.91 54.38 Favored 'General case' 0 N--CA 1.495 1.808 0 O-C-N 121.316 -0.865 . . . . 1.4199999999999999 110.554 -179.597 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 8.6 t -97.97 151.0 20.75 Favored 'General case' 0 N--CA 1.497 1.876 0 O-C-N 121.75 -0.593 . . . . 1.3 110.116 175.265 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 37.9 ttmt -150.49 119.13 6.52 Favored 'General case' 0 N--CA 1.495 1.791 0 O-C-N 121.521 -0.737 . . . . 2.4300000000000002 110.393 179.023 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 88.8 p -95.12 122.87 38.24 Favored 'General case' 0 N--CA 1.496 1.834 0 O-C-N 121.687 -0.633 . . . . 0.89000000000000001 110.27 179.356 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 82.0 mt -129.36 136.36 59.58 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.866 0 O-C-N 121.654 -0.654 . . . . 1.1499999999999999 109.301 179.427 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 66.9 t -81.88 127.63 39.43 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.914 0 O-C-N 121.565 -0.709 . . . . 1.1000000000000001 109.165 179.068 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 34.6 p -59.53 -24.86 64.04 Favored 'General case' 0 N--CA 1.504 2.266 0 O-C-N 121.56 -0.713 . . . . 1.0700000000000001 111.998 -170.606 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 77.1 tttt -56.55 -25.49 52.29 Favored 'General case' 0 N--CA 1.502 2.173 0 O-C-N 121.45 -0.781 . . . . 3.7000000000000002 110.943 -176.558 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 7.3 p30 -84.09 4.63 29.34 Favored 'General case' 0 N--CA 1.499 2.007 0 C-N-CA 119.714 -0.794 . . . . 0.54000000000000004 111.364 176.517 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 98.2 mt -75.8 126.46 36.56 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.137 0 O-C-N 121.07 -1.019 . . . . 1.1899999999999999 109.872 175.933 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 47.3 tptt -91.44 -29.95 16.76 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.833 -0.542 . . . . 2.4300000000000002 109.903 170.579 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 5.3 m-20 -164.29 157.01 17.24 Favored 'General case' 0 N--CA 1.5 2.06 0 O-C-N 121.795 -0.566 . . . . 0.85999999999999999 110.026 -178.136 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 84.1 mt -132.97 150.74 52.14 Favored 'General case' 0 N--CA 1.497 1.92 0 O-C-N 121.756 -0.59 . . . . 1.28 110.581 -178.65 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 9.2 ptp85 -152.79 142.33 21.78 Favored 'General case' 0 N--CA 1.497 1.884 0 O-C-N 121.729 -0.607 . . . . 2.4300000000000002 109.973 175.349 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 68.8 mt -86.42 133.25 30.24 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.928 0 O-C-N 121.501 -0.75 . . . . 1.1399999999999999 110.094 175.14 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 59.6 mt -83.56 161.7 55.62 Favored Pre-proline 0 N--CA 1.499 1.981 0 O-C-N 121.634 -0.666 . . . . 1.1499999999999999 110.029 -179.557 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 23.7 Cg_endo -66.04 152.19 81.94 Favored 'Trans proline' 0 N--CA 1.489 1.226 0 O-C-N 123.648 1.341 . . . . 1.4199999999999999 110.373 178.093 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 49.1 tttm -79.49 125.43 29.56 Favored 'General case' 0 N--CA 1.497 1.899 0 O-C-N 121.644 -0.66 . . . . 5.8899999999999997 110.238 -178.979 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 8.9 t-20 58.05 166.03 0.04 OUTLIER 'General case' 0 N--CA 1.507 2.396 0 O-C-N 121.633 -0.667 . . . . 6.0099999999999998 110.922 -179.03 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 75.9 mm-40 51.82 30.6 7.19 Favored 'General case' 0 N--CA 1.505 2.322 0 O-C-N 121.503 -0.748 . . . . 7.3799999999999999 111.168 -179.838 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 85.6 mt -68.05 -53.11 32.16 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.155 0 O-C-N 121.658 -0.651 . . . . 9.0999999999999996 109.73 -179.354 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 64' ' ' MET . . . . . . . . . . . . . 10.3 mtt -80.11 -56.81 0.7 Allowed Pre-proline 0 N--CA 1.497 1.892 0 O-C-N 121.623 -0.673 . . . . 12.73 110.614 179.429 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 41.2 Cg_endo -73.18 145.09 38.48 Favored 'Trans proline' 0 N--CA 1.487 1.135 0 O-C-N 123.231 1.122 . . . . 12.01 110.29 -178.549 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 50.2 mttp -111.3 125.89 54.31 Favored 'General case' 0 N--CA 1.496 1.849 0 O-C-N 121.69 -0.631 . . . . 16.129999999999999 110.133 179.195 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 28.7 m120 -141.36 167.25 22.61 Favored 'General case' 0 N--CA 1.495 1.783 0 O-C-N 121.761 -0.587 . . . . 15.119999999999999 110.232 179.4 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . -126.31 41.04 1.7 Allowed Glycine 0 N--CA 1.495 2.615 0 N-CA-C 109.623 -1.391 . . . . 16.620000000000001 109.623 -179.731 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 39.7 p -120.6 153.66 36.5 Favored 'General case' 0 N--CA 1.495 1.823 0 O-C-N 121.662 -0.905 . . . . 17.98 110.229 179.779 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 66.9 tttt -66.58 -38.06 86.24 Favored 'General case' 0 N--CA 1.499 2.019 0 O-C-N 121.754 -0.592 . . . . 20.620000000000001 110.347 -179.612 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 1.4 t 52.83 64.3 7.44 Favored Pre-proline 0 N--CA 1.504 2.233 0 O-C-N 121.552 -0.718 . . . . 20.359999999999999 110.787 -178.555 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 25.4 Cg_endo -66.11 -32.61 42.98 Favored 'Trans proline' 0 N--CA 1.488 1.198 0 O-C-N 123.542 1.285 . . . . 22.379999999999999 110.635 -178.278 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 23.6 p -119.63 143.87 47.45 Favored 'General case' 0 N--CA 1.495 1.813 0 O-C-N 121.6 -0.687 . . . . 22.530000000000001 110.307 -179.269 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 24.5 m -69.26 -35.68 76.34 Favored 'General case' 0 N--CA 1.498 1.948 0 O-C-N 121.736 -0.603 . . . . 23.52 110.129 179.349 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 30.4 m120 53.35 44.91 29.44 Favored 'General case' 0 N--CA 1.507 2.382 0 O-C-N 121.717 -0.614 . . . . 24.510000000000002 110.838 -179.851 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 96.3 p -100.26 146.39 26.97 Favored 'General case' 0 N--CA 1.495 1.775 0 O-C-N 121.624 -0.672 . . . . 24.829999999999998 110.155 179.559 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 35.5 p -138.55 39.43 2.23 Favored 'General case' 0 N--CA 1.494 1.76 0 O-C-N 121.69 -0.631 . . . . 26.440000000000001 110.238 -178.992 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 57.7 tttm -67.93 129.04 38.69 Favored 'General case' 0 N--CA 1.5 2.032 0 O-C-N 121.609 -0.682 . . . . 28.34 110.209 -179.167 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 81.8 mt 53.36 178.97 0.02 OUTLIER 'General case' 0 N--CA 1.507 2.403 0 O-C-N 121.73 -0.606 . . . . 28.379999999999999 111.199 -179.127 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 42.9 tttp 51.97 91.47 0.02 OUTLIER 'General case' 0 N--CA 1.506 2.337 0 O-C-N 121.579 -0.7 . . . . 28.760000000000002 110.994 -179.555 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 27.5 t -115.44 140.86 48.76 Favored 'General case' 0 N--CA 1.496 1.837 0 O-C-N 121.67 -0.644 . . . . 29.079999999999998 110.178 -179.4 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -113.12 -172.01 1.98 Allowed 'General case' 0 N--CA 1.495 1.793 0 O-C-N 121.623 -0.673 . . . . 29.399999999999999 110.142 179.665 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 50.9 mt-10 -97.76 26.41 5.13 Favored 'General case' 0 N--CA 1.496 1.854 0 O-C-N 121.635 -0.665 . . . . 30.84 110.719 -180.0 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 24.4 m -125.85 138.87 53.83 Favored 'General case' 0 N--CA 1.494 1.772 0 O-C-N 121.469 -0.769 . . . . 32.649999999999999 110.16 -179.919 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 99.0 m-85 -117.57 137.75 52.38 Favored 'General case' 0 N--CA 1.496 1.866 0 O-C-N 121.717 -0.614 . . . . 33.789999999999999 110.174 -179.999 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 31.9 t -127.69 140.52 52.02 Favored 'General case' 0 N--CA 1.495 1.798 0 O-C-N 121.689 -0.632 . . . . 34.409999999999997 110.21 179.477 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 32.1 t -129.12 138.08 51.59 Favored 'General case' 0 N--CA 1.496 1.848 0 O-C-N 121.739 -0.601 . . . . 35.719999999999999 110.204 179.873 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 27.1 mtpp 55.43 -84.93 0.01 OUTLIER 'General case' 0 N--CA 1.506 2.341 0 O-C-N 121.889 -0.507 . . . . 36.409999999999997 111.309 -179.203 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 46.2 p-10 -146.99 148.99 32.26 Favored 'General case' 0 N--CA 1.496 1.852 0 O-C-N 121.114 -0.991 . . . . 37.240000000000002 110.345 -179.438 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 49.7 mttp -66.68 -39.17 88.03 Favored 'General case' 0 N--CA 1.499 2.007 0 O-C-N 121.668 -0.645 . . . . 39.68 110.347 -179.728 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 91' ' ' TRP . . . . . . . . . . . . . 98.5 m95 -116.82 135.64 53.58 Favored 'General case' 0 N--CA 1.495 1.812 0 O-C-N 121.651 -0.656 . . . . 39.939999999999998 110.24 -179.736 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 50.5 m -126.58 144.75 50.79 Favored 'General case' 0 N--CA 1.495 1.823 0 O-C-N 121.746 -0.596 . . . . 39.159999999999997 110.236 179.255 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 93' ' ' MET . . . . . . . . . . . . . 13.4 mmt 52.58 31.91 10.83 Favored 'General case' 0 N--CA 1.504 2.267 0 O-C-N 121.615 -0.678 . . . . 41.5 111.13 179.496 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 7.0 m-20 . . . . . 0 N--CA 1.495 1.788 0 CA-C-O 117.946 -1.026 . . . . 41.130000000000003 110.273 179.202 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' B' B ' 240' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.295 0 N-CA-C 109.499 -1.44 . . . . 23.460000000000001 109.499 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' B' B ' 241' ' ' ALA . . . . . . . . . . . . . . . -103.7 145.32 30.24 Favored 'General case' 0 N--CA 1.495 1.807 0 O-C-N 121.678 -0.895 . . . . 22.02 110.189 -179.949 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 242' ' ' THR . . . . . . . . . . . . . 52.7 p -128.2 164.13 23.19 Favored 'General case' 0 N--CA 1.496 1.843 0 O-C-N 121.665 -0.647 . . . . 20.010000000000002 110.094 -179.933 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 243' ' ' THR . . . . . . . . . . . . . 23.9 m -65.47 -39.24 91.74 Favored 'General case' 0 N--CA 1.501 2.079 0 O-C-N 121.685 -0.634 . . . . 18.690000000000001 110.371 -179.758 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 244' ' ' LYS . . . . . . . . . . . . . 45.3 mtpt -103.56 133.31 48.8 Favored 'General case' 0 N--CA 1.495 1.785 0 O-C-N 121.653 -0.654 . . . . 18.149999999999999 110.15 179.702 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 245' ' ' GLU . . . . . . . . . . . . . 54.7 mt-10 -68.36 -34.24 75.72 Favored 'General case' 0 N--CA 1.499 1.996 0 O-C-N 121.653 -0.654 . . . . 15.5 110.267 179.692 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 246' ' ' LYS . . . . . . . . . . . . . 39.2 tttp -96.85 132.1 42.93 Favored 'General case' 0 N--CA 1.494 1.761 0 O-C-N 121.742 -0.599 . . . . 17.140000000000001 110.228 -179.665 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 247' ' ' ASN . . . . . . . . . . . . . 35.2 t-20 -131.41 -54.24 1.02 Allowed 'General case' 0 N--CA 1.495 1.823 0 O-C-N 121.701 -0.624 . . . . 13.34 110.126 179.4 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 248' ' ' ILE . . . . . . . . . . . . . 33.8 pt 38.99 -159.78 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.515 2.814 0 N-CA-C 112.253 0.464 . . . . 12.369999999999999 112.253 -179.648 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 249' ' ' SER . . . . . . . . . . . . . 56.7 p -138.47 -64.01 0.53 Allowed 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.322 -0.861 . . . . 9.3300000000000001 110.228 178.919 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 250' ' ' VAL . . . . . . . . . . . . . 19.7 m 41.19 -159.46 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.515 2.797 0 N-CA-C 112.118 0.414 . . . . 8.4299999999999997 112.118 177.827 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 251' ' ' ASP . . . . . . . . . . . . . 8.8 p-10 -161.2 103.88 1.28 Allowed 'General case' 0 N--CA 1.497 1.89 0 O-C-N 121.367 -0.833 . . . . 6.3600000000000003 110.312 179.09 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 252' ' ' VAL . . . . . . . . . . . . . 8.3 p -162.22 81.86 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.497 1.88 0 O-C-N 121.596 -0.69 . . . . 5.0800000000000001 110.02 -179.882 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 253' ' ' ASP . . . . . . . . . . . . . 74.5 m-20 -79.93 140.1 36.81 Favored 'General case' 0 N--CA 1.497 1.918 0 O-C-N 121.457 -0.777 . . . . 3.4700000000000002 110.349 -177.834 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 254' ' ' ALA . . . . . . . . . . . . . . . -66.8 -23.86 66.11 Favored 'General case' 0 N--CA 1.5 2.047 0 O-C-N 121.8 -0.562 . . . . 2.0 110.768 178.935 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 255' ' ' ASP . . . . . . . . . . . . . 16.7 t70 -70.75 -28.72 64.91 Favored 'General case' 0 N--CA 1.499 1.994 0 O-C-N 121.528 -0.732 . . . . 2.1099999999999999 110.465 -178.781 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 256' ' ' ALA . . . . . . . . . . . . . . . -63.19 -38.04 89.6 Favored 'General case' 0 N--CA 1.501 2.11 0 O-C-N 121.475 -0.766 . . . . 1.3799999999999999 110.42 179.689 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 257' ' ' SER . . . . . . . . . . . . . 49.0 m -55.37 -34.98 64.78 Favored 'General case' 0 N--CA 1.503 2.207 0 O-C-N 121.586 -0.696 . . . . 1.6000000000000001 110.459 177.74 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 258' ' ' SER . . . . . . . . . . . . . 25.4 m -69.07 -32.27 71.6 Favored 'General case' 0 N--CA 1.498 1.968 0 C-N-CA 120.502 -0.479 . . . . 1.7 110.3 -179.883 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 259' ' ' GLN . . . . . . . . . . . . . 98.5 mt-30 -63.42 -36.88 85.2 Favored 'General case' 0 N--CA 1.501 2.086 0 O-C-N 121.557 -0.714 . . . . 2.7000000000000002 110.46 -179.038 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 260' ' ' LEU . . . . . . . . . . . . . 83.3 mt -68.18 -43.9 77.1 Favored 'General case' 0 N--CA 1.5 2.051 0 O-C-N 121.691 -0.631 . . . . 1.1799999999999999 110.206 179.349 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 261' ' ' LEU . . . . . . . . . . . . . 21.7 tp -68.88 -35.06 76.43 Favored 'General case' 0 N--CA 1.498 1.932 0 O-C-N 121.703 -0.623 . . . . 1.1100000000000001 109.756 176.039 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 262' ' ' SER . . . . . . . . . . . . . 23.1 t -62.74 -37.98 88.74 Favored 'General case' 0 N--CA 1.5 2.028 0 O-C-N 121.714 -0.616 . . . . 1.49 110.599 178.127 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 263' ' ' LEU . . . . . . . . . . . . . 33.8 mt -65.55 -46.64 78.73 Favored 'General case' 0 N--CA 1.501 2.117 0 O-C-N 121.663 -0.648 . . . . 1.2 110.09 -179.212 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 264' ' ' LEU . . . . . . . . . . . . . 81.2 mt -63.68 -33.73 76.27 Favored 'General case' 0 N--CA 1.502 2.139 0 O-C-N 121.805 -0.56 . . . . 1.29 110.651 178.103 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 265' ' ' LYS . . . . . . . . . . . . . 22.5 ttmt -75.68 -42.13 52.01 Favored 'General case' 0 N--CA 1.498 1.934 0 O-C-N 121.67 -0.644 . . . . 3.02 110.37 -177.029 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 266' ' ' SER . . . . . . . . . . . . . 85.7 p -163.01 169.51 19.46 Favored 'General case' 0 N--CA 1.496 1.859 0 O-C-N 121.65 -0.656 . . . . 3.1099999999999999 110.389 -178.699 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 267' ' ' SER . . . . . . . . . . . . . 22.7 t -64.97 -31.32 72.5 Favored 'General case' 0 N--CA 1.501 2.095 0 O-C-N 121.742 -0.599 . . . . 4.25 110.638 -179.939 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 268' ' ' THR . . . . . . . . . . . . . 3.2 m 65.28 -66.08 0.15 Allowed 'General case' 0 N--CA 1.509 2.498 0 O-C-N 121.944 -0.473 . . . . 6.6699999999999999 110.844 -176.839 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 269' ' ' ALA . . . . . . . . . . . . . . . 55.43 177.3 0.03 OUTLIER Pre-proline 0 N--CA 1.506 2.35 0 O-C-N 121.336 -0.853 . . . . 7.5999999999999996 111.108 -179.74 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 270' ' ' PRO . . . . . . . . . . . . . 20.5 Cg_exo -62.19 -37.1 65.09 Favored 'Trans proline' 0 N--CA 1.49 1.302 0 O-C-N 123.58 1.305 . . . . 9.6199999999999992 110.87 -178.749 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 271' ' ' SER . . . . . . . . . . . . . 27.5 t -144.36 129.19 18.35 Favored 'General case' 0 N--CA 1.495 1.783 0 O-C-N 121.692 -0.63 . . . . 11.68 110.473 -179.214 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 272' ' ' ASP . . . . . . . . . . . . . 3.2 m-20 -161.24 47.66 0.21 Allowed 'General case' 0 N--CA 1.495 1.821 0 CA-C-O 121.324 0.583 . . . . 13.91 109.849 178.644 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 273' ' ' LEU . . . . . . . . . . . . . 20.4 tp -162.06 -44.42 0.04 OUTLIER 'General case' 0 N--CA 1.497 1.881 0 O-C-N 121.531 -0.731 . . . . 17.109999999999999 110.184 -178.548 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 274' ' ' ALA . . . . . . . . . . . . . . . -74.95 -178.85 3.95 Favored 'General case' 0 N--CA 1.498 1.927 0 O-C-N 121.642 -0.661 . . . . 15.789999999999999 110.156 179.983 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 275' ' ' THR . . . . . . . . . . . . . 37.9 p -68.09 158.4 84.12 Favored Pre-proline 0 N--CA 1.5 2.045 0 O-C-N 121.707 -0.62 . . . . 16.780000000000001 110.171 -179.243 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 276' ' ' PRO . . . . . . . . . . . . . 21.5 Cg_exo -61.38 136.45 63.89 Favored 'Trans proline' 0 N--CA 1.491 1.359 0 O-C-N 123.571 1.301 . . . . 18.02 110.702 -179.605 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 277' ' ' GLN . . . . . . . . . . . . . 39.2 mm-40 -141.88 158.81 61.46 Favored Pre-proline 0 N--CA 1.494 1.749 0 O-C-N 121.673 -0.642 . . . . 20.77 110.173 179.272 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 278' ' ' PRO . . . . . . . . . . . . . 28.7 Cg_endo -67.58 115.52 3.77 Favored 'Trans proline' 0 N--CA 1.487 1.132 0 O-C-N 123.648 1.341 . . . . 20.719999999999999 110.362 179.701 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 279' ' ' SER . . . . . . . . . . . . . 87.6 p -151.86 160.97 43.37 Favored 'General case' 0 N--CA 1.495 1.804 0 O-C-N 121.732 -0.605 . . . . 21.949999999999999 110.205 179.965 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 280' ' ' THR . . . . . . . . . . . . . 24.6 m -126.13 140.4 52.6 Favored 'General case' 0 N--CA 1.495 1.824 0 O-C-N 121.671 -0.643 . . . . 23.5 110.116 179.635 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 281' ' ' PHE . . . . . . . . . . . . . 21.6 t80 -124.39 79.49 60.84 Favored Pre-proline 0 N--CA 1.495 1.82 0 O-C-N 121.712 -0.617 . . . . 24.609999999999999 110.074 179.478 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 282' ' ' PRO . . . . . . . . . . . . . 28.1 Cg_endo -67.16 141.17 56.33 Favored 'Trans proline' 0 N--CA 1.488 1.188 0 O-C-N 123.491 1.258 . . . . 26.210000000000001 110.422 -179.648 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 283' ' ' GLN . . . . . . . . . . . . . 45.6 tt0 -130.91 86.54 51.77 Favored Pre-proline 0 N--CA 1.496 1.832 0 O-C-N 121.653 -0.655 . . . . 27.559999999999999 110.149 179.43 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 284' ' ' PRO . . . . . . . . . . . . . 29.8 Cg_endo -68.24 151.95 76.29 Favored 'Trans proline' 0 N--CA 1.487 1.122 0 O-C-N 123.591 1.311 . . . . 28.780000000000001 110.312 -179.85 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 285' ' ' PRO . . . . . . . . . . . . . 30.0 Cg_endo -67.9 -34.18 24.44 Favored 'Trans proline' 0 N--CA 1.488 1.153 0 O-C-N 123.599 1.315 . . . . 29.23 110.451 -179.159 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 286' ' ' VAL . . . . . . . . . . . . . 61.2 t -128.15 137.35 57.73 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.923 0 O-C-N 121.685 -0.635 . . . . 30.300000000000001 109.866 -179.014 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 287' ' ' GLU . . . . . . . . . . . . . 46.3 mt-10 -107.58 145.93 32.6 Favored 'General case' 0 N--CA 1.496 1.845 0 O-C-N 121.665 -0.647 . . . . 32.109999999999999 110.058 178.638 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 288' ' ' SER . . . . . . . . . . . . . 30.5 t -136.12 142.45 44.26 Favored 'General case' 0 N--CA 1.495 1.824 0 O-C-N 121.638 -0.664 . . . . 32.780000000000001 110.283 -179.642 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 289' ' ' HIS . . . . . . . . . . . . . 77.7 m80 -91.58 -31.71 15.8 Favored 'General case' 0 N--CA 1.497 1.877 0 O-C-N 121.656 -0.653 . . . . 33.079999999999998 110.364 179.239 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 290' ' ' SER . . . . . . . . . . . . . 50.7 m -121.04 148.45 44.13 Favored 'General case' 0 N--CA 1.496 1.829 0 O-C-N 121.635 -0.666 . . . . 33.490000000000002 110.194 179.728 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 291' ' ' SER . . . . . . . . . . . . . 42.5 m . . . . . 0 N--CA 1.494 1.773 0 CA-C-O 117.993 -1.003 . . . . 34.909999999999997 110.213 179.987 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' -1' ' ' MET . . . . . . . . . . . . . 74.4 mtm . . . . . 0 N--CA 1.494 1.727 0 CA-C-O 120.989 0.423 . . . . 0.0 110.112 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 0' ' ' GLY . . . . . . . . . . . . . . . 158.19 -151.32 22.42 Favored Glycine 0 N--CA 1.494 2.527 0 N-CA-C 109.51 -1.436 . . . . 0.0 109.51 -179.711 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 90.1 mtp -94.39 148.02 22.65 Favored 'General case' 0 N--CA 1.496 1.833 0 O-C-N 121.675 -0.897 . . . . 0.0 110.103 179.856 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 70.7 m -101.05 167.25 10.36 Favored 'General case' 0 N--CA 1.495 1.794 0 O-C-N 121.661 -0.649 . . . . 0.0 110.085 -179.387 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 73.2 t -66.18 -27.82 41.85 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.061 0 O-C-N 121.703 -0.623 . . . . 0.0 110.278 -179.153 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -55.06 -31.07 60.87 Favored 'General case' 0 N--CA 1.505 2.295 0 O-C-N 121.454 -0.779 . . . . 0.0 110.405 -178.907 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 74.4 m-20 -68.91 -30.62 69.13 Favored 'General case' 0 N--CA 1.499 1.991 0 O-C-N 121.845 -0.534 . . . . 0.0 110.279 174.886 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 96.1 m-85 -95.63 10.13 37.85 Favored 'General case' 0 N--CA 1.497 1.909 0 O-C-N 121.652 -0.655 . . . . 0.0 111.507 -178.025 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 3.1 m-30 -67.28 133.18 49.2 Favored 'General case' 0 N--CA 1.502 2.141 0 O-C-N 121.17 -0.956 . . . . 0.0 110.018 173.986 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 83.66 -2.15 87.75 Favored Glycine 0 N--CA 1.497 2.753 0 N-CA-C 110.695 -0.962 . . . . 0.0 110.695 -176.086 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 30.4 t -77.27 138.91 39.67 Favored 'General case' 0 N--CA 1.497 1.918 0 O-C-N 121.11 -1.23 . . . . 0.0 110.461 177.948 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 14.8 t-20 -83.7 121.99 28.03 Favored 'General case' 0 N--CA 1.497 1.924 0 O-C-N 121.69 -0.631 . . . . 0.0 109.659 173.652 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 35.8 m -143.24 159.75 17.46 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.775 0 O-C-N 121.79 -0.568 . . . . 0.0 109.598 -179.22 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . 0.434 ' HA ' ' HA ' ' A' ' 22' ' ' ARG . 46.5 tt0 -109.45 123.74 49.87 Favored 'General case' 0 N--CA 1.493 1.71 0 C-N-CA 119.901 -0.72 . . . . 0.0 109.984 177.009 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 60.3 t -106.77 123.4 61.74 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.822 0 O-C-N 121.592 -0.693 . . . . 0.0 109.964 -177.128 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 27.0 tp -96.03 127.53 42.13 Favored 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.69 -0.631 . . . . 0.0 109.622 175.537 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 84.6 mt -97.83 169.87 9.36 Favored 'General case' 0 N--CA 1.495 1.813 0 O-C-N 121.623 -0.673 . . . . 0.0 110.977 -171.945 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 25.0 p30 -58.07 -21.18 44.71 Favored 'General case' 0 N--CA 1.505 2.314 0 O-C-N 121.782 -0.574 . . . . 0.0 111.594 -178.427 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 52.9 p-10 -90.27 21.01 4.02 Favored 'General case' 0 N--CA 1.499 1.978 0 O-C-N 121.548 -0.72 . . . . 0.0 111.121 -177.372 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 74.4 m-20 58.84 27.39 16.05 Favored 'General case' 0 N--CA 1.505 2.298 0 O-C-N 121.36 -0.838 . . . . 0.0 110.734 175.046 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 49.1 m -109.76 133.85 52.67 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.486 -0.759 . . . . 0.0 109.613 172.159 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 22.2 ttpt -109.78 143.12 40.06 Favored 'General case' 0 N--CA 1.494 1.748 0 O-C-N 121.618 -0.677 . . . . 0.0 110.738 -176.377 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -153.08 159.72 42.84 Favored 'General case' 0 N--CA 1.495 1.805 0 O-C-N 121.756 -0.59 . . . . 0.0 109.838 178.264 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . 0.434 ' HA ' ' HA ' ' A' ' 12' ' ' GLU . 33.9 ptt-85 -141.27 148.64 40.15 Favored 'General case' 0 N--CA 1.497 1.895 0 O-C-N 121.625 -0.672 . . . . 0.0 110.831 -178.779 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -171.7 171.41 44.06 Favored Glycine 0 N--CA 1.495 2.631 0 N-CA-C 108.805 -1.718 . . . . 0.0 108.805 -176.589 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 46.4 t -94.57 122.5 46.08 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.944 0 O-C-N 121.428 -1.042 . . . . 0.0 109.348 -175.371 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 93.6 mt -64.85 142.73 16.54 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.152 0 O-C-N 121.665 -0.647 . . . . 0.0 110.496 -172.066 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 6.7 p -121.22 -26.46 5.07 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.758 -0.589 . . . . 0.0 111.363 179.09 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 6.9 t-20 -162.07 160.49 27.49 Favored 'General case' 0 N--CA 1.499 2.009 0 C-N-CA 118.93 -1.108 . . . . 0.0 111.912 -179.109 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 86.8 t80 -150.03 127.49 11.49 Favored 'General case' 0 N--CA 1.498 1.935 0 N-CA-C 109.136 -0.69 . . . . 0.0 109.136 169.18 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 17.9 t70 -99.43 130.41 45.7 Favored 'General case' 0 N--CA 1.492 1.654 0 N-CA-C 109.002 -0.74 . . . . 0.0 109.002 -177.726 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 23.1 t -68.8 -50.31 51.23 Favored 'General case' 0 N--CA 1.498 1.956 0 C-N-CA 120.097 -0.641 . . . . 0.0 110.538 -176.268 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 21.8 t -59.57 -43.0 93.72 Favored 'General case' 0 N--CA 1.502 2.147 0 O-C-N 121.614 -0.679 . . . . 0.0 110.907 -174.415 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 91.6 m-20 -103.47 -10.02 18.87 Favored 'General case' 0 N--CA 1.498 1.929 0 O-C-N 121.628 -0.67 . . . . 0.0 111.615 -178.079 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 1.9 m 49.94 67.34 0.92 Allowed 'General case' 0 N--CA 1.508 2.443 0 O-C-N 121.072 -1.018 . . . . 0.0 110.938 -174.284 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 46.9 mm -124.31 126.51 72.17 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.09 0 O-C-N 121.615 -0.678 . . . . 0.0 109.472 -175.753 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 11.7 tp -115.8 121.17 41.64 Favored 'General case' 0 N--CA 1.494 1.75 0 O-C-N 121.692 -0.63 . . . . 0.0 110.517 -169.243 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 78.9 mt-30 -91.27 134.33 34.66 Favored 'General case' 0 N--CA 1.491 1.577 0 N-CA-C 109.436 -0.579 . . . . 0.0 109.436 173.684 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 89.3 mt -117.78 123.85 46.98 Favored 'General case' 0 N--CA 1.497 1.891 0 O-C-N 121.729 -0.607 . . . . 0.0 109.862 173.635 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 64.8 ttt180 -97.12 108.4 21.12 Favored 'General case' 0 N--CA 1.497 1.918 0 O-C-N 121.678 -0.639 . . . . 0.0 109.813 176.371 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 19.1 tp -84.81 151.85 24.05 Favored 'General case' 0 N--CA 1.494 1.77 0 O-C-N 121.758 -0.589 . . . . 0.0 110.925 -174.522 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -65.88 -6.69 13.05 Favored 'General case' 0 N--CA 1.503 2.176 0 O-C-N 121.97 -0.456 . . . . 0.0 111.951 -172.481 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 91.6 m-20 -86.58 27.81 0.93 Allowed 'General case' 0 N--CA 1.498 1.974 0 O-C-N 121.103 -0.998 . . . . 0.0 110.909 174.73 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 7.9 t70 62.99 29.45 16.43 Favored 'General case' 0 N--CA 1.505 2.275 0 O-C-N 121.078 -1.014 . . . . 0.0 110.52 175.591 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 51.0 m -123.19 137.85 54.79 Favored 'General case' 0 N--CA 1.496 1.872 0 O-C-N 121.36 -0.837 . . . . 0.0 110.411 -179.651 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 8.9 t -98.89 151.02 21.31 Favored 'General case' 0 N--CA 1.497 1.902 0 O-C-N 121.754 -0.591 . . . . 0.0 110.278 176.08 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 85.4 tttt -149.81 119.12 6.83 Favored 'General case' 0 N--CA 1.494 1.767 0 O-C-N 121.579 -0.7 . . . . 0.0 110.301 178.183 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 91.2 p -96.12 122.87 39.42 Favored 'General case' 0 N--CA 1.496 1.827 0 O-C-N 121.647 -0.658 . . . . 0.0 110.175 178.653 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 82.3 mt -129.32 136.2 60.0 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.871 0 O-C-N 121.698 -0.626 . . . . 0.0 109.377 179.682 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 59.3 t -82.37 127.6 39.5 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.91 0 O-C-N 121.6 -0.687 . . . . 0.0 109.196 178.762 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 37.5 p -59.92 -24.88 64.7 Favored 'General case' 0 N--CA 1.505 2.302 0 O-C-N 121.563 -0.711 . . . . 0.0 112.021 -170.265 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 91.4 mttt -56.84 -23.65 45.62 Favored 'General case' 0 N--CA 1.503 2.204 0 O-C-N 121.461 -0.774 . . . . 0.0 111.006 -176.616 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 45.7 p30 -84.34 2.75 38.96 Favored 'General case' 0 N--CA 1.498 1.957 0 C-N-CA 119.718 -0.793 . . . . 0.0 111.402 176.407 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 98.9 mt -75.12 126.15 35.55 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.119 0 O-C-N 121.204 -0.935 . . . . 0.0 109.997 178.17 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 40.9 tttp -92.79 -28.87 16.3 Favored 'General case' 0 N--CA 1.493 1.722 0 O-C-N 121.848 -0.532 . . . . 0.0 109.954 171.111 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 5.3 m-20 -163.98 155.27 16.14 Favored 'General case' 0 N--CA 1.501 2.086 0 O-C-N 121.806 -0.559 . . . . 0.0 110.005 -178.033 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 85.2 mt -132.95 149.03 52.27 Favored 'General case' 0 N--CA 1.496 1.833 0 O-C-N 121.708 -0.62 . . . . 0.0 110.563 -178.973 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 6.6 ptm180 -151.52 136.05 16.99 Favored 'General case' 0 N--CA 1.497 1.88 0 O-C-N 121.784 -0.573 . . . . 0.0 109.893 175.262 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 68.7 mt -84.42 133.18 29.84 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.893 0 O-C-N 121.424 -0.798 . . . . 0.0 109.876 175.841 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 32.3 mt -84.7 141.89 39.04 Favored Pre-proline 0 N--CA 1.497 1.909 0 O-C-N 121.581 -0.7 . . . . 0.0 110.01 179.619 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 50.6 Cg_endo -74.78 65.84 5.84 Favored 'Trans proline' 0 N--CA 1.486 1.064 0 O-C-N 123.495 1.261 . . . . 0.0 110.229 179.188 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 39.4 tttp -93.8 -63.1 1.24 Allowed 'General case' 0 N--CA 1.496 1.827 0 O-C-N 121.498 -0.751 . . . . 0.0 110.274 -178.898 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 16.8 t-20 -115.94 120.06 37.94 Favored 'General case' 0 N--CA 1.495 1.793 0 O-C-N 121.647 -0.658 . . . . 0.0 110.219 -178.755 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 78.8 mt-10 -108.53 139.51 43.19 Favored 'General case' 0 N--CA 1.495 1.803 0 O-C-N 121.744 -0.598 . . . . 0.0 110.097 178.819 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 81.9 mt -120.44 130.08 74.84 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.924 0 O-C-N 121.592 -0.692 . . . . 0.0 109.747 -179.761 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 64' ' ' MET . . . . . . . . . . . . . 35.9 ttm 51.75 89.3 0.1 Allowed Pre-proline 0 N--CA 1.505 2.291 0 O-C-N 121.68 -0.637 . . . . 0.0 111.103 179.586 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 22.1 Cg_exo -61.37 -31.48 88.67 Favored 'Trans proline' 0 N--CA 1.491 1.347 0 O-C-N 123.511 1.269 . . . . 0.0 110.701 179.166 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 8.7 tttm 53.35 -163.06 0.1 Allowed 'General case' 0 N--CA 1.507 2.398 0 O-C-N 121.573 -0.705 . . . . 0.0 110.616 179.429 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 89.3 m-20 53.16 39.1 29.09 Favored 'General case' 0 N--CA 1.506 2.346 0 O-C-N 121.502 -0.749 . . . . 0.0 110.901 179.618 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . -75.98 141.98 27.93 Favored Glycine 0 N--CA 1.494 2.507 0 N-CA-C 109.481 -1.447 . . . . 0.0 109.481 179.382 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 24.5 m -124.69 132.4 53.4 Favored 'General case' 0 N--CA 1.495 1.787 0 O-C-N 121.695 -0.885 . . . . 0.0 110.218 -179.842 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 55.0 mtmt -96.74 -33.01 11.86 Favored 'General case' 0 N--CA 1.495 1.823 0 O-C-N 121.65 -0.656 . . . . 0.0 110.253 178.855 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 3.9 m 60.12 159.55 0.11 Allowed Pre-proline 0 N--CA 1.507 2.412 0 O-C-N 121.694 -0.629 . . . . 0.0 110.932 -178.974 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 30.8 Cg_endo -68.45 173.23 10.06 Favored 'Trans proline' 0 N--CA 1.488 1.159 0 O-C-N 123.543 1.286 . . . . 0.0 110.378 179.232 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 30.0 t -97.06 144.93 26.46 Favored 'General case' 0 N--CA 1.495 1.776 0 O-C-N 121.734 -0.604 . . . . 0.0 110.218 179.874 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 23.6 m -117.85 144.92 44.97 Favored 'General case' 0 N--CA 1.495 1.802 0 O-C-N 121.629 -0.67 . . . . 0.0 110.135 -179.522 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 41.6 t-20 -62.72 -34.86 78.04 Favored 'General case' 0 N--CA 1.501 2.12 0 O-C-N 121.678 -0.639 . . . . 0.0 110.602 -178.407 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 22.6 t -63.34 -33.51 75.68 Favored 'General case' 0 N--CA 1.501 2.088 0 O-C-N 121.634 -0.666 . . . . 0.0 110.377 179.943 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 40.3 p -106.67 31.59 5.15 Favored 'General case' 0 N--CA 1.495 1.808 0 O-C-N 121.712 -0.618 . . . . 0.0 110.322 179.009 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 18.8 tptm -62.11 -38.68 89.84 Favored 'General case' 0 N--CA 1.502 2.139 0 O-C-N 121.59 -0.694 . . . . 0.0 110.332 -179.402 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 15.2 tp -112.86 129.24 56.52 Favored 'General case' 0 N--CA 1.495 1.802 0 O-C-N 121.736 -0.603 . . . . 0.0 110.086 178.945 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 49.3 mttp -94.86 148.4 22.34 Favored 'General case' 0 N--CA 1.495 1.785 0 O-C-N 121.668 -0.645 . . . . 0.0 110.276 -179.991 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 85.5 p -77.76 165.03 24.7 Favored 'General case' 0 N--CA 1.498 1.93 0 O-C-N 121.724 -0.61 . . . . 0.0 110.198 -179.777 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -97.73 142.66 29.24 Favored 'General case' 0 N--CA 1.495 1.796 0 O-C-N 121.652 -0.655 . . . . 0.0 110.256 -179.885 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 13.4 pt-20 -64.93 -30.59 71.59 Favored 'General case' 0 N--CA 1.501 2.101 0 O-C-N 121.687 -0.633 . . . . 0.0 110.681 -179.612 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 24.6 m -112.75 139.99 47.9 Favored 'General case' 0 N--CA 1.496 1.84 0 O-C-N 121.626 -0.671 . . . . 0.0 110.169 -179.854 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 59.4 t80 -121.81 140.18 52.68 Favored 'General case' 0 N--CA 1.496 1.827 0 O-C-N 121.703 -0.623 . . . . 0.0 110.123 179.803 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 92.2 p -116.73 157.92 24.69 Favored 'General case' 0 N--CA 1.495 1.784 0 O-C-N 121.609 -0.682 . . . . 0.0 110.246 -179.575 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 22.7 t -63.86 -33.44 75.69 Favored 'General case' 0 N--CA 1.501 2.084 0 O-C-N 121.652 -0.655 . . . . 0.0 110.437 -179.923 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 59.2 mttm -95.23 137.33 34.43 Favored 'General case' 0 N--CA 1.495 1.822 0 O-C-N 121.668 -0.645 . . . . 0.0 110.148 179.232 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 91.2 m-20 -108.79 122.16 46.57 Favored 'General case' 0 N--CA 1.496 1.866 0 O-C-N 121.709 -0.62 . . . . 0.0 110.189 -179.775 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 53.5 mttm -128.71 127.98 43.16 Favored 'General case' 0 N--CA 1.495 1.808 0 O-C-N 121.72 -0.613 . . . . 0.0 110.179 179.377 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 91' ' ' TRP . . . . . . . . . . . . . 74.5 t-105 -161.8 -61.08 0.05 OUTLIER 'General case' 0 N--CA 1.496 1.827 0 O-C-N 121.723 -0.611 . . . . 0.0 110.166 179.641 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 50.0 m -125.02 150.85 46.32 Favored 'General case' 0 N--CA 1.496 1.835 0 O-C-N 121.674 -0.641 . . . . 0.0 110.148 -179.846 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 93' ' ' MET . . . . . . . . . . . . . 74.2 mtm -64.61 -34.8 79.12 Favored 'General case' 0 N--CA 1.5 2.064 0 O-C-N 121.668 -0.645 . . . . 0.0 110.372 179.846 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 20.0 t70 . . . . . 0 N--CA 1.495 1.777 0 CA-C-O 118.026 -0.988 . . . . 0.0 110.148 179.913 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' B' B ' 240' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.286 0 N-CA-C 109.541 -1.423 . . . . 0.0 109.541 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' B' B ' 241' ' ' ALA . . . . . . . . . . . . . . . -144.13 153.73 42.44 Favored 'General case' 0 N--CA 1.495 1.807 0 O-C-N 121.71 -0.876 . . . . 0.0 110.192 179.975 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 242' ' ' THR . . . . . . . . . . . . . 40.2 p -124.28 161.47 25.77 Favored 'General case' 0 N--CA 1.496 1.828 0 O-C-N 121.69 -0.631 . . . . 0.0 110.209 179.978 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 243' ' ' THR . . . . . . . . . . . . . 18.9 m -107.45 30.92 5.81 Favored 'General case' 0 N--CA 1.496 1.852 0 O-C-N 121.67 -0.644 . . . . 0.0 110.364 179.943 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 244' ' ' LYS . . . . . . . . . . . . . 64.4 tttt -129.96 138.31 50.79 Favored 'General case' 0 N--CA 1.495 1.794 0 O-C-N 121.604 -0.685 . . . . 0.0 110.134 -179.724 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 245' ' ' GLU . . . . . . . . . . . . . 46.3 mt-10 -95.51 137.48 34.51 Favored 'General case' 0 N--CA 1.495 1.812 0 O-C-N 121.702 -0.624 . . . . 0.0 110.268 -179.576 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 246' ' ' LYS . . . . . . . . . . . . . 37.5 ttpt -65.87 -35.89 81.89 Favored 'General case' 0 N--CA 1.5 2.051 0 O-C-N 121.702 -0.624 . . . . 0.0 110.311 179.771 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 247' ' ' ASN . . . . . . . . . . . . . 91.8 m-20 -98.85 157.62 16.18 Favored 'General case' 0 N--CA 1.495 1.81 0 O-C-N 121.745 -0.597 . . . . 0.0 110.265 -178.869 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 248' ' ' ILE . . . . . . . . . . . . . 17.9 tt -161.57 165.33 0.73 Allowed 'Isoleucine or valine' 0 N--CA 1.496 1.873 0 O-C-N 121.75 -0.594 . . . . 0.0 110.005 -179.934 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 249' ' ' SER . . . . . . . . . . . . . 33.1 m -113.85 139.46 49.15 Favored 'General case' 0 N--CA 1.496 1.827 0 O-C-N 121.691 -0.631 . . . . 0.0 110.262 -179.28 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 250' ' ' VAL . . . . . . . . . . . . . 91.3 t -149.65 141.36 17.31 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.951 0 O-C-N 121.671 -0.643 . . . . 0.0 109.382 179.797 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 251' ' ' ASP . . . . . . . . . . . . . 2.3 t0 52.88 -157.84 0.15 Allowed 'General case' 0 N--CA 1.506 2.355 0 O-C-N 121.555 -0.716 . . . . 0.0 110.772 179.253 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 252' ' ' VAL . . . . . . . . . . . . . 48.7 t 54.74 95.36 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.507 2.407 0 O-C-N 121.392 -0.817 . . . . 0.0 110.488 -179.733 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 253' ' ' ASP . . . . . . . . . . . . . 74.5 m-20 52.66 47.41 24.74 Favored 'General case' 0 N--CA 1.505 2.289 0 O-C-N 121.691 -0.631 . . . . 0.0 111.05 179.578 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 254' ' ' ALA . . . . . . . . . . . . . . . -68.43 -38.23 80.99 Favored 'General case' 0 N--CA 1.499 2.013 0 O-C-N 121.701 -0.624 . . . . 0.0 110.153 178.708 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 255' ' ' ASP . . . . . . . . . . . . . 16.5 t70 -74.13 -27.94 61.1 Favored 'General case' 0 N--CA 1.499 1.989 0 O-C-N 121.784 -0.572 . . . . 0.0 110.663 -179.431 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 256' ' ' ALA . . . . . . . . . . . . . . . -62.67 -44.29 96.65 Favored 'General case' 0 N--CA 1.501 2.116 0 O-C-N 121.48 -0.763 . . . . 0.0 110.568 -177.577 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 257' ' ' SER . . . . . . . . . . . . . 24.3 m -55.78 -37.64 68.83 Favored 'General case' 0 N--CA 1.503 2.213 0 O-C-N 121.596 -0.69 . . . . 0.0 110.389 178.1 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 258' ' ' SER . . . . . . . . . . . . . 24.0 m -69.56 -32.75 71.72 Favored 'General case' 0 N--CA 1.498 1.934 0 C-N-CA 120.501 -0.48 . . . . 0.0 110.252 179.189 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 259' ' ' GLN . . . . . . . . . . . . . 48.4 tt0 -63.05 -37.85 88.82 Favored 'General case' 0 N--CA 1.501 2.085 0 O-C-N 121.66 -0.65 . . . . 0.0 110.494 -179.248 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 260' ' ' LEU . . . . . . . . . . . . . 84.5 mt -67.47 -42.68 82.61 Favored 'General case' 0 N--CA 1.499 2.01 0 O-C-N 121.611 -0.681 . . . . 0.0 110.154 179.69 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 261' ' ' LEU . . . . . . . . . . . . . 23.1 tp -69.65 -35.87 75.57 Favored 'General case' 0 N--CA 1.497 1.913 0 O-C-N 121.665 -0.647 . . . . 0.0 109.743 175.802 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 262' ' ' SER . . . . . . . . . . . . . 22.8 t -62.72 -38.29 89.89 Favored 'General case' 0 N--CA 1.5 2.074 0 O-C-N 121.743 -0.598 . . . . 0.0 110.634 178.013 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 263' ' ' LEU . . . . . . . . . . . . . 34.9 mt -64.99 -43.51 92.35 Favored 'General case' 0 N--CA 1.501 2.123 0 O-C-N 121.673 -0.642 . . . . 0.0 110.221 -179.306 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 264' ' ' LEU . . . . . . . . . . . . . 84.0 mt -62.61 -32.7 73.76 Favored 'General case' 0 N--CA 1.502 2.159 0 O-C-N 121.734 -0.604 . . . . 0.0 110.67 178.137 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 265' ' ' LYS . . . . . . . . . . . . . 54.2 tttm -74.61 -33.94 62.72 Favored 'General case' 0 N--CA 1.498 1.962 0 O-C-N 121.665 -0.647 . . . . 0.0 110.187 -178.136 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 266' ' ' SER . . . . . . . . . . . . . 53.1 m -78.51 143.31 36.72 Favored 'General case' 0 N--CA 1.498 1.933 0 O-C-N 121.687 -0.633 . . . . 0.0 110.194 -179.755 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 267' ' ' SER . . . . . . . . . . . . . 87.3 p -153.5 165.09 36.94 Favored 'General case' 0 N--CA 1.495 1.775 0 O-C-N 121.709 -0.619 . . . . 0.0 110.229 -179.869 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 268' ' ' THR . . . . . . . . . . . . . 40.1 p -124.14 158.33 32.58 Favored 'General case' 0 N--CA 1.496 1.873 0 O-C-N 121.664 -0.647 . . . . 0.0 110.144 179.463 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 269' ' ' ALA . . . . . . . . . . . . . . . 48.09 85.58 0.17 Allowed Pre-proline 0 N--CA 1.506 2.357 0 O-C-N 121.778 -0.576 . . . . 0.0 111.346 -178.689 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 270' ' ' PRO . . . . . . . . . . . . . 28.1 Cg_endo -67.11 145.12 72.05 Favored 'Trans proline' 0 N--CA 1.489 1.207 0 O-C-N 123.588 1.309 . . . . 0.0 110.418 179.819 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 271' ' ' SER . . . . . . . . . . . . . 95.4 p -132.27 156.32 46.74 Favored 'General case' 0 N--CA 1.495 1.806 0 O-C-N 121.612 -0.68 . . . . 0.0 110.185 179.551 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 272' ' ' ASP . . . . . . . . . . . . . 26.4 t0 -129.4 108.94 10.67 Favored 'General case' 0 N--CA 1.496 1.843 0 O-C-N 121.707 -0.62 . . . . 0.0 110.211 -179.883 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 273' ' ' LEU . . . . . . . . . . . . . 20.3 tp 51.43 88.25 0.03 OUTLIER 'General case' 0 N--CA 1.506 2.345 0 O-C-N 121.643 -0.661 . . . . 0.0 111.103 179.874 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 274' ' ' ALA . . . . . . . . . . . . . . . 49.9 -165.79 0.03 OUTLIER 'General case' 0 N--CA 1.506 2.37 0 O-C-N 121.649 -0.657 . . . . 0.0 111.244 -179.81 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 275' ' ' THR . . . . . . . . . . . . . 26.0 m -114.54 87.76 14.74 Favored Pre-proline 0 N--CA 1.495 1.815 0 O-C-N 121.687 -0.633 . . . . 0.0 110.073 179.848 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 276' ' ' PRO . . . . . . . . . . . . . 25.7 Cg_endo -66.25 -32.28 42.41 Favored 'Trans proline' 0 N--CA 1.49 1.275 0 O-C-N 123.54 1.284 . . . . 0.0 110.6 -178.764 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 277' ' ' GLN . . . . . . . . . . . . . 40.7 mm-40 -116.58 155.21 49.02 Favored Pre-proline 0 N--CA 1.495 1.806 0 O-C-N 121.603 -0.686 . . . . 0.0 110.238 -179.469 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 278' ' ' PRO . . . . . . . . . . . . . 29.3 Cg_endo -67.83 146.11 71.02 Favored 'Trans proline' 0 N--CA 1.488 1.198 0 O-C-N 123.686 1.361 . . . . 0.0 110.379 -179.58 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 279' ' ' SER . . . . . . . . . . . . . 89.2 p -66.74 -30.44 70.67 Favored 'General case' 0 N--CA 1.5 2.036 0 O-C-N 121.634 -0.666 . . . . 0.0 110.486 179.115 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 280' ' ' THR . . . . . . . . . . . . . 23.3 m -92.98 146.18 23.82 Favored 'General case' 0 N--CA 1.496 1.851 0 O-C-N 121.599 -0.688 . . . . 0.0 110.14 179.774 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 281' ' ' PHE . . . . . . . . . . . . . 63.2 m-85 -116.49 92.49 37.21 Favored Pre-proline 0 N--CA 1.495 1.787 0 O-C-N 121.653 -0.654 . . . . 0.0 110.24 -179.62 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 282' ' ' PRO . . . . . . . . . . . . . 23.6 Cg_exo -60.54 -30.0 89.75 Favored 'Trans proline' 0 N--CA 1.491 1.326 0 O-C-N 123.446 1.235 . . . . 0.0 110.85 179.601 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 283' ' ' GLN . . . . . . . . . . . . . 13.1 mm100 -87.27 160.62 48.19 Favored Pre-proline 0 N--CA 1.496 1.85 0 O-C-N 121.647 -0.658 . . . . 0.0 110.134 179.282 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 284' ' ' PRO . . . . . . . . . . . . . 28.5 Cg_endo -67.56 153.73 75.53 Favored 'Trans proline' 0 N--CA 1.487 1.128 0 O-C-N 123.685 1.361 . . . . 0.0 110.39 -179.235 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 285' ' ' PRO . . . . . . . . . . . . . 29.4 Cg_endo -67.77 153.06 76.78 Favored 'Trans proline' 0 N--CA 1.488 1.184 0 O-C-N 123.645 1.339 . . . . 0.0 110.391 -179.653 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 286' ' ' VAL . . . . . . . . . . . . . 61.0 t -107.81 135.41 46.56 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.897 0 O-C-N 121.658 -0.651 . . . . 0.0 109.674 179.534 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 287' ' ' GLU . . . . . . . . . . . . . 78.5 mt-10 -103.57 151.35 23.0 Favored 'General case' 0 N--CA 1.495 1.792 0 O-C-N 121.717 -0.614 . . . . 0.0 110.27 -179.249 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 288' ' ' SER . . . . . . . . . . . . . 28.6 t -120.95 146.37 46.73 Favored 'General case' 0 N--CA 1.495 1.796 0 O-C-N 121.659 -0.651 . . . . 0.0 110.194 179.861 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 289' ' ' HIS . . . . . . . . . . . . . 77.1 m80 -64.02 -35.15 79.77 Favored 'General case' 0 N--CA 1.501 2.088 0 O-C-N 121.658 -0.651 . . . . 0.0 110.443 -179.811 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 290' ' ' SER . . . . . . . . . . . . . 89.3 p -125.97 155.28 41.63 Favored 'General case' 0 N--CA 1.495 1.807 0 O-C-N 121.697 -0.627 . . . . 0.0 110.153 179.824 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 291' ' ' SER . . . . . . . . . . . . . 44.9 m . . . . . 0 N--CA 1.494 1.749 0 CA-C-O 117.96 -1.019 . . . . 0.0 110.225 179.985 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' -1' ' ' MET . . . . . . . . . . . . . 60.6 mtt . . . . . 0 N--CA 1.493 1.679 0 CA-C-O 120.985 0.421 . . . . 0.0 110.139 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 0' ' ' GLY . . . . . . . . . . . . . . . -84.6 -175.25 50.69 Favored Glycine 0 N--CA 1.493 2.494 0 N-CA-C 109.535 -1.426 . . . . 0.0 109.535 179.923 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 65.9 mtt -97.78 141.56 30.63 Favored 'General case' 0 N--CA 1.494 1.759 0 O-C-N 121.691 -0.888 . . . . 0.0 110.217 179.983 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 70.8 m -101.09 164.86 11.6 Favored 'General case' 0 N--CA 1.494 1.755 0 O-C-N 121.743 -0.598 . . . . 0.0 110.057 -179.631 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 67.1 t -66.69 -27.92 41.56 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.084 0 O-C-N 121.652 -0.655 . . . . 0.0 110.086 179.474 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -55.02 -30.46 59.56 Favored 'General case' 0 N--CA 1.505 2.289 0 O-C-N 121.451 -0.781 . . . . 0.0 110.395 -179.523 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 74.4 m-20 -68.46 -31.15 70.25 Favored 'General case' 0 N--CA 1.499 1.99 0 O-C-N 121.802 -0.561 . . . . 0.0 110.186 174.676 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 96.1 m-85 -96.02 10.07 38.67 Favored 'General case' 0 N--CA 1.498 1.948 0 O-C-N 121.712 -0.618 . . . . 0.0 111.469 -178.755 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 3.6 m-30 -67.19 140.28 57.46 Favored 'General case' 0 N--CA 1.503 2.178 0 O-C-N 121.153 -0.967 . . . . 0.0 110.102 174.647 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 82.33 0.05 89.43 Favored Glycine 0 N--CA 1.497 2.727 0 N-CA-C 110.574 -1.01 . . . . 0.0 110.574 -175.982 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 30.2 t -77.41 134.91 38.3 Favored 'General case' 0 N--CA 1.497 1.912 0 O-C-N 121.129 -1.218 . . . . 0.0 110.492 179.208 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 11.8 t-20 -83.23 118.73 23.83 Favored 'General case' 0 N--CA 1.497 1.889 0 O-C-N 121.625 -0.672 . . . . 0.0 109.596 173.063 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 35.6 m -142.45 161.68 19.04 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.678 0 O-C-N 121.674 -0.641 . . . . 0.0 109.741 -177.381 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 46.7 tt0 -109.32 147.41 32.74 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.684 -0.635 . . . . 0.0 109.632 177.103 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 60.9 t -137.14 126.41 36.43 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.743 0 O-C-N 121.621 -0.674 . . . . 0.0 109.709 -175.36 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 23.7 tp -95.89 129.79 43.04 Favored 'General case' 0 N--CA 1.492 1.646 0 N-CA-C 109.432 -0.581 . . . . 0.0 109.432 176.525 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 82.3 mt -90.6 170.14 10.42 Favored 'General case' 0 N--CA 1.496 1.857 0 O-C-N 121.657 -0.652 . . . . 0.0 110.565 -175.53 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 23.9 p30 -56.8 -22.95 39.98 Favored 'General case' 0 N--CA 1.506 2.351 0 O-C-N 121.751 -0.593 . . . . 0.0 111.51 -177.799 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 53.6 p-10 -94.2 24.15 4.58 Favored 'General case' 0 N--CA 1.497 1.89 0 O-C-N 121.535 -0.728 . . . . 0.0 110.733 -177.714 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 10.4 m-20 59.41 28.43 17.8 Favored 'General case' 0 N--CA 1.506 2.346 0 O-C-N 121.446 -0.783 . . . . 0.0 110.607 175.721 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 50.3 m -103.87 144.83 30.98 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.437 -0.789 . . . . 0.0 109.659 172.359 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 97.2 mttt -109.57 145.07 36.99 Favored 'General case' 0 N--CA 1.495 1.791 0 O-C-N 121.543 -0.723 . . . . 0.0 110.665 -176.166 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -153.05 133.4 13.58 Favored 'General case' 0 N--CA 1.496 1.86 0 O-C-N 121.713 -0.617 . . . . 0.0 110.229 176.359 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 35.1 ptt180 -128.48 144.78 51.2 Favored 'General case' 0 N--CA 1.498 1.957 0 O-C-N 121.685 -0.634 . . . . 0.0 110.39 -178.009 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -171.78 171.43 44.1 Favored Glycine 0 N--CA 1.496 2.635 0 N-CA-C 109.229 -1.548 . . . . 0.0 109.229 -175.36 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 47.4 t -94.59 119.11 42.11 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.986 0 O-C-N 121.609 -0.936 . . . . 0.0 109.355 -176.968 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 89.7 mt -64.29 143.57 15.57 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.163 0 O-C-N 121.704 -0.623 . . . . 0.0 110.56 -171.381 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 10.1 p -121.24 -25.89 5.17 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.773 -0.58 . . . . 0.0 111.237 178.246 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 2.0 t-20 -162.28 158.07 23.76 Favored 'General case' 0 N--CA 1.501 2.121 0 O-C-N 121.0 -1.063 . . . . 0.0 111.774 -179.08 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 91.2 t80 -150.16 124.29 9.43 Favored 'General case' 0 N--CA 1.5 2.056 0 N-CA-C 109.361 -0.607 . . . . 0.0 109.361 171.428 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . 0.402 ' O ' ' N ' ' A' ' 33' ' ' SER . 21.7 t70 -98.12 126.27 43.49 Favored 'General case' 0 N--CA 1.492 1.658 0 N-CA-C 109.091 -0.707 . . . . 0.0 109.091 -179.296 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 87.0 p -65.16 -43.03 93.1 Favored 'General case' 0 N--CA 1.5 2.07 0 O-C-N 121.65 -0.656 . . . . 0.0 110.778 -174.143 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 19.6 m -60.21 -48.05 83.37 Favored 'General case' 0 N--CA 1.503 2.196 0 O-C-N 121.522 -0.736 . . . . 0.0 110.884 -173.573 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 91.7 m-20 -107.07 -0.05 23.18 Favored 'General case' 0 N--CA 1.498 1.961 0 O-C-N 121.621 -0.675 . . . . 0.0 111.697 -179.258 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 33' ' ' SER . . . . . 0.402 ' N ' ' O ' ' A' ' 29' ' ' ASP . 38.8 p 45.71 67.08 0.79 Allowed 'General case' 0 N--CA 1.508 2.45 0 O-C-N 121.423 -0.798 . . . . 0.0 111.142 -174.754 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 44.8 mm -114.5 125.79 71.89 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.981 0 O-C-N 121.553 -0.717 . . . . 0.0 109.222 -175.917 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 11.3 tp -115.84 120.52 39.53 Favored 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.633 -0.667 . . . . 0.0 110.53 -168.605 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 67.3 mt-30 -91.04 132.11 36.21 Favored 'General case' 0 N--CA 1.489 1.51 0 N-CA-C 109.201 -0.666 . . . . 0.0 109.201 171.952 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 16.7 mt -117.77 123.76 46.77 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.812 -0.555 . . . . 0.0 110.07 175.837 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 72.8 ttt180 -96.29 104.95 16.95 Favored 'General case' 0 N--CA 1.496 1.868 0 O-C-N 121.721 -0.612 . . . . 0.0 109.79 176.001 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 18.4 tp -84.56 153.63 23.13 Favored 'General case' 0 N--CA 1.495 1.803 0 O-C-N 121.699 -0.626 . . . . 0.0 110.949 -173.602 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -67.46 -4.59 11.77 Favored 'General case' 0 N--CA 1.503 2.201 0 O-C-N 121.895 -0.503 . . . . 0.0 111.986 -171.753 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 30.1 m120 -87.1 27.62 1.01 Allowed 'General case' 0 N--CA 1.498 1.925 0 O-C-N 121.063 -1.023 . . . . 0.0 110.871 174.063 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 15.3 t0 63.13 29.28 16.16 Favored 'General case' 0 N--CA 1.505 2.286 0 O-C-N 121.079 -1.013 . . . . 0.0 110.521 175.848 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 48.7 m -125.65 137.85 53.89 Favored 'General case' 0 N--CA 1.495 1.818 0 O-C-N 121.357 -0.839 . . . . 0.0 110.528 -179.33 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 9.7 t -97.94 151.03 20.7 Favored 'General case' 0 N--CA 1.497 1.917 0 O-C-N 121.764 -0.585 . . . . 0.0 110.122 174.986 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 42.1 tttp -148.96 119.09 7.21 Favored 'General case' 0 N--CA 1.496 1.84 0 O-C-N 121.562 -0.711 . . . . 0.0 110.384 179.049 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 90.3 p -96.46 120.34 36.6 Favored 'General case' 0 N--CA 1.495 1.805 0 O-C-N 121.712 -0.617 . . . . 0.0 110.286 179.271 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 82.5 mt -129.42 138.89 53.16 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.908 0 O-C-N 121.712 -0.618 . . . . 0.0 109.343 179.251 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 63.2 t -82.12 127.69 39.39 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.955 0 C-N-CA 120.001 -0.679 . . . . 0.0 109.207 178.54 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 41.9 p -59.34 -25.08 63.9 Favored 'General case' 0 N--CA 1.504 2.235 0 O-C-N 121.624 -0.672 . . . . 0.0 112.059 -169.449 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 60.0 tttt -57.58 -23.15 49.2 Favored 'General case' 0 N--CA 1.502 2.149 0 O-C-N 121.546 -0.721 . . . . 0.0 111.261 -175.524 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 10.3 p30 -81.17 -3.46 52.26 Favored 'General case' 0 N--CA 1.499 2.01 0 C-N-CA 119.702 -0.799 . . . . 0.0 111.058 176.078 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 95.8 mt -79.79 135.28 25.84 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.021 0 O-C-N 121.265 -0.897 . . . . 0.0 110.219 177.926 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 83.6 tttt -92.08 -28.47 17.11 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.9 -0.5 . . . . 0.0 109.785 170.294 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -164.83 158.46 17.42 Favored 'General case' 0 N--CA 1.503 2.204 0 O-C-N 121.735 -0.603 . . . . 0.0 110.287 -177.012 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 4.2 mp -132.93 153.64 51.21 Favored 'General case' 0 N--CA 1.497 1.893 0 O-C-N 121.74 -0.6 . . . . 0.0 110.411 178.227 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 20.1 ptp180 -151.87 146.39 25.63 Favored 'General case' 0 N--CA 1.496 1.863 0 O-C-N 121.719 -0.613 . . . . 0.0 109.964 175.549 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 62.4 mt -85.54 133.32 29.78 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.956 0 O-C-N 121.559 -0.713 . . . . 0.0 109.87 173.732 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 61.3 mt -83.03 146.87 52.76 Favored Pre-proline 0 N--CA 1.498 1.946 0 O-C-N 121.559 -0.713 . . . . 0.0 110.073 -177.971 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 36.9 Cg_endo -70.8 140.22 38.3 Favored 'Trans proline' 0 N--CA 1.487 1.121 0 O-C-N 123.49 1.258 . . . . 0.0 110.229 178.742 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 83.8 tttt -96.4 -63.56 1.13 Allowed 'General case' 0 N--CA 1.494 1.753 0 O-C-N 121.623 -0.673 . . . . 0.0 110.196 179.472 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 89.4 m-20 52.9 42.44 32.06 Favored 'General case' 0 N--CA 1.506 2.345 0 O-C-N 121.549 -0.72 . . . . 0.0 110.936 -179.65 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 76.2 mt-10 -108.49 162.63 13.94 Favored 'General case' 0 N--CA 1.496 1.827 0 O-C-N 121.625 -0.672 . . . . 0.0 110.297 179.695 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 82.9 mt -107.81 141.02 24.1 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.868 0 O-C-N 121.702 -0.624 . . . . 0.0 109.56 179.452 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 64' ' ' MET . . . . . . . . . . . . . 13.2 mmt 51.81 86.48 0.16 Allowed Pre-proline 0 N--CA 1.505 2.321 0 O-C-N 121.612 -0.68 . . . . 0.0 110.848 -178.671 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 26.7 Cg_endo -66.49 134.64 36.4 Favored 'Trans proline' 0 N--CA 1.49 1.273 0 O-C-N 123.628 1.33 . . . . 0.0 110.482 -178.438 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 55.4 mmtt -66.08 -35.39 80.4 Favored 'General case' 0 N--CA 1.5 2.056 0 O-C-N 121.625 -0.672 . . . . 0.0 110.201 179.167 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 15.7 t-20 -65.08 -34.01 77.39 Favored 'General case' 0 N--CA 1.5 2.035 0 O-C-N 121.634 -0.666 . . . . 0.0 110.429 179.724 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 89.36 -163.72 31.54 Favored Glycine 0 N--CA 1.493 2.489 0 N-CA-C 109.465 -1.454 . . . . 0.0 109.465 -179.456 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 24.4 m -115.77 139.78 49.84 Favored 'General case' 0 N--CA 1.496 1.835 0 O-C-N 121.642 -0.917 . . . . 0.0 110.16 -179.5 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 98.4 mttt -101.06 155.93 17.71 Favored 'General case' 0 N--CA 1.495 1.81 0 O-C-N 121.69 -0.631 . . . . 0.0 110.225 -179.674 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 92.7 p -80.87 159.65 68.23 Favored Pre-proline 0 N--CA 1.497 1.912 0 O-C-N 121.677 -0.64 . . . . 0.0 110.015 178.622 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 20.7 Cg_endo -65.53 -57.07 0.28 Allowed 'Trans proline' 0 N--CA 1.489 1.206 0 O-C-N 123.599 1.315 . . . . 0.0 110.507 -179.377 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 70.1 m -135.69 131.53 35.78 Favored 'General case' 0 N--CA 1.496 1.827 0 O-C-N 121.747 -0.596 . . . . 0.0 110.251 179.085 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 24.3 m -78.97 -34.64 44.05 Favored 'General case' 0 N--CA 1.498 1.97 0 O-C-N 121.683 -0.636 . . . . 0.0 110.078 178.34 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 30.6 m120 56.08 168.85 0.03 OUTLIER 'General case' 0 N--CA 1.507 2.399 0 CA-C-O 121.277 0.56 . . . . 0.0 111.249 -179.086 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 32.7 t -160.97 157.37 26.24 Favored 'General case' 0 N--CA 1.495 1.777 0 O-C-N 121.589 -0.695 . . . . 0.0 110.225 -179.877 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 38.9 p -120.23 145.64 46.83 Favored 'General case' 0 N--CA 1.496 1.86 0 O-C-N 121.703 -0.623 . . . . 0.0 110.111 179.18 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 59.1 mttm -140.62 155.86 46.43 Favored 'General case' 0 N--CA 1.496 1.837 0 O-C-N 121.724 -0.61 . . . . 0.0 110.264 -179.982 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 82.6 mt -67.17 -33.32 75.16 Favored 'General case' 0 N--CA 1.499 2.002 0 O-C-N 121.654 -0.654 . . . . 0.0 110.353 179.089 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 35.1 ttmt -64.01 -42.58 97.1 Favored 'General case' 0 N--CA 1.502 2.152 0 O-C-N 121.673 -0.642 . . . . 0.0 110.532 -179.392 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 89.5 p -148.05 157.53 43.57 Favored 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.705 -0.622 . . . . 0.0 110.344 -179.793 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -146.13 155.86 43.03 Favored 'General case' 0 N--CA 1.495 1.776 0 O-C-N 121.728 -0.607 . . . . 0.0 110.17 -179.946 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 30.4 tp10 -100.75 132.34 46.2 Favored 'General case' 0 N--CA 1.494 1.767 0 O-C-N 121.725 -0.61 . . . . 0.0 110.142 179.92 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 25.0 m -128.09 139.98 52.21 Favored 'General case' 0 N--CA 1.495 1.786 0 O-C-N 121.723 -0.611 . . . . 0.0 110.097 179.618 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 69.7 t80 -111.54 122.17 47.12 Favored 'General case' 0 N--CA 1.495 1.792 0 O-C-N 121.683 -0.636 . . . . 0.0 110.219 179.733 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 88.8 p -151.99 159.16 43.82 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.741 -0.599 . . . . 0.0 110.154 179.685 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 92.3 p -146.96 156.29 42.94 Favored 'General case' 0 N--CA 1.494 1.758 0 O-C-N 121.616 -0.677 . . . . 0.0 110.265 179.569 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 4.3 mmpt? -124.68 124.21 41.69 Favored 'General case' 0 N--CA 1.495 1.81 0 O-C-N 121.6 -0.688 . . . . 0.0 110.126 179.296 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 91.1 m-20 -67.8 -36.59 80.69 Favored 'General case' 0 N--CA 1.5 2.04 0 O-C-N 121.696 -0.627 . . . . 0.0 110.188 179.429 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 30.6 mtmm -66.44 -34.54 78.17 Favored 'General case' 0 N--CA 1.5 2.061 0 O-C-N 121.683 -0.636 . . . . 0.0 110.44 -179.956 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 91' ' ' TRP . . . . . . . . . . . . . 71.6 t-105 -64.03 -36.43 83.98 Favored 'General case' 0 N--CA 1.502 2.136 0 O-C-N 121.607 -0.683 . . . . 0.0 110.538 -178.386 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 96.9 p -108.42 155.21 20.82 Favored 'General case' 0 N--CA 1.496 1.829 0 O-C-N 121.686 -0.634 . . . . 0.0 110.274 -178.838 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 93' ' ' MET . . . . . . . . . . . . . 74.4 mtm -122.19 156.03 34.57 Favored 'General case' 0 N--CA 1.495 1.804 0 O-C-N 121.677 -0.639 . . . . 0.0 110.195 -179.988 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 26.3 t0 . . . . . 0 N--CA 1.495 1.812 0 CA-C-O 118.039 -0.982 . . . . 0.0 110.145 179.973 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' B' B ' 240' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.336 0 N-CA-C 109.502 -1.439 . . . . 0.0 109.502 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' B' B ' 241' ' ' ALA . . . . . . . . . . . . . . . 53.29 32.68 14.01 Favored 'General case' 0 N--CA 1.506 2.356 0 O-C-N 121.554 -0.968 . . . . 0.0 110.954 179.82 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 242' ' ' THR . . . . . . . . . . . . . 42.7 p -68.2 -34.0 75.46 Favored 'General case' 0 N--CA 1.499 2.0 0 O-C-N 121.565 -0.709 . . . . 0.0 110.215 -179.782 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 243' ' ' THR . . . . . . . . . . . . . 40.5 p -126.3 159.62 32.62 Favored 'General case' 0 N--CA 1.497 1.896 0 O-C-N 121.707 -0.621 . . . . 0.0 110.205 179.52 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 244' ' ' LYS . . . . . . . . . . . . . 47.6 pttt -67.2 140.86 57.46 Favored 'General case' 0 N--CA 1.499 2.007 0 O-C-N 121.683 -0.636 . . . . 0.0 110.426 179.354 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 245' ' ' GLU . . . . . . . . . . . . . 50.6 mt-10 -99.01 28.09 4.62 Favored 'General case' 0 N--CA 1.496 1.834 0 O-C-N 121.66 -0.65 . . . . 0.0 110.565 -179.9 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 246' ' ' LYS . . . . . . . . . . . . . 62.4 mttm -65.05 -33.31 75.73 Favored 'General case' 0 N--CA 1.501 2.075 0 O-C-N 121.511 -0.743 . . . . 0.0 110.427 -179.757 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 247' ' ' ASN . . . . . . . . . . . . . 65.7 t30 -92.98 153.74 18.57 Favored 'General case' 0 N--CA 1.495 1.784 0 O-C-N 121.726 -0.609 . . . . 0.0 110.17 179.99 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 248' ' ' ILE . . . . . . . . . . . . . 82.4 mt -76.6 -33.15 21.9 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.042 0 O-C-N 121.695 -0.628 . . . . 0.0 109.792 -179.204 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 249' ' ' SER . . . . . . . . . . . . . 96.9 p -109.52 141.66 41.67 Favored 'General case' 0 N--CA 1.495 1.799 0 O-C-N 121.599 -0.688 . . . . 0.0 110.193 179.677 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 250' ' ' VAL . . . . . . . . . . . . . 30.6 m -150.48 159.74 4.63 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.958 0 O-C-N 121.66 -0.65 . . . . 0.0 109.977 -179.994 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 251' ' ' ASP . . . . . . . . . . . . . 74.3 m-20 56.55 -81.96 0.01 OUTLIER 'General case' 0 N--CA 1.507 2.386 0 O-C-N 121.972 -0.455 . . . . 0.0 111.332 -179.066 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 252' ' ' VAL . . . . . . . . . . . . . 51.4 t 53.46 95.99 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.508 2.446 0 O-C-N 121.149 -0.969 . . . . 0.0 110.512 -178.33 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 253' ' ' ASP . . . . . . . . . . . . . 12.5 p-10 -161.56 -168.45 1.99 Allowed 'General case' 0 N--CA 1.496 1.862 0 O-C-N 121.644 -0.66 . . . . 0.0 110.384 -179.01 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 254' ' ' ALA . . . . . . . . . . . . . . . -65.42 -29.74 70.46 Favored 'General case' 0 N--CA 1.5 2.069 0 O-C-N 121.778 -0.577 . . . . 0.0 110.827 -176.926 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 255' ' ' ASP . . . . . . . . . . . . . 74.5 m-20 -72.14 -32.35 66.83 Favored 'General case' 0 N--CA 1.499 2.024 0 O-C-N 121.626 -0.671 . . . . 0.0 110.22 -178.997 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 256' ' ' ALA . . . . . . . . . . . . . . . -64.67 -37.56 87.99 Favored 'General case' 0 N--CA 1.501 2.115 0 O-C-N 121.548 -0.72 . . . . 0.0 110.165 177.262 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 257' ' ' SER . . . . . . . . . . . . . 27.1 m -56.7 -38.14 71.87 Favored 'General case' 0 N--CA 1.503 2.195 0 O-C-N 121.748 -0.595 . . . . 0.0 110.643 179.713 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 258' ' ' SER . . . . . . . . . . . . . 60.2 p -69.32 -30.87 69.02 Favored 'General case' 0 N--CA 1.5 2.029 0 C-N-CA 120.366 -0.534 . . . . 0.0 110.4 -177.604 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 259' ' ' GLN . . . . . . . . . . . . . 47.4 tt0 -64.96 -40.1 94.48 Favored 'General case' 0 N--CA 1.5 2.051 0 O-C-N 121.623 -0.673 . . . . 0.0 110.395 -179.721 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 260' ' ' LEU . . . . . . . . . . . . . 83.7 mt -68.84 -38.98 80.19 Favored 'General case' 0 N--CA 1.499 1.993 0 O-C-N 121.686 -0.634 . . . . 0.0 110.243 179.882 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 261' ' ' LEU . . . . . . . . . . . . . 29.6 tp -67.91 -36.98 81.13 Favored 'General case' 0 N--CA 1.498 1.965 0 O-C-N 121.638 -0.664 . . . . 0.0 110.018 179.064 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 262' ' ' SER . . . . . . . . . . . . . 23.0 t -62.48 -38.54 90.25 Favored 'General case' 0 N--CA 1.501 2.101 0 O-C-N 121.754 -0.591 . . . . 0.0 110.465 177.587 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 263' ' ' LEU . . . . . . . . . . . . . 45.7 mt -65.01 -40.17 94.51 Favored 'General case' 0 N--CA 1.501 2.076 0 O-C-N 121.663 -0.648 . . . . 0.0 110.363 179.208 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 264' ' ' LEU . . . . . . . . . . . . . 84.2 mt -62.24 -35.55 79.28 Favored 'General case' 0 N--CA 1.502 2.143 0 O-C-N 121.736 -0.603 . . . . 0.0 110.564 178.517 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 265' ' ' LYS . . . . . . . . . . . . . 30.1 ttpt -75.81 -36.72 59.63 Favored 'General case' 0 N--CA 1.497 1.922 0 O-C-N 121.757 -0.59 . . . . 0.0 110.085 -179.511 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 266' ' ' SER . . . . . . . . . . . . . 86.3 p -162.95 171.04 17.16 Favored 'General case' 0 N--CA 1.495 1.805 0 O-C-N 121.682 -0.636 . . . . 0.0 110.178 -179.659 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 267' ' ' SER . . . . . . . . . . . . . 86.5 p -89.49 160.04 16.95 Favored 'General case' 0 N--CA 1.496 1.871 0 O-C-N 121.792 -0.567 . . . . 0.0 110.181 -179.949 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 268' ' ' THR . . . . . . . . . . . . . 24.1 m -65.74 -37.83 87.45 Favored 'General case' 0 N--CA 1.5 2.056 0 O-C-N 121.697 -0.627 . . . . 0.0 110.326 -179.65 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 269' ' ' ALA . . . . . . . . . . . . . . . 48.53 86.78 0.14 Allowed Pre-proline 0 N--CA 1.506 2.342 0 O-C-N 121.748 -0.595 . . . . 0.0 111.255 -178.37 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 270' ' ' PRO . . . . . . . . . . . . . 23.9 Cg_endo -65.87 -32.61 45.26 Favored 'Trans proline' 0 N--CA 1.489 1.225 0 O-C-N 123.54 1.284 . . . . 0.0 110.583 -179.506 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 271' ' ' SER . . . . . . . . . . . . . 50.2 m -123.41 146.64 47.84 Favored 'General case' 0 N--CA 1.496 1.842 0 O-C-N 121.682 -0.636 . . . . 0.0 110.226 179.952 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 272' ' ' ASP . . . . . . . . . . . . . 19.9 t70 -160.52 31.66 0.16 Allowed 'General case' 0 N--CA 1.495 1.804 0 O-C-N 121.659 -0.651 . . . . 0.0 110.356 179.307 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 273' ' ' LEU . . . . . . . . . . . . . 7.3 mp 51.23 65.2 1.55 Allowed 'General case' 0 N--CA 1.505 2.322 0 O-C-N 121.636 -0.665 . . . . 0.0 111.077 -179.303 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 274' ' ' ALA . . . . . . . . . . . . . . . -166.51 170.45 12.8 Favored 'General case' 0 N--CA 1.497 1.895 0 O-C-N 121.492 -0.755 . . . . 0.0 110.036 -179.588 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 275' ' ' THR . . . . . . . . . . . . . 23.5 m -117.27 81.76 13.75 Favored Pre-proline 0 N--CA 1.494 1.759 0 O-C-N 121.67 -0.644 . . . . 0.0 110.109 179.899 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 276' ' ' PRO . . . . . . . . . . . . . 26.3 Cg_endo -66.5 -30.91 42.97 Favored 'Trans proline' 0 N--CA 1.487 1.146 0 O-C-N 123.551 1.29 . . . . 0.0 110.647 -179.668 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 277' ' ' GLN . . . . . . . . . . . . . 43.2 mt-30 -120.04 88.47 40.93 Favored Pre-proline 0 N--CA 1.495 1.806 0 O-C-N 121.618 -0.676 . . . . 0.0 110.25 -179.349 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 278' ' ' PRO . . . . . . . . . . . . . 18.6 Cg_exo -62.98 152.65 78.27 Favored 'Trans proline' 0 N--CA 1.489 1.264 0 O-C-N 123.481 1.253 . . . . 0.0 110.542 178.906 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 279' ' ' SER . . . . . . . . . . . . . 90.8 p -107.75 149.86 27.67 Favored 'General case' 0 N--CA 1.494 1.77 0 O-C-N 121.619 -0.676 . . . . 0.0 110.237 -179.819 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 280' ' ' THR . . . . . . . . . . . . . 20.6 m -152.58 -46.21 0.1 Allowed 'General case' 0 N--CA 1.495 1.777 0 O-C-N 121.687 -0.633 . . . . 0.0 110.298 -179.612 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 281' ' ' PHE . . . . . . . . . . . . . 1.7 m-85 -61.75 -48.51 89.37 Favored Pre-proline 0 N--CA 1.502 2.154 0 O-C-N 121.657 -0.652 . . . . 0.0 111.044 -179.348 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 282' ' ' PRO . . . . . . . . . . . . . 27.5 Cg_exo -57.83 150.94 59.79 Favored 'Trans proline' 0 N--CA 1.494 1.527 0 O-C-N 123.182 1.096 . . . . 0.0 110.838 177.216 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 283' ' ' GLN . . . . . . . . . . . . . 4.7 pt20 -64.1 158.07 65.73 Favored Pre-proline 0 N--CA 1.501 2.119 0 O-C-N 121.661 -0.649 . . . . 0.0 110.536 -179.672 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 284' ' ' PRO . . . . . . . . . . . . . 28.4 Cg_endo -67.38 155.59 69.74 Favored 'Trans proline' 0 N--CA 1.488 1.161 0 O-C-N 123.711 1.374 . . . . 0.0 110.399 -179.324 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 285' ' ' PRO . . . . . . . . . . . . . 26.5 Cg_endo -66.7 151.2 83.09 Favored 'Trans proline' 0 N--CA 1.488 1.172 0 O-C-N 123.662 1.348 . . . . 0.0 110.419 -179.669 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 286' ' ' VAL . . . . . . . . . . . . . 15.0 p -63.88 -32.78 58.44 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.086 0 O-C-N 121.709 -0.62 . . . . 0.0 110.417 179.887 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 287' ' ' GLU . . . . . . . . . . . . . 29.8 tp10 -99.11 137.63 37.36 Favored 'General case' 0 N--CA 1.494 1.764 0 O-C-N 121.698 -0.626 . . . . 0.0 110.167 179.915 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 288' ' ' SER . . . . . . . . . . . . . 26.6 t -136.23 153.73 51.13 Favored 'General case' 0 N--CA 1.495 1.782 0 O-C-N 121.66 -0.65 . . . . 0.0 110.093 -179.869 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 289' ' ' HIS . . . . . . . . . . . . . 98.4 m-70 -103.75 132.69 49.77 Favored 'General case' 0 N--CA 1.495 1.782 0 O-C-N 121.633 -0.667 . . . . 0.0 110.201 -179.725 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 290' ' ' SER . . . . . . . . . . . . . 27.5 t -135.37 147.64 49.13 Favored 'General case' 0 N--CA 1.494 1.76 0 O-C-N 121.671 -0.643 . . . . 0.0 110.176 -179.756 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 291' ' ' SER . . . . . . . . . . . . . 3.4 m . . . . . 0 N--CA 1.494 1.768 0 CA-C-O 118.034 -0.984 . . . . 0.0 110.228 179.931 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' -1' ' ' MET . . . . . . . . . . . . . 74.2 mtm . . . . . 0 N--CA 1.493 1.687 0 CA-C-O 120.979 0.419 . . . . 0.0 110.223 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 0' ' ' GLY . . . . . . . . . . . . . . . -71.16 134.84 23.51 Favored Glycine 0 N--CA 1.493 2.465 0 N-CA-C 109.549 -1.42 . . . . 0.0 109.549 -179.989 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 65.3 mtt -131.7 164.32 26.2 Favored 'General case' 0 N--CA 1.495 1.804 0 O-C-N 121.603 -0.939 . . . . 0.0 110.215 179.935 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 68.6 m -95.28 171.93 8.42 Favored 'General case' 0 N--CA 1.496 1.858 0 O-C-N 121.738 -0.601 . . . . 0.0 110.047 179.488 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 78.5 t -66.64 -27.75 41.09 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.06 0 O-C-N 121.699 -0.626 . . . . 0.0 110.303 -178.543 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -55.33 -31.53 61.77 Favored 'General case' 0 N--CA 1.504 2.272 0 O-C-N 121.375 -0.828 . . . . 0.0 110.399 -178.828 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 74.4 m-20 -69.04 -30.64 69.04 Favored 'General case' 0 N--CA 1.499 2.0 0 O-C-N 121.85 -0.531 . . . . 0.0 110.283 174.845 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 91.0 m-85 -95.4 10.02 37.86 Favored 'General case' 0 N--CA 1.497 1.917 0 O-C-N 121.59 -0.694 . . . . 0.0 111.536 -178.08 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 2.9 m-30 -67.2 134.57 51.95 Favored 'General case' 0 N--CA 1.502 2.163 0 O-C-N 121.072 -1.017 . . . . 0.0 109.941 173.953 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 83.49 -1.05 89.3 Favored Glycine 0 N--CA 1.496 2.676 0 N-CA-C 110.84 -0.904 . . . . 0.0 110.84 -178.046 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 83.1 p -77.82 137.59 38.5 Favored 'General case' 0 N--CA 1.499 2.01 0 O-C-N 121.064 -1.257 . . . . 0.0 110.516 176.855 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 27.0 t-20 -85.17 119.28 25.38 Favored 'General case' 0 N--CA 1.498 1.952 0 O-C-N 121.592 -0.692 . . . . 0.0 109.925 174.102 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 35.2 m -142.5 163.02 18.37 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.729 0 N-CA-C 109.448 -0.575 . . . . 0.0 109.448 -179.837 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 41.8 tt0 -109.34 127.4 54.3 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.489 -0.757 . . . . 0.0 110.072 178.236 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 55.5 t -106.83 124.78 62.7 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.744 0 O-C-N 121.619 -0.675 . . . . 0.0 109.913 -177.848 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 22.2 tp -96.02 126.73 41.46 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.687 -0.633 . . . . 0.0 109.456 174.31 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 86.3 mt -97.46 166.37 11.56 Favored 'General case' 0 N--CA 1.495 1.819 0 O-C-N 121.588 -0.695 . . . . 0.0 111.167 -171.38 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 16.7 p30 -58.09 -22.62 51.33 Favored 'General case' 0 N--CA 1.506 2.333 0 O-C-N 121.746 -0.596 . . . . 0.0 111.535 -177.277 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 40.3 p-10 -93.0 23.56 4.18 Favored 'General case' 0 N--CA 1.497 1.918 0 O-C-N 121.571 -0.705 . . . . 0.0 110.847 -176.551 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 74.3 m-20 59.1 27.7 16.75 Favored 'General case' 0 N--CA 1.505 2.292 0 O-C-N 121.398 -0.814 . . . . 0.0 110.671 175.838 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 50.5 m -104.62 133.98 48.55 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.502 -0.749 . . . . 0.0 109.63 172.339 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 30.2 ttmt -109.66 138.76 45.56 Favored 'General case' 0 N--CA 1.495 1.793 0 O-C-N 121.715 -0.616 . . . . 0.0 110.413 -176.008 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -153.02 160.54 43.0 Favored 'General case' 0 N--CA 1.496 1.845 0 O-C-N 121.718 -0.614 . . . . 0.0 110.278 179.438 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 6.8 ptp85 -140.69 154.44 46.37 Favored 'General case' 0 N--CA 1.496 1.831 0 O-C-N 121.665 -0.647 . . . . 0.0 110.355 -179.914 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -171.85 171.13 43.95 Favored Glycine 0 N--CA 1.494 2.527 0 N-CA-C 109.059 -1.616 . . . . 0.0 109.059 179.429 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 40.9 t -94.7 123.05 46.67 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.983 0 O-C-N 121.66 -0.906 . . . . 0.0 109.259 176.3 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 96.0 mt -63.18 141.43 18.14 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.182 0 O-C-N 121.62 -0.675 . . . . 0.0 110.499 -171.953 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 12.2 p -121.15 -25.41 5.3 Favored 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.818 -0.551 . . . . 0.0 111.229 -179.545 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 2.0 t-20 -163.38 161.42 24.44 Favored 'General case' 0 N--CA 1.5 2.075 0 O-C-N 120.901 -1.124 . . . . 0.0 111.849 178.864 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 84.5 t80 -150.03 129.0 12.59 Favored 'General case' 0 N--CA 1.498 1.963 0 N-CA-C 109.23 -0.655 . . . . 0.0 109.23 169.032 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 21.2 t70 -98.77 131.23 45.06 Favored 'General case' 0 N--CA 1.492 1.625 0 N-CA-C 109.031 -0.729 . . . . 0.0 109.031 -178.359 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 87.4 p -69.81 -50.64 41.01 Favored 'General case' 0 N--CA 1.498 1.953 0 C-N-CA 120.032 -0.667 . . . . 0.0 110.616 -175.35 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 5.2 t -59.63 -42.61 93.1 Favored 'General case' 0 N--CA 1.502 2.131 0 O-C-N 121.567 -0.708 . . . . 0.0 110.782 -174.632 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 28.6 m120 -103.79 -10.06 18.56 Favored 'General case' 0 N--CA 1.496 1.875 0 O-C-N 121.663 -0.648 . . . . 0.0 111.518 -177.266 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 2.1 m 49.94 67.31 0.92 Allowed 'General case' 0 N--CA 1.508 2.452 0 O-C-N 121.027 -1.046 . . . . 0.0 110.876 -174.153 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 45.8 mm -123.51 125.86 72.18 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.043 0 O-C-N 121.519 -0.738 . . . . 0.0 109.333 -175.698 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 9.5 tp -115.7 122.73 46.42 Favored 'General case' 0 N--CA 1.495 1.792 0 O-C-N 121.701 -0.624 . . . . 0.0 110.628 -168.639 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 78.4 mt-30 -91.03 133.22 35.49 Favored 'General case' 0 N--CA 1.49 1.562 0 N-CA-C 109.445 -0.576 . . . . 0.0 109.445 172.318 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 13.7 mt -117.83 123.54 46.16 Favored 'General case' 0 N--CA 1.494 1.772 0 C-N-CA 120.224 -0.59 . . . . 0.0 110.036 174.676 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 63.3 ttt180 -104.5 105.01 14.96 Favored 'General case' 0 N--CA 1.495 1.811 0 O-C-N 121.761 -0.587 . . . . 0.0 110.132 174.62 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 62.9 tp -83.65 155.45 23.18 Favored 'General case' 0 N--CA 1.499 1.977 0 O-C-N 121.535 -0.728 . . . . 0.0 110.679 -176.086 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -67.19 -3.1 6.8 Favored 'General case' 0 N--CA 1.503 2.22 0 O-C-N 121.806 -0.559 . . . . 0.0 112.154 -170.497 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 35.4 p-10 -85.75 28.99 0.73 Allowed 'General case' 0 N--CA 1.499 1.993 0 O-C-N 121.044 -1.035 . . . . 0.0 110.937 173.166 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 74.1 m-20 59.05 29.28 18.8 Favored 'General case' 0 N--CA 1.505 2.298 0 O-C-N 121.26 -0.9 . . . . 0.0 110.357 177.138 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 68.9 m -121.5 141.93 50.55 Favored 'General case' 0 N--CA 1.494 1.758 0 O-C-N 121.502 -0.748 . . . . 0.0 109.99 177.112 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 9.0 t -128.16 147.37 50.55 Favored 'General case' 0 N--CA 1.495 1.816 0 O-C-N 121.621 -0.674 . . . . 0.0 109.966 179.903 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 77.1 tttt -150.76 134.11 16.26 Favored 'General case' 0 N--CA 1.495 1.798 0 C-N-CA 120.157 -0.617 . . . . 0.0 110.595 -177.325 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 88.4 p -94.72 123.04 37.94 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.817 -0.552 . . . . 0.0 110.105 177.93 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 82.2 mt -129.25 137.92 55.76 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.857 0 N-CA-C 109.252 -0.648 . . . . 0.0 109.252 179.683 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 58.7 t -82.41 127.61 39.48 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.874 0 O-C-N 121.598 -0.689 . . . . 0.0 109.297 179.638 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 34.2 p -59.88 -24.89 64.64 Favored 'General case' 0 N--CA 1.504 2.269 0 O-C-N 121.552 -0.717 . . . . 0.0 112.052 -170.727 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 51.4 mttm -57.14 -25.23 58.55 Favored 'General case' 0 N--CA 1.503 2.224 0 O-C-N 121.474 -0.766 . . . . 0.0 110.96 -176.289 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 6.4 p30 -84.35 4.85 29.39 Favored 'General case' 0 N--CA 1.499 1.998 0 C-N-CA 119.659 -0.817 . . . . 0.0 111.381 176.295 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 98.9 mt -75.59 127.72 37.1 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.13 0 O-C-N 121.119 -0.988 . . . . 0.0 109.831 175.953 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 85.3 tttt -92.9 -29.62 15.82 Favored 'General case' 0 N--CA 1.493 1.697 0 O-C-N 121.853 -0.53 . . . . 0.0 109.738 170.844 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 5.3 m-20 -164.09 155.18 15.77 Favored 'General case' 0 N--CA 1.5 2.048 0 O-C-N 121.821 -0.549 . . . . 0.0 110.091 -177.715 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 80.0 mt -132.95 148.97 52.28 Favored 'General case' 0 N--CA 1.496 1.861 0 O-C-N 121.675 -0.641 . . . . 0.0 110.4 -179.346 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 19.7 ptp180 -150.8 146.46 26.39 Favored 'General case' 0 N--CA 1.496 1.874 0 O-C-N 121.75 -0.594 . . . . 0.0 109.933 174.937 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 59.2 mt -86.98 133.24 30.45 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.866 0 O-C-N 121.497 -0.752 . . . . 0.0 109.97 173.455 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 73.0 mt -83.47 153.25 65.14 Favored Pre-proline 0 N--CA 1.498 1.955 0 O-C-N 121.628 -0.67 . . . . 0.0 110.153 -179.205 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 32.4 Cg_endo -69.05 145.43 61.25 Favored 'Trans proline' 0 N--CA 1.488 1.154 0 O-C-N 123.671 1.353 . . . . 0.0 110.311 -179.968 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 61.2 mttm -95.34 -39.32 10.09 Favored 'General case' 0 N--CA 1.495 1.803 0 O-C-N 121.715 -0.615 . . . . 0.0 110.261 179.197 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 18.0 t-20 -109.82 124.97 52.24 Favored 'General case' 0 N--CA 1.495 1.816 0 O-C-N 121.651 -0.655 . . . . 0.0 110.17 179.652 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 34.2 tt0 -154.17 -46.82 0.09 Allowed 'General case' 0 N--CA 1.495 1.801 0 O-C-N 121.735 -0.603 . . . . 0.0 110.433 -179.244 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 49.4 mm -112.44 141.23 28.63 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.916 0 O-C-N 121.656 -0.652 . . . . 0.0 109.987 -177.864 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 64' ' ' MET . . . . . . . . . . . . . 2.7 tpt 52.44 62.31 10.54 Favored Pre-proline 0 N--CA 1.506 2.338 0 O-C-N 121.709 -0.619 . . . . 0.0 111.038 179.609 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 29.6 Cg_endo -67.98 134.46 32.05 Favored 'Trans proline' 0 N--CA 1.488 1.171 0 O-C-N 123.552 1.291 . . . . 0.0 110.295 178.66 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 57.5 mtpt -108.64 136.86 47.52 Favored 'General case' 0 N--CA 1.494 1.765 0 O-C-N 121.621 -0.674 . . . . 0.0 110.228 179.821 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 25.8 t30 -91.09 -61.12 1.73 Allowed 'General case' 0 N--CA 1.495 1.817 0 O-C-N 121.664 -0.648 . . . . 0.0 110.226 179.533 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 67.75 -122.42 16.88 Favored Glycine 0 N--CA 1.496 2.643 0 N-CA-C 109.692 -1.363 . . . . 0.0 109.692 -179.907 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 40.9 p -97.12 165.14 12.2 Favored 'General case' 0 N--CA 1.494 1.766 0 O-C-N 121.75 -0.853 . . . . 0.0 110.058 178.741 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 28.7 tptt -99.43 31.59 3.08 Favored 'General case' 0 N--CA 1.495 1.811 0 O-C-N 121.671 -0.643 . . . . 0.0 110.379 -179.338 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 15.2 m -137.1 156.99 75.32 Favored Pre-proline 0 N--CA 1.495 1.81 0 O-C-N 121.617 -0.677 . . . . 0.0 110.196 179.927 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 29.0 Cg_endo -67.58 151.09 80.01 Favored 'Trans proline' 0 N--CA 1.489 1.235 0 O-C-N 123.603 1.318 . . . . 0.0 110.434 179.998 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 25.4 t -115.16 135.29 54.34 Favored 'General case' 0 N--CA 1.495 1.81 0 O-C-N 121.687 -0.633 . . . . 0.0 110.174 179.054 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 24.4 m -68.63 -42.9 77.38 Favored 'General case' 0 N--CA 1.498 1.938 0 O-C-N 121.653 -0.655 . . . . 0.0 110.35 -178.962 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 16.4 t-20 -114.55 120.86 41.64 Favored 'General case' 0 N--CA 1.496 1.859 0 O-C-N 121.65 -0.656 . . . . 0.0 110.218 -178.681 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 85.7 p -108.43 30.55 6.34 Favored 'General case' 0 N--CA 1.495 1.784 0 O-C-N 121.636 -0.665 . . . . 0.0 110.443 179.129 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 24.9 m -116.3 138.69 51.11 Favored 'General case' 0 N--CA 1.496 1.825 0 O-C-N 121.608 -0.682 . . . . 0.0 110.183 -179.198 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 44.8 pttt -136.6 153.52 50.93 Favored 'General case' 0 N--CA 1.497 1.915 0 O-C-N 121.72 -0.612 . . . . 0.0 110.272 -179.755 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 6.1 mp -98.6 138.65 35.47 Favored 'General case' 0 N--CA 1.495 1.776 0 O-C-N 121.664 -0.647 . . . . 0.0 110.184 179.669 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 98.7 mttt -109.47 127.1 54.17 Favored 'General case' 0 N--CA 1.496 1.829 0 O-C-N 121.694 -0.629 . . . . 0.0 110.221 -179.611 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 24.6 m -67.09 -39.76 86.83 Favored 'General case' 0 N--CA 1.5 2.031 0 O-C-N 121.668 -0.645 . . . . 0.0 110.274 179.761 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -160.87 147.46 15.11 Favored 'General case' 0 N--CA 1.495 1.809 0 O-C-N 121.688 -0.632 . . . . 0.0 110.149 179.278 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 46.5 mt-10 -104.24 -57.8 1.98 Allowed 'General case' 0 N--CA 1.496 1.826 0 O-C-N 121.677 -0.639 . . . . 0.0 110.164 179.3 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 39.3 p -127.77 173.71 9.73 Favored 'General case' 0 N--CA 1.496 1.859 0 O-C-N 121.722 -0.612 . . . . 0.0 110.057 179.989 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 98.8 m-85 -103.87 130.51 51.46 Favored 'General case' 0 N--CA 1.494 1.768 0 O-C-N 121.728 -0.607 . . . . 0.0 110.207 179.66 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 44.0 m -127.73 157.14 41.14 Favored 'General case' 0 N--CA 1.495 1.812 0 O-C-N 121.769 -0.582 . . . . 0.0 110.145 -179.458 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 23.0 t -62.25 -34.55 76.75 Favored 'General case' 0 N--CA 1.501 2.118 0 O-C-N 121.543 -0.723 . . . . 0.0 110.391 179.768 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 53.2 mttp -102.36 129.93 48.96 Favored 'General case' 0 N--CA 1.495 1.809 0 O-C-N 121.649 -0.657 . . . . 0.0 110.028 178.368 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 90.7 m-20 -66.44 -36.57 83.13 Favored 'General case' 0 N--CA 1.5 2.041 0 O-C-N 121.671 -0.643 . . . . 0.0 110.33 -178.676 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 63.1 mttm -103.51 28.56 6.38 Favored 'General case' 0 N--CA 1.496 1.865 0 O-C-N 121.674 -0.641 . . . . 0.0 110.651 -179.072 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 91' ' ' TRP . . . . . . . . . . . . . 27.0 t90 55.62 -84.79 0.01 OUTLIER 'General case' 0 N--CA 1.506 2.348 0 O-C-N 121.787 -0.57 . . . . 0.0 111.229 -178.99 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 27.2 t -127.59 141.36 51.65 Favored 'General case' 0 N--CA 1.495 1.818 0 O-C-N 121.174 -0.954 . . . . 0.0 110.229 -178.952 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 93' ' ' MET . . . . . . . . . . . . . 13.3 mmt -66.0 -35.23 80.02 Favored 'General case' 0 N--CA 1.501 2.09 0 O-C-N 121.701 -0.624 . . . . 0.0 110.31 179.859 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 17.1 t70 . . . . . 0 N--CA 1.495 1.796 0 CA-C-O 118.021 -0.99 . . . . 0.0 110.148 -179.864 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' B' B ' 240' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.239 0 N-CA-C 109.566 -1.414 . . . . 0.0 109.566 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' B' B ' 241' ' ' ALA . . . . . . . . . . . . . . . -67.27 -32.67 73.84 Favored 'General case' 0 N--CA 1.501 2.076 0 O-C-N 121.684 -0.892 . . . . 0.0 110.355 179.866 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 242' ' ' THR . . . . . . . . . . . . . 23.2 m -119.79 144.84 47.09 Favored 'General case' 0 N--CA 1.495 1.791 0 O-C-N 121.66 -0.65 . . . . 0.0 110.165 179.971 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 243' ' ' THR . . . . . . . . . . . . . 42.8 p -82.18 154.34 25.52 Favored 'General case' 0 N--CA 1.497 1.92 0 O-C-N 121.663 -0.648 . . . . 0.0 110.164 -179.665 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 244' ' ' LYS . . . . . . . . . . . . . 53.2 mtmt -89.65 -30.33 18.19 Favored 'General case' 0 N--CA 1.496 1.85 0 O-C-N 121.684 -0.635 . . . . 0.0 110.571 -179.404 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 245' ' ' GLU . . . . . . . . . . . . . 46.3 tt0 -94.1 132.36 38.7 Favored 'General case' 0 N--CA 1.496 1.85 0 O-C-N 121.571 -0.705 . . . . 0.0 110.171 -178.931 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 246' ' ' LYS . . . . . . . . . . . . . 53.8 mttp -132.72 160.92 35.38 Favored 'General case' 0 N--CA 1.495 1.789 0 O-C-N 121.671 -0.643 . . . . 0.0 110.211 179.989 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 247' ' ' ASN . . . . . . . . . . . . . 89.9 m-20 -74.01 171.16 13.99 Favored 'General case' 0 N--CA 1.498 1.957 0 O-C-N 121.743 -0.598 . . . . 0.0 110.155 -179.797 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 248' ' ' ILE . . . . . . . . . . . . . 46.5 mm 58.36 164.54 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.508 2.464 0 O-C-N 121.764 -0.585 . . . . 0.0 110.719 -179.564 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 249' ' ' SER . . . . . . . . . . . . . 91.5 p -110.83 156.87 20.5 Favored 'General case' 0 N--CA 1.495 1.813 0 O-C-N 121.581 -0.699 . . . . 0.0 110.22 179.653 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 250' ' ' VAL . . . . . . . . . . . . . 34.4 m -87.57 129.02 39.62 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.014 0 O-C-N 121.71 -0.619 . . . . 0.0 110.463 -178.908 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 251' ' ' ASP . . . . . . . . . . . . . 74.5 m-20 54.72 -86.61 0.02 OUTLIER 'General case' 0 N--CA 1.506 2.34 0 O-C-N 121.829 -0.544 . . . . 0.0 111.455 179.916 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 252' ' ' VAL . . . . . . . . . . . . . 96.2 t 54.89 -87.07 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.507 2.389 0 O-C-N 121.212 -0.93 . . . . 0.0 110.783 -176.72 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 253' ' ' ASP . . . . . . . . . . . . . 74.6 m-20 52.03 48.34 22.94 Favored 'General case' 0 N--CA 1.506 2.352 0 O-C-N 121.091 -1.006 . . . . 0.0 111.055 -179.275 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 254' ' ' ALA . . . . . . . . . . . . . . . -67.92 -38.47 82.93 Favored 'General case' 0 N--CA 1.5 2.026 0 O-C-N 121.728 -0.608 . . . . 0.0 110.233 179.586 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 255' ' ' ASP . . . . . . . . . . . . . 9.6 m-20 -74.35 -26.01 59.87 Favored 'General case' 0 N--CA 1.499 1.985 0 O-C-N 121.724 -0.61 . . . . 0.0 110.759 -179.782 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 256' ' ' ALA . . . . . . . . . . . . . . . -63.0 -34.7 78.11 Favored 'General case' 0 N--CA 1.5 2.052 0 O-C-N 121.4 -0.813 . . . . 0.0 110.441 -179.959 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 257' ' ' SER . . . . . . . . . . . . . 23.6 m -56.73 -40.5 75.82 Favored 'General case' 0 N--CA 1.502 2.139 0 O-C-N 121.656 -0.652 . . . . 0.0 110.546 179.236 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 258' ' ' SER . . . . . . . . . . . . . 62.4 p -70.3 -31.79 69.27 Favored 'General case' 0 N--CA 1.498 1.973 0 C-N-CA 120.306 -0.558 . . . . 0.0 110.373 -179.265 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 259' ' ' GLN . . . . . . . . . . . . . 77.7 mt-30 -65.39 -34.87 79.32 Favored 'General case' 0 N--CA 1.501 2.085 0 O-C-N 121.597 -0.69 . . . . 0.0 110.361 -179.986 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 260' ' ' LEU . . . . . . . . . . . . . 82.7 mt -68.48 -40.93 80.75 Favored 'General case' 0 N--CA 1.499 2.018 0 O-C-N 121.661 -0.649 . . . . 0.0 110.19 179.878 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 261' ' ' LEU . . . . . . . . . . . . . 24.6 tp -69.81 -40.77 75.75 Favored 'General case' 0 N--CA 1.498 1.967 0 O-C-N 121.671 -0.643 . . . . 0.0 109.972 177.678 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 262' ' ' SER . . . . . . . . . . . . . 83.5 p -63.07 -33.85 76.34 Favored 'General case' 0 N--CA 1.501 2.081 0 O-C-N 121.678 -0.639 . . . . 0.0 110.462 177.64 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 263' ' ' LEU . . . . . . . . . . . . . 25.3 mt -65.3 -43.48 90.97 Favored 'General case' 0 N--CA 1.501 2.118 0 O-C-N 121.606 -0.684 . . . . 0.0 110.204 178.682 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 264' ' ' LEU . . . . . . . . . . . . . 81.4 mt -62.52 -35.12 78.4 Favored 'General case' 0 N--CA 1.502 2.137 0 O-C-N 121.673 -0.642 . . . . 0.0 110.467 178.564 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 265' ' ' LYS . . . . . . . . . . . . . 56.0 tttm -75.62 -38.12 59.2 Favored 'General case' 0 N--CA 1.498 1.967 0 O-C-N 121.786 -0.571 . . . . 0.0 110.239 -178.602 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 266' ' ' SER . . . . . . . . . . . . . 27.3 t -163.31 161.66 24.74 Favored 'General case' 0 N--CA 1.497 1.904 0 O-C-N 121.686 -0.634 . . . . 0.0 110.255 -178.674 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 267' ' ' SER . . . . . . . . . . . . . 93.3 p -118.87 157.48 27.56 Favored 'General case' 0 N--CA 1.495 1.798 0 O-C-N 121.702 -0.624 . . . . 0.0 110.145 179.703 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 268' ' ' THR . . . . . . . . . . . . . 23.6 m -65.53 -39.24 91.55 Favored 'General case' 0 N--CA 1.502 2.165 0 O-C-N 121.678 -0.639 . . . . 0.0 110.379 -179.498 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 269' ' ' ALA . . . . . . . . . . . . . . . 48.84 72.49 1.25 Allowed Pre-proline 0 N--CA 1.506 2.344 0 O-C-N 121.688 -0.633 . . . . 0.0 111.281 -178.934 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 270' ' ' PRO . . . . . . . . . . . . . 19.1 Cg_exo -62.48 151.89 80.44 Favored 'Trans proline' 0 N--CA 1.489 1.26 0 O-C-N 123.435 1.229 . . . . 0.0 110.639 179.585 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 271' ' ' SER . . . . . . . . . . . . . 88.7 p -65.92 -29.63 70.09 Favored 'General case' 0 N--CA 1.5 2.061 0 O-C-N 121.635 -0.665 . . . . 0.0 110.6 -179.942 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 272' ' ' ASP . . . . . . . . . . . . . 74.5 m-20 -67.8 150.3 48.8 Favored 'General case' 0 N--CA 1.5 2.048 0 O-C-N 121.601 -0.687 . . . . 0.0 110.203 -179.981 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 273' ' ' LEU . . . . . . . . . . . . . 21.3 tp -78.54 -33.63 47.71 Favored 'General case' 0 N--CA 1.498 1.953 0 O-C-N 121.659 -0.651 . . . . 0.0 110.096 -179.124 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 274' ' ' ALA . . . . . . . . . . . . . . . -165.58 149.48 8.23 Favored 'General case' 0 N--CA 1.497 1.894 0 O-C-N 121.55 -0.719 . . . . 0.0 110.134 -179.957 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 275' ' ' THR . . . . . . . . . . . . . 6.2 t -156.94 102.49 1.94 Allowed Pre-proline 0 N--CA 1.497 1.887 0 O-C-N 121.683 -0.636 . . . . 0.0 110.26 -179.676 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 276' ' ' PRO . . . . . . . . . . . . . 21.3 Cg_endo -65.52 138.06 53.14 Favored 'Trans proline' 0 N--CA 1.49 1.317 0 O-C-N 123.174 1.091 . . . . 0.0 110.52 -179.243 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 277' ' ' GLN . . . . . . . . . . . . . 29.4 mt-30 52.28 83.04 0.23 Allowed Pre-proline 0 N--CA 1.506 2.346 0 O-C-N 121.622 -0.674 . . . . 0.0 111.011 -179.842 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 278' ' ' PRO . . . . . . . . . . . . . 25.8 Cg_endo -66.44 -32.57 39.95 Favored 'Trans proline' 0 N--CA 1.489 1.207 0 O-C-N 123.528 1.278 . . . . 0.0 110.494 179.685 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 279' ' ' SER . . . . . . . . . . . . . 97.6 p -135.7 158.47 44.3 Favored 'General case' 0 N--CA 1.495 1.776 0 O-C-N 121.616 -0.678 . . . . 0.0 110.143 179.307 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 280' ' ' THR . . . . . . . . . . . . . 54.1 p -128.08 160.65 31.32 Favored 'General case' 0 N--CA 1.497 1.891 0 O-C-N 121.666 -0.646 . . . . 0.0 110.177 -179.673 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 281' ' ' PHE . . . . . . . . . . . . . 51.4 p90 -132.01 157.49 78.09 Favored Pre-proline 0 N--CA 1.495 1.795 0 O-C-N 121.639 -0.663 . . . . 0.0 110.199 179.649 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 282' ' ' PRO . . . . . . . . . . . . . 27.5 Cg_endo -67.08 142.02 59.93 Favored 'Trans proline' 0 N--CA 1.49 1.268 0 O-C-N 123.724 1.381 . . . . 0.0 110.33 179.92 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 283' ' ' GLN . . . . . . . . . . . . . 36.8 mt-30 -122.52 168.43 11.83 Favored Pre-proline 0 N--CA 1.495 1.802 0 O-C-N 121.656 -0.653 . . . . 0.0 110.197 -179.752 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 284' ' ' PRO . . . . . . . . . . . . . 17.8 Cg_exo -62.98 155.55 59.91 Favored 'Trans proline' 0 N--CA 1.489 1.25 0 O-C-N 123.636 1.334 . . . . 0.0 110.532 -179.965 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 285' ' ' PRO . . . . . . . . . . . . . 23.5 Cg_endo -65.95 -41.45 13.65 Favored 'Trans proline' 0 N--CA 1.488 1.189 0 O-C-N 123.561 1.295 . . . . 0.0 110.427 -179.227 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 286' ' ' VAL . . . . . . . . . . . . . 77.6 t -144.0 -67.52 0.1 Allowed 'Isoleucine or valine' 0 N--CA 1.497 1.879 0 O-C-N 121.713 -0.617 . . . . 0.0 109.694 179.369 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 287' ' ' GLU . . . . . . . . . . . . . 75.3 mt-10 -142.69 167.28 22.44 Favored 'General case' 0 N--CA 1.494 1.768 0 O-C-N 121.622 -0.674 . . . . 0.0 110.245 179.66 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 288' ' ' SER . . . . . . . . . . . . . 30.4 t -111.98 144.66 40.95 Favored 'General case' 0 N--CA 1.496 1.839 0 O-C-N 121.663 -0.648 . . . . 0.0 110.135 179.733 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 289' ' ' HIS . . . . . . . . . . . . . 59.1 t-80 -118.38 131.54 56.29 Favored 'General case' 0 N--CA 1.496 1.826 0 O-C-N 121.654 -0.654 . . . . 0.0 110.238 -179.509 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 290' ' ' SER . . . . . . . . . . . . . 50.4 m -121.83 148.09 45.13 Favored 'General case' 0 N--CA 1.497 1.898 0 O-C-N 121.767 -0.583 . . . . 0.0 110.209 179.625 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 291' ' ' SER . . . . . . . . . . . . . 57.6 p . . . . . 0 N--CA 1.495 1.776 0 CA-C-O 118.098 -0.953 . . . . 0.0 110.23 179.975 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' -1' ' ' MET . . . . . . . . . . . . . 61.2 mtt . . . . . 0 N--CA 1.493 1.684 0 CA-C-O 120.977 0.418 . . . . 0.0 110.151 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 0' ' ' GLY . . . . . . . . . . . . . . . -140.73 57.41 0.59 Allowed Glycine 0 N--CA 1.494 2.54 0 N-CA-C 109.5 -1.44 . . . . 0.0 109.5 -179.777 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 44.9 ttm -94.04 119.13 32.48 Favored 'General case' 0 N--CA 1.495 1.791 0 O-C-N 121.639 -0.918 . . . . 0.0 110.066 179.937 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 73.9 m -101.03 -178.97 3.91 Favored 'General case' 0 N--CA 1.496 1.87 0 O-C-N 121.709 -0.619 . . . . 0.0 110.435 -177.212 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 55.9 t -64.97 -27.95 43.63 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.165 0 O-C-N 121.707 -0.621 . . . . 0.0 110.408 -179.298 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -55.45 -31.39 61.91 Favored 'General case' 0 N--CA 1.504 2.234 0 O-C-N 121.418 -0.801 . . . . 0.0 110.515 -178.664 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 74.4 m-20 -68.5 -34.24 75.54 Favored 'General case' 0 N--CA 1.499 1.984 0 O-C-N 121.793 -0.567 . . . . 0.0 109.973 174.787 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 96.6 m-85 -97.5 10.12 40.64 Favored 'General case' 0 N--CA 1.496 1.867 0 O-C-N 121.732 -0.605 . . . . 0.0 111.246 178.931 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -67.41 127.95 34.61 Favored 'General case' 0 N--CA 1.501 2.09 0 O-C-N 121.223 -0.923 . . . . 0.0 110.162 -178.661 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 83.24 -2.11 87.58 Favored Glycine 0 N--CA 1.498 2.77 0 N-CA-C 110.851 -0.899 . . . . 0.0 110.851 -177.51 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 57.0 p -76.85 145.05 38.61 Favored 'General case' 0 N--CA 1.498 1.949 0 O-C-N 120.969 -1.312 . . . . 0.0 110.168 177.499 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 2.3 m-20 -85.21 119.27 25.41 Favored 'General case' 0 N--CA 1.496 1.87 0 O-C-N 121.644 -0.66 . . . . 0.0 109.598 174.785 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 32.9 m -142.44 159.84 19.42 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.846 0 O-C-N 121.69 -0.631 . . . . 0.0 109.754 179.885 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . 0.441 ' HA ' ' HA ' ' A' ' 22' ' ' ARG . 46.5 tt0 -109.4 128.94 55.52 Favored 'General case' 0 N--CA 1.494 1.731 0 C-N-CA 119.912 -0.715 . . . . 0.0 110.169 179.023 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 60.4 t -106.78 127.69 62.1 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.766 0 O-C-N 121.728 -0.608 . . . . 0.0 109.957 -179.289 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 29.0 tp -95.74 127.73 42.02 Favored 'General case' 0 N--CA 1.494 1.733 0 N-CA-C 109.125 -0.695 . . . . 0.0 109.125 173.776 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 83.8 mt -96.05 168.27 10.72 Favored 'General case' 0 N--CA 1.495 1.821 0 O-C-N 121.653 -0.654 . . . . 0.0 111.097 -172.846 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 24.2 p30 -57.89 -22.06 46.48 Favored 'General case' 0 N--CA 1.506 2.333 0 O-C-N 121.815 -0.553 . . . . 0.0 111.484 -178.537 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 25.1 p30 -91.29 22.36 3.91 Favored 'General case' 0 N--CA 1.499 1.996 0 O-C-N 121.586 -0.696 . . . . 0.0 111.078 -177.364 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 74.4 m-20 59.79 28.53 18.01 Favored 'General case' 0 N--CA 1.506 2.361 0 O-C-N 121.393 -0.817 . . . . 0.0 110.813 172.805 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 17.9 m -111.49 147.32 35.58 Favored 'General case' 0 N--CA 1.494 1.743 0 O-C-N 121.474 -0.766 . . . . 0.0 109.573 171.229 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 97.1 mttt -109.59 150.29 28.43 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.616 -0.677 . . . . 0.0 110.608 -177.248 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -153.01 154.15 34.35 Favored 'General case' 0 N--CA 1.496 1.867 0 O-C-N 121.824 -0.548 . . . . 0.0 109.999 176.188 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . 0.441 ' HA ' ' HA ' ' A' ' 12' ' ' GLU . 7.7 ptp85 -138.22 150.41 46.71 Favored 'General case' 0 N--CA 1.494 1.765 0 O-C-N 121.569 -0.707 . . . . 0.0 110.494 179.75 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -171.83 171.16 43.96 Favored Glycine 0 N--CA 1.492 2.383 0 N-CA-C 109.069 -1.613 . . . . 0.0 109.069 -178.958 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 40.6 t -94.48 125.39 47.1 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.912 0 O-C-N 121.676 -0.896 . . . . 0.0 109.082 176.156 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 45.7 mt -61.23 137.03 24.13 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.259 0 O-C-N 121.568 -0.707 . . . . 0.0 110.824 -171.554 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 10.0 p -121.15 -19.81 6.99 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.921 -0.487 . . . . 0.0 111.581 -178.25 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 11.2 t30 -165.74 158.14 14.97 Favored 'General case' 0 N--CA 1.504 2.268 0 O-C-N 120.886 -1.134 . . . . 0.0 111.937 176.517 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 77.2 t80 -150.34 119.99 7.0 Favored 'General case' 0 N--CA 1.496 1.853 0 N-CA-C 109.101 -0.703 . . . . 0.0 109.101 172.618 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 21.2 t70 -98.21 128.28 44.59 Favored 'General case' 0 N--CA 1.492 1.641 0 N-CA-C 109.248 -0.649 . . . . 0.0 109.248 -176.949 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 22.7 m -67.48 -47.97 68.51 Favored 'General case' 0 N--CA 1.498 1.956 0 O-C-N 121.578 -0.701 . . . . 0.0 110.661 -175.856 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 22.2 m -59.32 -45.49 91.2 Favored 'General case' 0 N--CA 1.502 2.164 0 O-C-N 121.591 -0.693 . . . . 0.0 110.897 -174.058 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 91.4 m-20 -105.53 -5.63 20.05 Favored 'General case' 0 N--CA 1.496 1.861 0 O-C-N 121.63 -0.669 . . . . 0.0 111.743 -177.973 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 58.7 m 49.42 67.18 0.93 Allowed 'General case' 0 N--CA 1.508 2.461 0 O-C-N 121.023 -1.048 . . . . 0.0 110.925 -174.277 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 44.5 mm -117.7 125.9 74.4 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.974 0 O-C-N 121.537 -0.727 . . . . 0.0 109.236 -175.407 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 11.0 tp -115.93 118.97 34.44 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.687 -0.633 . . . . 0.0 110.477 -170.539 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 78.2 mt-30 -91.51 133.34 35.59 Favored 'General case' 0 N--CA 1.49 1.537 0 N-CA-C 109.333 -0.617 . . . . 0.0 109.333 171.872 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 52.0 mt -117.84 123.55 46.17 Favored 'General case' 0 N--CA 1.493 1.684 0 C-N-CA 120.222 -0.591 . . . . 0.0 110.009 174.535 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 40.7 ttp180 -105.65 104.97 14.8 Favored 'General case' 0 N--CA 1.496 1.826 0 O-C-N 121.758 -0.589 . . . . 0.0 110.126 174.137 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 64.5 tp -83.59 156.53 22.7 Favored 'General case' 0 N--CA 1.499 1.982 0 O-C-N 121.64 -0.663 . . . . 0.0 110.616 -175.977 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -68.05 -3.03 8.88 Favored 'General case' 0 N--CA 1.502 2.166 0 O-C-N 121.898 -0.501 . . . . 0.0 112.208 -170.582 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 30.1 m120 -86.75 29.13 0.82 Allowed 'General case' 0 N--CA 1.499 1.986 0 O-C-N 121.104 -0.997 . . . . 0.0 110.782 173.734 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 73.1 m-20 60.76 31.54 20.1 Favored 'General case' 0 N--CA 1.506 2.332 0 O-C-N 121.213 -0.929 . . . . 0.0 110.278 175.728 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 67.0 m -125.76 138.62 53.86 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.447 -0.783 . . . . 0.0 109.981 177.33 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 9.1 t -128.21 147.26 50.57 Favored 'General case' 0 N--CA 1.496 1.85 0 O-C-N 121.652 -0.655 . . . . 0.0 109.988 179.511 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 7.6 tmtm? -150.63 135.93 17.84 Favored 'General case' 0 N--CA 1.495 1.794 0 O-C-N 121.666 -0.646 . . . . 0.0 110.439 -177.959 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 88.5 p -94.67 124.51 38.75 Favored 'General case' 0 N--CA 1.495 1.813 0 O-C-N 121.745 -0.597 . . . . 0.0 110.208 178.372 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 82.8 mt -129.32 133.92 64.69 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.894 0 O-C-N 121.687 -0.633 . . . . 0.0 109.356 179.238 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 63.6 t -81.88 127.74 39.33 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.925 0 C-N-CA 119.999 -0.68 . . . . 0.0 109.182 179.214 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 80.8 p -57.37 -25.06 58.87 Favored 'General case' 0 N--CA 1.506 2.37 0 O-C-N 121.474 -0.766 . . . . 0.0 111.927 -168.197 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 16.0 ttpp -56.8 -26.36 57.7 Favored 'General case' 0 N--CA 1.501 2.116 0 O-C-N 121.464 -0.773 . . . . 0.0 111.022 -177.126 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 5.0 p30 -84.83 6.13 25.88 Favored 'General case' 0 N--CA 1.498 1.946 0 C-N-CA 119.729 -0.788 . . . . 0.0 111.389 176.709 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 97.7 mt -75.67 126.73 36.74 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.144 0 O-C-N 121.151 -0.968 . . . . 0.0 109.909 176.095 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 76.3 tttt -93.13 -29.17 15.9 Favored 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.802 -0.561 . . . . 0.0 109.929 170.727 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 5.0 m-20 -163.71 154.86 16.32 Favored 'General case' 0 N--CA 1.501 2.075 0 O-C-N 121.723 -0.611 . . . . 0.0 110.112 -177.836 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 86.7 mt -132.99 148.22 52.27 Favored 'General case' 0 N--CA 1.497 1.886 0 O-C-N 121.667 -0.645 . . . . 0.0 110.507 -179.248 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 4.7 ptm180 -152.19 142.33 22.3 Favored 'General case' 0 N--CA 1.495 1.793 0 O-C-N 121.757 -0.589 . . . . 0.0 109.959 175.934 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 69.9 mt -85.07 133.14 30.04 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.86 0 O-C-N 121.495 -0.753 . . . . 0.0 109.678 172.575 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 40.6 mt -83.39 116.88 66.73 Favored Pre-proline 0 N--CA 1.497 1.905 0 O-C-N 121.496 -0.752 . . . . 0.0 110.204 -177.975 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 12.9 Cg_exo -66.7 159.46 51.04 Favored 'Trans proline' 0 N--CA 1.489 1.237 0 O-C-N 123.332 1.175 . . . . 0.0 110.207 177.001 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 77.6 tttt -63.22 -37.71 88.32 Favored 'General case' 0 N--CA 1.5 2.074 0 O-C-N 121.679 -0.638 . . . . 0.0 110.325 179.111 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 36.4 t30 -109.94 120.82 43.67 Favored 'General case' 0 N--CA 1.495 1.782 0 O-C-N 121.721 -0.612 . . . . 0.0 110.128 178.956 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 12.2 pt-20 -134.98 37.98 3.01 Favored 'General case' 0 N--CA 1.496 1.838 0 O-C-N 121.629 -0.669 . . . . 0.0 110.326 -179.614 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 18.6 tt -64.24 -30.56 50.44 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.07 0 O-C-N 121.633 -0.667 . . . . 0.0 110.602 -179.521 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 64' ' ' MET . . . . . . . . . . . . . 3.9 mtt -159.88 170.45 8.68 Favored Pre-proline 0 N--CA 1.495 1.8 0 O-C-N 121.618 -0.676 . . . . 0.0 110.12 -178.724 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 22.8 Cg_exo -60.87 -28.27 86.11 Favored 'Trans proline' 0 N--CA 1.491 1.363 0 O-C-N 123.677 1.356 . . . . 0.0 111.061 -179.772 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 92.6 mttt -81.88 145.25 30.46 Favored 'General case' 0 N--CA 1.498 1.931 0 O-C-N 121.569 -0.707 . . . . 0.0 110.212 -179.901 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 90.6 m-20 -64.38 -34.18 77.56 Favored 'General case' 0 N--CA 1.5 2.06 0 O-C-N 121.705 -0.622 . . . . 0.0 110.513 -179.183 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . -175.41 -175.17 42.62 Favored Glycine 0 N--CA 1.494 2.535 0 N-CA-C 109.577 -1.409 . . . . 0.0 109.577 -179.961 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 9.5 t -135.87 171.43 14.47 Favored 'General case' 0 N--CA 1.498 1.932 0 O-C-N 121.754 -0.85 . . . . 0.0 110.231 -179.813 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 39.0 ttpt -61.94 -35.64 79.03 Favored 'General case' 0 N--CA 1.501 2.121 0 O-C-N 121.645 -0.659 . . . . 0.0 110.429 179.855 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 98.8 p -123.81 79.55 56.69 Favored Pre-proline 0 N--CA 1.496 1.842 0 O-C-N 121.717 -0.614 . . . . 0.0 110.061 178.86 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 28.1 Cg_endo -67.12 143.57 65.73 Favored 'Trans proline' 0 N--CA 1.488 1.179 0 O-C-N 123.496 1.261 . . . . 0.0 110.437 -179.288 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 86.1 p -99.67 29.0 4.31 Favored 'General case' 0 N--CA 1.495 1.787 0 O-C-N 121.732 -0.605 . . . . 0.0 110.561 179.394 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 38.4 p -105.22 30.64 5.45 Favored 'General case' 0 N--CA 1.496 1.843 0 O-C-N 121.583 -0.698 . . . . 0.0 110.462 -179.004 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 89.4 m-20 53.32 44.27 30.32 Favored 'General case' 0 N--CA 1.505 2.311 0 O-C-N 121.493 -0.755 . . . . 0.0 110.865 179.597 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 22.8 t -64.02 -33.45 75.76 Favored 'General case' 0 N--CA 1.5 2.052 0 O-C-N 121.495 -0.753 . . . . 0.0 110.475 -179.941 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 24.2 m -66.0 -35.09 79.64 Favored 'General case' 0 N--CA 1.501 2.09 0 O-C-N 121.727 -0.608 . . . . 0.0 110.269 179.598 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 60.8 tttt -86.16 138.52 31.84 Favored 'General case' 0 N--CA 1.496 1.873 0 O-C-N 121.734 -0.604 . . . . 0.0 110.25 179.97 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 82.4 mt -90.67 151.05 21.42 Favored 'General case' 0 N--CA 1.498 1.926 0 O-C-N 121.63 -0.669 . . . . 0.0 110.136 -179.511 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 39.4 tttp -62.27 -33.29 74.35 Favored 'General case' 0 N--CA 1.502 2.163 0 O-C-N 121.73 -0.606 . . . . 0.0 110.464 -179.803 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 28.9 t -97.9 143.0 28.95 Favored 'General case' 0 N--CA 1.495 1.785 0 O-C-N 121.679 -0.638 . . . . 0.0 110.186 179.759 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -132.75 -167.95 1.99 Allowed 'General case' 0 N--CA 1.495 1.821 0 O-C-N 121.611 -0.681 . . . . 0.0 110.212 -179.168 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 74.8 mm-40 -94.51 158.49 15.52 Favored 'General case' 0 N--CA 1.495 1.797 0 O-C-N 121.738 -0.601 . . . . 0.0 110.22 -179.722 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 24.2 m -64.64 -35.81 82.23 Favored 'General case' 0 N--CA 1.501 2.096 0 O-C-N 121.653 -0.654 . . . . 0.0 110.355 -179.197 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 99.4 m-85 -113.36 133.68 55.02 Favored 'General case' 0 N--CA 1.495 1.798 0 O-C-N 121.625 -0.672 . . . . 0.0 110.232 -179.739 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 28.9 t -140.85 145.99 36.93 Favored 'General case' 0 N--CA 1.495 1.777 0 O-C-N 121.639 -0.663 . . . . 0.0 110.18 179.552 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 98.3 p -122.1 150.73 41.76 Favored 'General case' 0 N--CA 1.494 1.766 0 O-C-N 121.628 -0.67 . . . . 0.0 110.296 -179.92 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 98.6 mttt -126.79 147.21 50.02 Favored 'General case' 0 N--CA 1.496 1.828 0 O-C-N 121.7 -0.625 . . . . 0.0 110.078 179.418 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 29.9 m120 -104.38 103.51 13.25 Favored 'General case' 0 N--CA 1.494 1.766 0 O-C-N 121.628 -0.67 . . . . 0.0 110.248 -179.744 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 94.9 mttt -133.02 132.32 41.72 Favored 'General case' 0 N--CA 1.495 1.789 0 O-C-N 121.622 -0.674 . . . . 0.0 110.133 179.104 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 91' ' ' TRP . . . . . . . . . . . . . 87.3 t90 -126.78 125.04 41.05 Favored 'General case' 0 N--CA 1.495 1.798 0 O-C-N 121.662 -0.648 . . . . 0.0 110.233 179.678 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 29.0 t -146.1 137.48 24.73 Favored 'General case' 0 N--CA 1.495 1.814 0 O-C-N 121.704 -0.623 . . . . 0.0 110.224 179.271 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 93' ' ' MET . . . . . . . . . . . . . 74.4 mtm -66.86 -35.77 80.79 Favored 'General case' 0 N--CA 1.5 2.039 0 O-C-N 121.651 -0.656 . . . . 0.0 110.302 179.541 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 74.4 m-20 . . . . . 0 N--CA 1.505 2.308 0 CA-C-O 118.012 -0.994 . . . . 0.0 111.043 -179.91 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' B' B ' 240' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.326 0 N-CA-C 109.495 -1.442 . . . . 0.0 109.495 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' B' B ' 241' ' ' ALA . . . . . . . . . . . . . . . -142.26 151.35 41.98 Favored 'General case' 0 N--CA 1.495 1.79 0 O-C-N 121.66 -0.906 . . . . 0.0 110.201 179.841 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 242' ' ' THR . . . . . . . . . . . . . 9.8 t -137.56 156.41 48.13 Favored 'General case' 0 N--CA 1.496 1.865 0 O-C-N 121.698 -0.626 . . . . 0.0 110.452 -179.832 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 243' ' ' THR . . . . . . . . . . . . . 23.0 m -152.25 -61.16 0.16 Allowed 'General case' 0 N--CA 1.495 1.803 0 O-C-N 121.677 -0.639 . . . . 0.0 110.056 179.255 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 244' ' ' LYS . . . . . . . . . . . . . 54.1 mttp -104.24 29.03 6.3 Favored 'General case' 0 N--CA 1.496 1.826 0 O-C-N 121.705 -0.622 . . . . 0.0 110.477 179.312 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 245' ' ' GLU . . . . . . . . . . . . . 46.4 mt-10 -111.42 166.4 11.16 Favored 'General case' 0 N--CA 1.496 1.848 0 O-C-N 121.656 -0.652 . . . . 0.0 110.077 -179.453 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 246' ' ' LYS . . . . . . . . . . . . . 58.8 mttm 53.48 70.58 0.58 Allowed 'General case' 0 N--CA 1.504 2.246 0 O-C-N 121.587 -0.695 . . . . 0.0 110.841 179.809 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 247' ' ' ASN . . . . . . . . . . . . . 34.6 t30 -61.55 -32.32 72.39 Favored 'General case' 0 N--CA 1.503 2.175 0 O-C-N 121.544 -0.723 . . . . 0.0 110.611 -179.371 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 248' ' ' ILE . . . . . . . . . . . . . 80.6 mt 53.76 94.6 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.508 2.452 0 O-C-N 121.552 -0.717 . . . . 0.0 110.432 -179.87 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 249' ' ' SER . . . . . . . . . . . . . 66.5 m -79.79 -174.83 4.57 Favored 'General case' 0 N--CA 1.498 1.932 0 O-C-N 121.723 -0.61 . . . . 0.0 110.162 -179.759 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 250' ' ' VAL . . . . . . . . . . . . . 11.9 p -87.08 152.12 3.48 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.897 0 O-C-N 121.7 -0.625 . . . . 0.0 110.135 -179.623 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 251' ' ' ASP . . . . . . . . . . . . . 25.9 t0 53.18 35.13 19.08 Favored 'General case' 0 N--CA 1.506 2.335 0 O-C-N 121.674 -0.642 . . . . 0.0 110.921 -178.464 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 252' ' ' VAL . . . . . . . . . . . . . 32.8 m 36.73 36.45 0.15 Allowed 'Isoleucine or valine' 0 N--CA 1.514 2.768 0 N-CA-C 112.52 0.563 . . . . 0.0 112.52 179.325 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 253' ' ' ASP . . . . . . . . . . . . . 74.6 m-20 52.64 50.68 17.63 Favored 'General case' 0 N--CA 1.506 2.346 0 O-C-N 121.615 -0.678 . . . . 0.0 110.858 -179.878 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 254' ' ' ALA . . . . . . . . . . . . . . . -66.44 -29.62 69.79 Favored 'General case' 0 N--CA 1.5 2.042 0 O-C-N 121.635 -0.665 . . . . 0.0 110.616 -179.27 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 255' ' ' ASP . . . . . . . . . . . . . 74.5 m-20 -72.09 -31.47 66.1 Favored 'General case' 0 N--CA 1.498 1.958 0 O-C-N 121.575 -0.703 . . . . 0.0 110.289 -179.171 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 256' ' ' ALA . . . . . . . . . . . . . . . -64.67 -40.51 95.53 Favored 'General case' 0 N--CA 1.5 2.074 0 O-C-N 121.498 -0.751 . . . . 0.0 110.279 177.687 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 257' ' ' SER . . . . . . . . . . . . . 36.8 m -56.65 -38.43 72.17 Favored 'General case' 0 N--CA 1.503 2.195 0 O-C-N 121.683 -0.635 . . . . 0.0 110.659 179.92 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 258' ' ' SER . . . . . . . . . . . . . 59.8 p -69.85 -29.63 66.92 Favored 'General case' 0 N--CA 1.5 2.039 0 C-N-CA 120.268 -0.573 . . . . 0.0 110.468 -178.225 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 259' ' ' GLN . . . . . . . . . . . . . 98.8 mt-30 -64.0 -38.77 92.28 Favored 'General case' 0 N--CA 1.502 2.126 0 O-C-N 121.547 -0.721 . . . . 0.0 110.487 -179.698 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 260' ' ' LEU . . . . . . . . . . . . . 81.3 mt -67.77 -44.29 77.8 Favored 'General case' 0 N--CA 1.501 2.076 0 O-C-N 121.608 -0.682 . . . . 0.0 110.246 179.713 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 261' ' ' LEU . . . . . . . . . . . . . 22.8 tp -68.61 -35.94 78.0 Favored 'General case' 0 N--CA 1.497 1.899 0 O-C-N 121.652 -0.655 . . . . 0.0 109.799 176.778 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 262' ' ' SER . . . . . . . . . . . . . 23.0 t -62.3 -36.72 83.02 Favored 'General case' 0 N--CA 1.5 2.064 0 O-C-N 121.753 -0.592 . . . . 0.0 110.457 177.521 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 263' ' ' LEU . . . . . . . . . . . . . 23.2 mt -65.37 -46.05 81.68 Favored 'General case' 0 N--CA 1.501 2.109 0 O-C-N 121.703 -0.623 . . . . 0.0 110.099 179.582 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 264' ' ' LEU . . . . . . . . . . . . . 81.8 mt -63.53 -37.33 86.91 Favored 'General case' 0 N--CA 1.502 2.127 0 O-C-N 121.775 -0.578 . . . . 0.0 110.585 178.571 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 265' ' ' LYS . . . . . . . . . . . . . 51.3 tttm -76.42 -44.97 33.62 Favored 'General case' 0 N--CA 1.498 1.928 0 O-C-N 121.701 -0.624 . . . . 0.0 110.211 -177.683 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 266' ' ' SER . . . . . . . . . . . . . 85.6 p -79.82 149.66 30.95 Favored 'General case' 0 N--CA 1.496 1.849 0 O-C-N 121.676 -0.64 . . . . 0.0 110.26 -179.625 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 267' ' ' SER . . . . . . . . . . . . . 85.2 p -156.58 135.66 11.97 Favored 'General case' 0 N--CA 1.495 1.784 0 O-C-N 121.605 -0.684 . . . . 0.0 110.258 179.079 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 268' ' ' THR . . . . . . . . . . . . . 7.9 t -164.21 31.2 0.08 Allowed 'General case' 0 N--CA 1.498 1.957 0 O-C-N 121.699 -0.625 . . . . 0.0 110.222 178.76 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 269' ' ' ALA . . . . . . . . . . . . . . . 47.7 56.64 17.69 Favored Pre-proline 0 N--CA 1.505 2.325 0 O-C-N 121.774 -0.579 . . . . 0.0 111.179 -177.283 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 270' ' ' PRO . . . . . . . . . . . . . 28.7 Cg_endo -67.53 125.16 12.93 Favored 'Trans proline' 0 N--CA 1.487 1.145 0 O-C-N 123.532 1.28 . . . . 0.0 110.383 -178.789 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 271' ' ' SER . . . . . . . . . . . . . 49.5 m -130.31 144.7 51.54 Favored 'General case' 0 N--CA 1.495 1.777 0 O-C-N 121.677 -0.64 . . . . 0.0 110.213 179.05 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 272' ' ' ASP . . . . . . . . . . . . . 26.4 t0 -143.71 137.16 27.96 Favored 'General case' 0 N--CA 1.494 1.772 0 O-C-N 121.641 -0.662 . . . . 0.0 110.134 179.37 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 273' ' ' LEU . . . . . . . . . . . . . 82.8 mt 51.79 94.22 0.02 OUTLIER 'General case' 0 N--CA 1.506 2.342 0 O-C-N 121.61 -0.681 . . . . 0.0 111.092 -179.338 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 274' ' ' ALA . . . . . . . . . . . . . . . 50.76 -172.19 0.02 OUTLIER 'General case' 0 N--CA 1.505 2.313 0 O-C-N 121.604 -0.685 . . . . 0.0 111.186 -178.389 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 275' ' ' THR . . . . . . . . . . . . . 31.0 p -131.58 165.56 34.62 Favored Pre-proline 0 N--CA 1.496 1.837 0 O-C-N 121.747 -0.596 . . . . 0.0 110.252 -179.655 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 276' ' ' PRO . . . . . . . . . . . . . 20.3 Cg_exo -62.3 148.54 93.08 Favored 'Trans proline' 0 N--CA 1.49 1.275 0 O-C-N 123.656 1.345 . . . . 0.0 110.607 179.811 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 277' ' ' GLN . . . . . . . . . . . . . 22.7 mt-30 -97.48 158.92 32.3 Favored Pre-proline 0 N--CA 1.494 1.742 0 O-C-N 121.612 -0.68 . . . . 0.0 110.319 -179.845 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 278' ' ' PRO . . . . . . . . . . . . . 27.3 Cg_endo -66.8 151.1 83.08 Favored 'Trans proline' 0 N--CA 1.488 1.157 0 O-C-N 123.679 1.357 . . . . 0.0 110.424 -179.962 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 279' ' ' SER . . . . . . . . . . . . . 22.7 t -64.46 -32.98 74.83 Favored 'General case' 0 N--CA 1.501 2.092 0 O-C-N 121.691 -0.631 . . . . 0.0 110.436 179.898 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 280' ' ' THR . . . . . . . . . . . . . 24.6 m -114.47 139.59 49.41 Favored 'General case' 0 N--CA 1.496 1.845 0 O-C-N 121.699 -0.625 . . . . 0.0 110.029 179.824 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 281' ' ' PHE . . . . . . . . . . . . . 16.1 p90 -129.75 154.89 81.07 Favored Pre-proline 0 N--CA 1.496 1.872 0 O-C-N 121.731 -0.605 . . . . 0.0 110.249 -179.384 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 282' ' ' PRO . . . . . . . . . . . . . 36.3 Cg_endo -70.39 -50.76 0.37 Allowed 'Trans proline' 0 N--CA 1.487 1.116 0 O-C-N 123.728 1.383 . . . . 0.0 110.363 179.367 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 283' ' ' GLN . . . . . . . . . . . . . 16.2 mm100 -125.74 161.54 50.33 Favored Pre-proline 0 N--CA 1.496 1.858 0 O-C-N 121.732 -0.605 . . . . 0.0 110.163 -179.62 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 284' ' ' PRO . . . . . . . . . . . . . 27.5 Cg_endo -66.78 153.83 76.6 Favored 'Trans proline' 0 N--CA 1.488 1.186 0 O-C-N 123.682 1.359 . . . . 0.0 110.42 -178.878 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 285' ' ' PRO . . . . . . . . . . . . . 29.3 Cg_endo -67.67 150.28 79.37 Favored 'Trans proline' 0 N--CA 1.488 1.201 0 O-C-N 123.623 1.328 . . . . 0.0 110.421 -179.213 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 286' ' ' VAL . . . . . . . . . . . . . 61.0 t -111.9 135.04 52.43 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.925 0 O-C-N 121.634 -0.666 . . . . 0.0 109.608 179.098 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 287' ' ' GLU . . . . . . . . . . . . . 41.3 tt0 -66.31 -40.38 89.92 Favored 'General case' 0 N--CA 1.5 2.048 0 O-C-N 121.709 -0.619 . . . . 0.0 110.253 -178.786 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 288' ' ' SER . . . . . . . . . . . . . 49.0 m -130.4 142.29 50.52 Favored 'General case' 0 N--CA 1.496 1.862 0 O-C-N 121.647 -0.658 . . . . 0.0 110.206 179.486 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 289' ' ' HIS . . . . . . . . . . . . . 77.6 m80 -104.59 -33.28 8.57 Favored 'General case' 0 N--CA 1.495 1.777 0 O-C-N 121.76 -0.587 . . . . 0.0 110.278 179.004 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 290' ' ' SER . . . . . . . . . . . . . 23.4 m -66.02 -34.68 78.65 Favored 'General case' 0 N--CA 1.498 1.972 0 O-C-N 121.672 -0.642 . . . . 0.0 110.397 179.839 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 291' ' ' SER . . . . . . . . . . . . . 39.1 m . . . . . 0 N--CA 1.495 1.796 0 CA-C-O 118.031 -0.985 . . . . 0.0 110.217 -179.849 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' -1' ' ' MET . . . . . . . . . . . . . 74.0 mtm . . . . . 0 N--CA 1.493 1.696 0 CA-C-O 120.952 0.405 . . . . 0.0 110.219 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 0' ' ' GLY . . . . . . . . . . . . . . . -151.46 -176.13 23.95 Favored Glycine 0 N--CA 1.494 2.512 0 N-CA-C 109.608 -1.397 . . . . 0.0 109.608 -179.784 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 14.2 ptm -144.14 68.77 1.27 Allowed 'General case' 0 N--CA 1.496 1.845 0 O-C-N 121.717 -0.872 . . . . 0.0 110.232 -179.821 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 69.8 m -92.18 172.94 8.09 Favored 'General case' 0 N--CA 1.495 1.81 0 O-C-N 121.413 -0.805 . . . . 0.0 110.167 -179.033 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 65.7 t -66.45 -27.8 41.46 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.054 0 O-C-N 121.761 -0.587 . . . . 0.0 110.274 -179.368 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -55.3 -31.11 61.37 Favored 'General case' 0 N--CA 1.504 2.231 0 O-C-N 121.376 -0.828 . . . . 0.0 110.388 -179.033 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 9.7 m-20 -68.66 -31.13 70.04 Favored 'General case' 0 N--CA 1.499 1.985 0 O-C-N 121.821 -0.549 . . . . 0.0 110.222 174.647 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 96.4 m-85 -95.67 10.07 38.1 Favored 'General case' 0 N--CA 1.497 1.908 0 O-C-N 121.585 -0.697 . . . . 0.0 111.531 -178.955 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 3.3 m-30 -67.24 139.05 57.33 Favored 'General case' 0 N--CA 1.502 2.17 0 O-C-N 121.196 -0.94 . . . . 0.0 109.961 174.783 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 82.84 -0.32 89.68 Favored Glycine 0 N--CA 1.497 2.762 0 N-CA-C 110.602 -0.999 . . . . 0.0 110.602 -175.541 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 29.0 t -76.57 137.66 39.68 Favored 'General case' 0 N--CA 1.498 1.935 0 O-C-N 121.154 -1.204 . . . . 0.0 110.509 -179.991 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 2.4 m120 -84.14 115.59 22.48 Favored 'General case' 0 N--CA 1.498 1.97 0 O-C-N 121.684 -0.635 . . . . 0.0 109.418 174.143 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 35.7 m -141.89 162.45 20.11 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.725 0 O-C-N 121.699 -0.626 . . . . 0.0 109.769 -178.443 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . 0.416 ' HA ' ' HA ' ' A' ' 22' ' ' ARG . 47.0 tt0 -109.48 129.11 55.58 Favored 'General case' 0 N--CA 1.492 1.675 0 C-N-CA 119.914 -0.714 . . . . 0.0 110.012 177.933 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 61.7 t -106.66 126.53 62.5 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.655 0 O-C-N 121.614 -0.679 . . . . 0.0 109.838 -179.439 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 28.5 tp -95.86 126.63 41.25 Favored 'General case' 0 N--CA 1.493 1.703 0 N-CA-C 109.155 -0.683 . . . . 0.0 109.155 175.14 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 86.8 mt -96.39 167.11 11.37 Favored 'General case' 0 N--CA 1.496 1.836 0 O-C-N 121.587 -0.696 . . . . 0.0 111.076 -172.822 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 24.3 p30 -58.54 -21.81 53.6 Favored 'General case' 0 N--CA 1.504 2.263 0 O-C-N 121.82 -0.55 . . . . 0.0 111.685 -176.96 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 41.8 p-10 -92.76 23.51 4.09 Favored 'General case' 0 N--CA 1.497 1.924 0 O-C-N 121.531 -0.731 . . . . 0.0 110.899 -176.191 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 74.3 m-20 58.73 27.57 16.13 Favored 'General case' 0 N--CA 1.505 2.307 0 O-C-N 121.472 -0.767 . . . . 0.0 110.606 176.06 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 50.6 m -106.37 144.57 32.87 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.527 -0.733 . . . . 0.0 109.485 172.741 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 74.4 mttt -109.64 148.83 30.64 Favored 'General case' 0 N--CA 1.496 1.836 0 O-C-N 121.582 -0.699 . . . . 0.0 110.557 -176.305 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -153.05 153.56 33.1 Favored 'General case' 0 N--CA 1.496 1.869 0 O-C-N 121.717 -0.614 . . . . 0.0 110.248 176.123 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . 0.416 ' HA ' ' HA ' ' A' ' 12' ' ' GLU . 31.1 ptt180 -144.0 143.25 31.12 Favored 'General case' 0 N--CA 1.498 1.951 0 O-C-N 121.663 -0.648 . . . . 0.0 110.533 178.265 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -171.78 171.45 44.11 Favored Glycine 0 N--CA 1.494 2.51 0 N-CA-C 108.878 -1.689 . . . . 0.0 108.878 -174.986 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 39.5 t -94.54 118.37 40.42 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.916 0 O-C-N 121.468 -1.019 . . . . 0.0 109.382 -176.461 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 76.5 mt -63.72 143.27 15.81 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.122 0 O-C-N 121.657 -0.652 . . . . 0.0 110.442 -172.064 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 7.0 p -121.2 -27.76 4.83 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.733 -0.604 . . . . 0.0 111.283 -179.664 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 7.3 t-20 -161.94 158.25 24.98 Favored 'General case' 0 N--CA 1.499 2.012 0 C-N-CA 119.004 -1.078 . . . . 0.0 111.594 -177.622 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 77.1 t80 -150.1 126.71 10.92 Favored 'General case' 0 N--CA 1.498 1.936 0 N-CA-C 109.235 -0.654 . . . . 0.0 109.235 170.17 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 17.8 t70 -100.31 130.98 46.49 Favored 'General case' 0 N--CA 1.491 1.594 0 N-CA-C 109.095 -0.705 . . . . 0.0 109.095 -177.711 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 19.5 m -68.55 -48.69 63.62 Favored 'General case' 0 N--CA 1.498 1.975 0 C-N-CA 120.031 -0.668 . . . . 0.0 110.629 -175.703 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 25.2 m -59.49 -44.16 93.15 Favored 'General case' 0 N--CA 1.503 2.206 0 O-C-N 121.57 -0.706 . . . . 0.0 110.859 -174.078 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 29.6 m120 -103.88 -8.84 19.4 Favored 'General case' 0 N--CA 1.497 1.882 0 O-C-N 121.622 -0.674 . . . . 0.0 111.52 -178.164 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 16.1 m 49.46 67.22 0.92 Allowed 'General case' 0 N--CA 1.507 2.387 0 O-C-N 121.141 -0.974 . . . . 0.0 110.928 -174.381 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 45.8 mm -121.96 125.91 73.78 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.071 0 O-C-N 121.629 -0.669 . . . . 0.0 109.407 -175.679 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 7.3 tp -115.81 119.69 36.83 Favored 'General case' 0 N--CA 1.494 1.767 0 O-C-N 121.648 -0.658 . . . . 0.0 110.429 -168.847 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 98.9 mt-30 -90.98 134.25 34.63 Favored 'General case' 0 N--CA 1.49 1.544 0 C-N-CA 120.315 -0.554 . . . . 0.0 109.576 174.72 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 15.8 mt -117.79 123.83 46.91 Favored 'General case' 0 N--CA 1.495 1.787 0 O-C-N 121.939 -0.476 . . . . 0.0 109.966 174.72 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 74.4 ttt-85 -97.27 106.2 18.48 Favored 'General case' 0 N--CA 1.497 1.897 0 O-C-N 121.741 -0.6 . . . . 0.0 109.779 175.746 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 18.8 tp -84.72 152.06 23.98 Favored 'General case' 0 N--CA 1.495 1.777 0 O-C-N 121.678 -0.639 . . . . 0.0 110.877 -174.227 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -68.14 -3.55 10.84 Favored 'General case' 0 N--CA 1.502 2.146 0 O-C-N 121.928 -0.482 . . . . 0.0 111.982 -172.455 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 23.2 m120 -87.05 27.56 1.01 Allowed 'General case' 0 N--CA 1.498 1.941 0 O-C-N 121.07 -1.019 . . . . 0.0 110.923 173.545 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 14.8 t0 63.11 29.31 16.2 Favored 'General case' 0 N--CA 1.505 2.279 0 O-C-N 121.042 -1.036 . . . . 0.0 110.523 176.088 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 50.7 m -125.08 137.8 54.19 Favored 'General case' 0 N--CA 1.495 1.81 0 O-C-N 121.313 -0.867 . . . . 0.0 110.568 -179.267 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 9.8 t -98.11 151.04 20.8 Favored 'General case' 0 N--CA 1.496 1.845 0 O-C-N 121.817 -0.552 . . . . 0.0 110.208 175.362 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 33.6 ttmt -150.2 119.17 6.68 Favored 'General case' 0 N--CA 1.495 1.817 0 O-C-N 121.525 -0.734 . . . . 0.0 110.362 178.577 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 89.7 p -96.2 123.81 39.96 Favored 'General case' 0 N--CA 1.495 1.797 0 O-C-N 121.675 -0.64 . . . . 0.0 110.249 179.079 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 82.5 mt -129.4 135.89 60.62 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.887 0 N-CA-C 109.309 -0.626 . . . . 0.0 109.309 179.203 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 64.0 t -81.87 127.6 39.46 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.895 0 C-N-CA 120.032 -0.667 . . . . 0.0 109.265 179.358 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 39.0 p -59.17 -24.85 63.42 Favored 'General case' 0 N--CA 1.504 2.239 0 O-C-N 121.668 -0.645 . . . . 0.0 112.071 -169.744 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 63.4 tttt -56.46 -24.1 43.33 Favored 'General case' 0 N--CA 1.504 2.227 0 O-C-N 121.46 -0.775 . . . . 0.0 110.981 -176.824 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 46.5 p30 -83.91 2.52 38.22 Favored 'General case' 0 N--CA 1.499 1.987 0 O-C-N 121.468 -0.77 . . . . 0.0 111.281 176.598 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 98.8 mt -75.47 127.34 36.95 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.113 0 O-C-N 121.195 -0.941 . . . . 0.0 109.987 177.978 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 50.4 tttm -92.45 -29.79 16.07 Favored 'General case' 0 N--CA 1.494 1.739 0 O-C-N 121.871 -0.518 . . . . 0.0 109.652 170.506 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 5.3 m-20 -163.95 156.89 17.94 Favored 'General case' 0 N--CA 1.499 2.022 0 O-C-N 121.795 -0.566 . . . . 0.0 110.053 -178.141 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 84.3 mt -133.01 148.54 52.25 Favored 'General case' 0 N--CA 1.496 1.858 0 O-C-N 121.675 -0.641 . . . . 0.0 110.513 -179.376 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 6.5 ptm180 -151.94 143.04 23.2 Favored 'General case' 0 N--CA 1.495 1.812 0 O-C-N 121.673 -0.642 . . . . 0.0 110.046 176.006 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 68.7 mt -85.33 133.2 29.98 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.843 0 O-C-N 121.443 -0.786 . . . . 0.0 109.718 173.218 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 59.2 mt -83.84 146.72 49.9 Favored Pre-proline 0 N--CA 1.497 1.915 0 O-C-N 121.583 -0.698 . . . . 0.0 110.164 -179.021 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 42.3 Cg_endo -73.24 102.29 1.45 Allowed 'Trans proline' 0 N--CA 1.486 1.086 0 O-C-N 123.55 1.29 . . . . 0.0 110.3 179.805 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 72.5 mttt -133.36 131.28 39.88 Favored 'General case' 0 N--CA 1.496 1.846 0 O-C-N 121.667 -0.646 . . . . 0.0 110.206 179.531 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 16.5 t-20 -117.57 125.7 51.27 Favored 'General case' 0 N--CA 1.495 1.791 0 O-C-N 121.717 -0.615 . . . . 0.0 110.273 -179.666 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 27.7 tt0 -152.34 37.08 0.53 Allowed 'General case' 0 N--CA 1.495 1.817 0 O-C-N 121.7 -0.625 . . . . 0.0 109.967 179.516 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 51.0 mm -68.99 -34.92 66.55 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.064 0 O-C-N 121.62 -0.675 . . . . 0.0 109.811 -179.4 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 64' ' ' MET . . . . . . . . . . . . . 11.6 ttm 52.22 58.85 15.1 Favored Pre-proline 0 N--CA 1.505 2.324 0 O-C-N 121.606 -0.684 . . . . 0.0 110.797 -179.292 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 28.4 Cg_endo -67.07 -28.02 41.61 Favored 'Trans proline' 0 N--CA 1.489 1.253 0 O-C-N 123.564 1.297 . . . . 0.0 110.855 -178.657 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 79.0 mttt -61.62 -45.31 94.61 Favored 'General case' 0 N--CA 1.502 2.169 0 O-C-N 121.53 -0.731 . . . . 0.0 110.763 -177.208 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 24.9 m120 -68.66 -40.64 80.11 Favored 'General case' 0 N--CA 1.499 1.978 0 O-C-N 121.594 -0.691 . . . . 0.0 110.217 179.534 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 67.89 -138.67 33.52 Favored Glycine 0 N--CA 1.495 2.602 0 N-CA-C 109.739 -1.344 . . . . 0.0 109.739 179.431 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 8.6 t -136.62 32.74 2.74 Favored 'General case' 0 N--CA 1.498 1.967 0 O-C-N 121.69 -0.888 . . . . 0.0 110.252 179.16 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 40.9 tttm -93.41 123.46 36.73 Favored 'General case' 0 N--CA 1.495 1.82 0 O-C-N 121.7 -0.625 . . . . 0.0 110.18 -179.256 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 1.9 t -68.39 -56.79 9.73 Favored Pre-proline 0 N--CA 1.498 1.948 0 O-C-N 121.656 -0.652 . . . . 0.0 110.398 -179.534 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 30.3 Cg_endo -68.64 143.66 57.37 Favored 'Trans proline' 0 N--CA 1.489 1.222 0 O-C-N 123.171 1.09 . . . . 0.0 110.237 178.709 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 89.3 p -125.21 156.64 38.15 Favored 'General case' 0 N--CA 1.496 1.852 0 O-C-N 121.657 -0.652 . . . . 0.0 110.21 -179.594 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 24.0 m -82.77 137.92 34.19 Favored 'General case' 0 N--CA 1.496 1.856 0 O-C-N 121.591 -0.693 . . . . 0.0 110.02 179.294 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 29.9 m120 -101.57 115.35 30.32 Favored 'General case' 0 N--CA 1.496 1.839 0 O-C-N 121.679 -0.638 . . . . 0.0 110.234 -178.718 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 4.5 t -92.37 -31.47 15.32 Favored 'General case' 0 N--CA 1.496 1.852 0 O-C-N 121.678 -0.639 . . . . 0.0 110.289 178.854 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 47.1 p -66.82 -29.67 69.66 Favored 'General case' 0 N--CA 1.5 2.073 0 O-C-N 121.591 -0.693 . . . . 0.0 110.558 179.883 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 61.3 mttm -73.15 165.95 24.05 Favored 'General case' 0 N--CA 1.498 1.944 0 O-C-N 121.551 -0.718 . . . . 0.0 110.214 -179.865 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 8.5 tt -92.06 131.52 37.27 Favored 'General case' 0 N--CA 1.496 1.854 0 O-C-N 121.75 -0.594 . . . . 0.0 110.149 -178.449 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 38.1 ttpt -85.77 -62.62 1.48 Allowed 'General case' 0 N--CA 1.497 1.916 0 O-C-N 121.694 -0.629 . . . . 0.0 110.139 -179.336 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 48.1 m -122.6 142.35 50.74 Favored 'General case' 0 N--CA 1.496 1.841 0 O-C-N 121.684 -0.635 . . . . 0.0 110.088 179.916 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -106.27 130.22 54.16 Favored 'General case' 0 N--CA 1.494 1.725 0 O-C-N 121.675 -0.64 . . . . 0.0 110.333 -179.419 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 13.5 mm-40 -68.39 -33.45 74.26 Favored 'General case' 0 N--CA 1.499 2.0 0 O-C-N 121.69 -0.631 . . . . 0.0 110.121 178.697 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 40.7 p -121.43 168.86 11.22 Favored 'General case' 0 N--CA 1.496 1.85 0 O-C-N 121.711 -0.618 . . . . 0.0 110.066 179.484 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 53.0 p90 -114.9 141.02 48.5 Favored 'General case' 0 N--CA 1.497 1.886 0 O-C-N 121.686 -0.634 . . . . 0.0 110.276 -179.541 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 29.9 t -150.61 157.29 42.82 Favored 'General case' 0 N--CA 1.494 1.765 0 O-C-N 121.713 -0.617 . . . . 0.0 110.269 -179.833 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 48.6 m -117.53 144.77 44.76 Favored 'General case' 0 N--CA 1.496 1.857 0 O-C-N 121.703 -0.623 . . . . 0.0 110.205 179.747 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 52.7 mttp -125.59 147.68 49.2 Favored 'General case' 0 N--CA 1.496 1.832 0 O-C-N 121.683 -0.636 . . . . 0.0 110.255 179.781 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 29.6 m120 -101.25 29.0 4.97 Favored 'General case' 0 N--CA 1.496 1.86 0 O-C-N 121.667 -0.646 . . . . 0.0 110.549 179.816 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 23.3 tptp -130.84 129.4 42.29 Favored 'General case' 0 N--CA 1.496 1.865 0 O-C-N 121.605 -0.685 . . . . 0.0 110.005 -179.819 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 91' ' ' TRP . . . . . . . . . . . . . 98.7 m95 -111.04 134.31 52.74 Favored 'General case' 0 N--CA 1.495 1.811 0 O-C-N 121.738 -0.601 . . . . 0.0 110.313 -178.909 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 23.2 t -66.94 -37.39 84.23 Favored 'General case' 0 N--CA 1.499 2.017 0 O-C-N 121.66 -0.65 . . . . 0.0 110.25 179.512 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 93' ' ' MET . . . . . . . . . . . . . 49.9 ttm -131.72 148.43 52.58 Favored 'General case' 0 N--CA 1.495 1.79 0 O-C-N 121.672 -0.643 . . . . 0.0 110.183 -179.989 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 75.1 m-20 . . . . . 0 N--CA 1.495 1.775 0 CA-C-O 117.97 -1.014 . . . . 0.0 110.218 179.976 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' B' B ' 240' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.493 2.437 0 N-CA-C 109.478 -1.449 . . . . 0.0 109.478 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' B' B ' 241' ' ' ALA . . . . . . . . . . . . . . . -67.26 -33.88 76.24 Favored 'General case' 0 N--CA 1.5 2.067 0 O-C-N 121.687 -0.89 . . . . 0.0 110.247 -179.883 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 242' ' ' THR . . . . . . . . . . . . . 42.1 p -68.91 -42.62 76.61 Favored 'General case' 0 N--CA 1.499 2.023 0 O-C-N 121.686 -0.634 . . . . 0.0 110.182 -179.952 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 243' ' ' THR . . . . . . . . . . . . . 9.8 t -152.23 151.75 31.36 Favored 'General case' 0 N--CA 1.496 1.861 0 O-C-N 121.682 -0.636 . . . . 0.0 110.428 179.37 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 244' ' ' LYS . . . . . . . . . . . . . 21.7 pttm -141.35 175.81 9.36 Favored 'General case' 0 N--CA 1.497 1.881 0 O-C-N 121.724 -0.61 . . . . 0.0 110.285 178.534 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 245' ' ' GLU . . . . . . . . . . . . . 74.8 mm-40 -65.38 -32.25 73.79 Favored 'General case' 0 N--CA 1.5 2.053 0 O-C-N 121.71 -0.618 . . . . 0.0 110.515 -179.265 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 246' ' ' LYS . . . . . . . . . . . . . 56.2 mttm -90.06 166.91 13.15 Favored 'General case' 0 N--CA 1.496 1.853 0 O-C-N 121.654 -0.654 . . . . 0.0 110.224 -179.907 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 247' ' ' ASN . . . . . . . . . . . . . 56.6 t30 54.14 58.49 4.96 Favored 'General case' 0 N--CA 1.504 2.258 0 O-C-N 121.51 -0.744 . . . . 0.0 110.862 179.453 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 248' ' ' ILE . . . . . . . . . . . . . 82.0 mt -75.59 -33.01 25.77 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.02 0 O-C-N 121.436 -0.79 . . . . 0.0 109.664 -179.766 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 249' ' ' SER . . . . . . . . . . . . . 28.2 t -109.73 141.96 41.6 Favored 'General case' 0 N--CA 1.495 1.81 0 O-C-N 121.661 -0.65 . . . . 0.0 110.099 178.302 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 250' ' ' VAL . . . . . . . . . . . . . 29.4 m -149.64 156.65 7.04 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.011 0 O-C-N 121.687 -0.633 . . . . 0.0 110.084 -179.027 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 251' ' ' ASP . . . . . . . . . . . . . 74.5 m-20 52.27 39.2 26.64 Favored 'General case' 0 N--CA 1.506 2.342 0 O-C-N 121.716 -0.615 . . . . 0.0 110.97 -179.733 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 252' ' ' VAL . . . . . . . . . . . . . 14.3 p -80.54 127.22 39.58 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.917 0 O-C-N 121.618 -0.677 . . . . 0.0 110.213 179.361 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 253' ' ' ASP . . . . . . . . . . . . . 74.5 m-20 52.43 50.13 18.95 Favored 'General case' 0 N--CA 1.506 2.336 0 O-C-N 121.588 -0.695 . . . . 0.0 110.896 -179.996 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 254' ' ' ALA . . . . . . . . . . . . . . . -66.77 -35.99 81.37 Favored 'General case' 0 N--CA 1.499 2.003 0 O-C-N 121.563 -0.711 . . . . 0.0 110.276 -179.199 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 255' ' ' ASP . . . . . . . . . . . . . 19.3 t70 -73.42 -32.93 64.68 Favored 'General case' 0 N--CA 1.498 1.935 0 O-C-N 121.757 -0.589 . . . . 0.0 110.198 179.257 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 256' ' ' ALA . . . . . . . . . . . . . . . -63.93 -39.09 93.35 Favored 'General case' 0 N--CA 1.501 2.09 0 O-C-N 121.699 -0.626 . . . . 0.0 110.316 179.523 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 257' ' ' SER . . . . . . . . . . . . . 40.5 m -55.65 -35.98 66.55 Favored 'General case' 0 N--CA 1.504 2.248 0 O-C-N 121.656 -0.652 . . . . 0.0 110.373 177.908 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 258' ' ' SER . . . . . . . . . . . . . 25.3 m -69.29 -33.23 72.87 Favored 'General case' 0 N--CA 1.499 1.983 0 C-N-CA 120.423 -0.511 . . . . 0.0 110.272 179.855 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 259' ' ' GLN . . . . . . . . . . . . . 78.2 mt-30 -63.79 -36.99 85.7 Favored 'General case' 0 N--CA 1.501 2.084 0 O-C-N 121.628 -0.67 . . . . 0.0 110.43 -179.433 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 260' ' ' LEU . . . . . . . . . . . . . 82.7 mt -66.59 -42.66 86.63 Favored 'General case' 0 N--CA 1.5 2.072 0 O-C-N 121.639 -0.663 . . . . 0.0 110.231 179.556 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 261' ' ' LEU . . . . . . . . . . . . . 22.5 tp -70.43 -37.49 74.39 Favored 'General case' 0 N--CA 1.498 1.928 0 O-C-N 121.719 -0.613 . . . . 0.0 109.749 176.511 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 262' ' ' SER . . . . . . . . . . . . . 22.8 t -62.53 -36.92 84.14 Favored 'General case' 0 N--CA 1.5 2.051 0 O-C-N 121.771 -0.581 . . . . 0.0 110.443 176.896 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 263' ' ' LEU . . . . . . . . . . . . . 24.1 mt -64.6 -40.65 95.89 Favored 'General case' 0 N--CA 1.5 2.074 0 O-C-N 121.681 -0.637 . . . . 0.0 110.28 179.691 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 264' ' ' LEU . . . . . . . . . . . . . 86.7 mt -62.42 -38.62 90.4 Favored 'General case' 0 N--CA 1.502 2.168 0 O-C-N 121.68 -0.637 . . . . 0.0 110.418 178.474 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 265' ' ' LYS . . . . . . . . . . . . . 80.3 mttt -76.37 -39.16 54.53 Favored 'General case' 0 N--CA 1.498 1.928 0 C-N-CA 120.292 -0.563 . . . . 0.0 110.156 179.576 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 266' ' ' SER . . . . . . . . . . . . . 85.6 p -80.03 158.91 26.38 Favored 'General case' 0 N--CA 1.498 1.942 0 O-C-N 121.771 -0.581 . . . . 0.0 110.251 179.894 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 267' ' ' SER . . . . . . . . . . . . . 12.0 t -91.43 -33.86 15.07 Favored 'General case' 0 N--CA 1.496 1.862 0 O-C-N 121.687 -0.633 . . . . 0.0 110.26 178.906 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 268' ' ' THR . . . . . . . . . . . . . 66.1 p 46.01 -167.96 0.01 OUTLIER 'General case' 0 N--CA 1.509 2.511 0 CA-C-O 121.094 0.474 . . . . 0.0 111.732 179.431 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 269' ' ' ALA . . . . . . . . . . . . . . . 59.03 165.32 0.08 OUTLIER Pre-proline 0 N--CA 1.506 2.326 0 O-C-N 121.559 -0.713 . . . . 0.0 110.972 -178.867 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 270' ' ' PRO . . . . . . . . . . . . . 29.1 Cg_endo -69.33 -55.42 0.19 Allowed 'Trans proline' 0 N--CA 1.486 1.04 0 O-C-N 123.476 1.251 . . . . 0.0 110.356 179.045 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 271' ' ' SER . . . . . . . . . . . . . 87.0 p -156.64 166.13 34.29 Favored 'General case' 0 N--CA 1.495 1.777 0 O-C-N 121.665 -0.647 . . . . 0.0 110.199 179.873 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 272' ' ' ASP . . . . . . . . . . . . . 20.2 t0 -139.78 84.76 2.0 Allowed 'General case' 0 N--CA 1.495 1.775 0 O-C-N 121.716 -0.615 . . . . 0.0 110.127 178.972 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 273' ' ' LEU . . . . . . . . . . . . . 3.3 pp -162.89 -39.7 0.04 OUTLIER 'General case' 0 N--CA 1.498 1.947 0 O-C-N 121.531 -0.73 . . . . 0.0 110.896 -179.839 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 274' ' ' ALA . . . . . . . . . . . . . . . 51.37 94.68 0.02 OUTLIER 'General case' 0 N--CA 1.507 2.408 0 O-C-N 121.396 -0.815 . . . . 0.0 111.192 -179.221 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 275' ' ' THR . . . . . . . . . . . . . 28.2 p -76.71 161.26 74.73 Favored Pre-proline 0 N--CA 1.497 1.91 0 O-C-N 121.654 -0.654 . . . . 0.0 110.221 179.614 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 276' ' ' PRO . . . . . . . . . . . . . 25.8 Cg_endo -66.74 164.76 28.06 Favored 'Trans proline' 0 N--CA 1.488 1.148 0 O-C-N 123.571 1.301 . . . . 0.0 110.345 179.023 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 277' ' ' GLN . . . . . . . . . . . . . 27.4 mt-30 -89.17 108.85 26.78 Favored Pre-proline 0 N--CA 1.497 1.879 0 O-C-N 121.715 -0.615 . . . . 0.0 110.097 -179.775 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 278' ' ' PRO . . . . . . . . . . . . . 23.0 Cg_endo -65.61 141.99 69.06 Favored 'Trans proline' 0 N--CA 1.49 1.297 0 O-C-N 123.377 1.198 . . . . 0.0 110.466 -179.306 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 279' ' ' SER . . . . . . . . . . . . . 23.7 m -66.17 -32.72 74.32 Favored 'General case' 0 N--CA 1.5 2.052 0 O-C-N 121.731 -0.605 . . . . 0.0 110.448 179.803 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 280' ' ' THR . . . . . . . . . . . . . 24.3 m -64.11 -39.5 94.17 Favored 'General case' 0 N--CA 1.502 2.148 0 O-C-N 121.683 -0.636 . . . . 0.0 110.427 -178.899 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 281' ' ' PHE . . . . . . . . . . . . . 31.4 t80 -132.07 74.85 76.08 Favored Pre-proline 0 N--CA 1.495 1.807 0 O-C-N 121.615 -0.678 . . . . 0.0 110.208 -179.925 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 282' ' ' PRO . . . . . . . . . . . . . 16.5 Cg_exo -64.43 150.15 88.77 Favored 'Trans proline' 0 N--CA 1.489 1.256 0 O-C-N 123.49 1.258 . . . . 0.0 110.484 178.635 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 283' ' ' GLN . . . . . . . . . . . . . 1.5 mp0 -95.33 156.01 38.16 Favored Pre-proline 0 N--CA 1.495 1.803 0 O-C-N 121.709 -0.619 . . . . 0.0 110.234 179.539 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 284' ' ' PRO . . . . . . . . . . . . . 32.2 Cg_endo -69.21 115.1 3.85 Favored 'Trans proline' 0 N--CA 1.488 1.168 0 O-C-N 123.656 1.346 . . . . 0.0 110.155 179.745 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 285' ' ' PRO . . . . . . . . . . . . . 26.2 Cg_endo -66.17 149.96 85.25 Favored 'Trans proline' 0 N--CA 1.489 1.255 0 O-C-N 123.371 1.195 . . . . 0.0 110.478 179.206 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 286' ' ' VAL . . . . . . . . . . . . . 57.8 t -66.71 -39.34 83.49 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.114 0 O-C-N 121.709 -0.62 . . . . 0.0 109.83 -179.557 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 287' ' ' GLU . . . . . . . . . . . . . 78.4 mt-10 -111.27 155.84 22.4 Favored 'General case' 0 N--CA 1.496 1.862 0 O-C-N 121.684 -0.635 . . . . 0.0 110.115 179.683 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 288' ' ' SER . . . . . . . . . . . . . 49.1 m -117.57 146.42 43.62 Favored 'General case' 0 N--CA 1.494 1.763 0 O-C-N 121.669 -0.644 . . . . 0.0 110.185 -179.777 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 289' ' ' HIS . . . . . . . . . . . . . 56.7 t-80 -160.02 33.52 0.18 Allowed 'General case' 0 N--CA 1.494 1.761 0 O-C-N 121.723 -0.61 . . . . 0.0 110.236 -179.962 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 290' ' ' SER . . . . . . . . . . . . . 51.1 m -120.28 148.38 43.78 Favored 'General case' 0 N--CA 1.495 1.794 0 O-C-N 121.714 -0.616 . . . . 0.0 110.211 -179.791 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 291' ' ' SER . . . . . . . . . . . . . 27.3 t . . . . . 0 N--CA 1.494 1.767 0 CA-C-O 117.947 -1.025 . . . . 0.0 110.231 179.921 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' -1' ' ' MET . . . . . . . . . . . . . 73.9 mtm . . . . . 0 N--CA 1.493 1.7 0 CA-C-O 121.03 0.443 . . . . 0.0 110.154 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 0' ' ' GLY . . . . . . . . . . . . . . . -83.63 -171.09 47.28 Favored Glycine 0 N--CA 1.495 2.587 0 N-CA-C 109.447 -1.461 . . . . 0.0 109.447 179.87 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.6 mpp? -88.85 128.68 35.66 Favored 'General case' 0 N--CA 1.496 1.866 0 O-C-N 121.651 -0.911 . . . . 0.0 110.166 -179.98 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 69.5 m -101.03 165.84 11.11 Favored 'General case' 0 N--CA 1.495 1.791 0 O-C-N 121.71 -0.619 . . . . 0.0 110.263 -179.13 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 57.3 t -65.2 -27.99 43.48 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.164 0 O-C-N 121.702 -0.624 . . . . 0.0 110.194 179.192 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -55.19 -31.76 61.67 Favored 'General case' 0 N--CA 1.505 2.283 0 O-C-N 121.518 -0.739 . . . . 0.0 110.349 179.902 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 74.5 m-20 -68.64 -35.9 77.9 Favored 'General case' 0 N--CA 1.499 1.994 0 O-C-N 121.818 -0.551 . . . . 0.0 109.942 175.444 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 97.7 m-85 -97.67 10.0 41.12 Favored 'General case' 0 N--CA 1.497 1.892 0 O-C-N 121.708 -0.62 . . . . 0.0 111.217 178.877 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -67.41 128.63 37.15 Favored 'General case' 0 N--CA 1.501 2.082 0 O-C-N 121.257 -0.902 . . . . 0.0 110.061 179.048 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 82.24 -0.73 88.56 Favored Glycine 0 N--CA 1.497 2.716 0 N-CA-C 110.693 -0.963 . . . . 0.0 110.693 -175.794 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 30.4 t -76.61 136.67 39.21 Favored 'General case' 0 N--CA 1.497 1.883 0 O-C-N 120.989 -1.301 . . . . 0.0 110.4 177.794 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 14.3 t-20 -83.36 120.09 25.44 Favored 'General case' 0 N--CA 1.497 1.896 0 O-C-N 121.608 -0.683 . . . . 0.0 109.669 174.722 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 35.0 m -142.83 164.52 16.66 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.733 0 O-C-N 121.794 -0.567 . . . . 0.0 109.505 -178.824 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . 0.417 ' HA ' ' HA ' ' A' ' 22' ' ' ARG . 36.8 tt0 -109.36 128.85 55.43 Favored 'General case' 0 N--CA 1.493 1.697 0 C-N-CA 119.87 -0.732 . . . . 0.0 109.894 176.412 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 60.4 t -106.83 126.6 62.76 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.741 0 O-C-N 121.659 -0.65 . . . . 0.0 109.857 -179.285 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 24.1 tp -95.84 127.92 42.29 Favored 'General case' 0 N--CA 1.494 1.74 0 N-CA-C 109.263 -0.643 . . . . 0.0 109.263 175.483 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 83.6 mt -96.1 161.87 13.78 Favored 'General case' 0 N--CA 1.496 1.864 0 O-C-N 121.609 -0.682 . . . . 0.0 110.923 -173.466 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 24.2 p30 -57.81 -21.76 43.79 Favored 'General case' 0 N--CA 1.506 2.327 0 O-C-N 121.855 -0.528 . . . . 0.0 111.418 179.886 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 24.8 p30 -90.91 22.49 3.61 Favored 'General case' 0 N--CA 1.5 2.073 0 O-C-N 121.618 -0.676 . . . . 0.0 111.067 -177.717 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 74.3 m-20 60.26 29.01 18.65 Favored 'General case' 0 N--CA 1.506 2.346 0 O-C-N 121.356 -0.84 . . . . 0.0 110.807 172.561 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 23.8 m -110.79 143.8 40.76 Favored 'General case' 0 N--CA 1.495 1.798 0 O-C-N 121.472 -0.767 . . . . 0.0 109.551 170.838 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 34.2 mtpt -109.67 144.89 37.4 Favored 'General case' 0 N--CA 1.494 1.743 0 O-C-N 121.574 -0.704 . . . . 0.0 110.467 -176.69 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -153.09 157.93 41.14 Favored 'General case' 0 N--CA 1.497 1.905 0 O-C-N 121.8 -0.562 . . . . 0.0 110.145 177.081 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . 0.417 ' HA ' ' HA ' ' A' ' 12' ' ' GLU . 30.7 ptt180 -143.97 152.61 41.28 Favored 'General case' 0 N--CA 1.496 1.846 0 O-C-N 121.578 -0.701 . . . . 0.0 110.441 178.081 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -171.81 171.26 44.01 Favored Glycine 0 N--CA 1.494 2.503 0 N-CA-C 109.128 -1.589 . . . . 0.0 109.128 -179.075 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 43.9 t -94.64 126.06 47.14 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.918 0 O-C-N 121.59 -0.947 . . . . 0.0 109.288 176.619 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 50.9 mt -61.66 137.99 22.91 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.253 0 O-C-N 121.64 -0.663 . . . . 0.0 110.896 -170.805 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 13.7 p -121.19 -19.06 7.23 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.922 -0.486 . . . . 0.0 111.465 -179.82 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 9.9 t30 -166.15 158.8 14.65 Favored 'General case' 0 N--CA 1.503 2.222 0 O-C-N 120.917 -1.115 . . . . 0.0 111.751 176.046 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 65.0 t80 -150.32 124.96 9.69 Favored 'General case' 0 N--CA 1.495 1.818 0 N-CA-C 109.244 -0.651 . . . . 0.0 109.244 173.314 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 20.2 t70 -98.18 130.86 44.92 Favored 'General case' 0 N--CA 1.492 1.64 0 N-CA-C 109.004 -0.739 . . . . 0.0 109.004 -179.741 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 23.1 t -71.56 -53.76 12.71 Favored 'General case' 0 N--CA 1.498 1.956 0 C-N-CA 120.007 -0.677 . . . . 0.0 110.633 -175.845 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 22.9 m -61.93 -37.9 86.41 Favored 'General case' 0 N--CA 1.5 2.061 0 O-C-N 121.591 -0.693 . . . . 0.0 110.699 -175.819 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 91.5 m-20 -103.77 -9.85 18.74 Favored 'General case' 0 N--CA 1.498 1.942 0 O-C-N 121.746 -0.596 . . . . 0.0 111.66 -176.909 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 27.8 p 47.11 67.05 0.86 Allowed 'General case' 0 N--CA 1.508 2.434 0 O-C-N 121.408 -0.807 . . . . 0.0 111.202 -175.13 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 46.8 mm -121.36 125.8 74.15 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.964 0 O-C-N 121.642 -0.661 . . . . 0.0 109.236 -176.433 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 11.0 tp -116.57 120.47 38.81 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.746 -0.596 . . . . 0.0 110.468 -170.3 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 57.6 mt-30 -91.02 131.94 36.31 Favored 'General case' 0 N--CA 1.49 1.551 0 N-CA-C 109.061 -0.718 . . . . 0.0 109.061 170.659 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 50.6 mt -117.82 123.56 46.23 Favored 'General case' 0 N--CA 1.494 1.761 0 C-N-CA 120.121 -0.632 . . . . 0.0 110.007 175.723 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 70.3 ttt180 -105.63 105.08 14.95 Favored 'General case' 0 N--CA 1.495 1.788 0 O-C-N 121.821 -0.549 . . . . 0.0 110.144 173.928 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 65.2 tp -83.19 157.36 22.76 Favored 'General case' 0 N--CA 1.499 1.979 0 O-C-N 121.623 -0.673 . . . . 0.0 110.518 -176.657 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -67.57 -2.97 7.5 Favored 'General case' 0 N--CA 1.503 2.179 0 O-C-N 121.857 -0.527 . . . . 0.0 112.156 -170.822 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 30.1 m120 -86.25 29.06 0.78 Allowed 'General case' 0 N--CA 1.499 1.983 0 O-C-N 120.987 -1.07 . . . . 0.0 110.822 173.503 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 73.9 m-20 60.39 31.47 20.37 Favored 'General case' 0 N--CA 1.505 2.277 0 O-C-N 121.225 -0.922 . . . . 0.0 110.326 175.468 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 69.9 m -125.91 140.77 52.36 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.483 -0.761 . . . . 0.0 110.05 177.736 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 9.8 t -128.27 147.79 50.61 Favored 'General case' 0 N--CA 1.495 1.809 0 O-C-N 121.681 -0.637 . . . . 0.0 110.018 179.785 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 81.3 tttt -150.19 135.18 17.77 Favored 'General case' 0 N--CA 1.495 1.797 0 O-C-N 121.709 -0.619 . . . . 0.0 110.545 -178.106 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 89.5 p -94.78 121.03 35.95 Favored 'General case' 0 N--CA 1.495 1.806 0 O-C-N 121.798 -0.563 . . . . 0.0 110.142 177.85 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 81.3 mt -129.25 137.29 57.4 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.868 0 O-C-N 121.671 -0.643 . . . . 0.0 109.325 -179.956 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 60.5 t -81.53 127.78 39.28 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.846 0 O-C-N 121.566 -0.709 . . . . 0.0 109.219 179.117 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 44.3 p -58.33 -29.7 66.14 Favored 'General case' 0 N--CA 1.503 2.2 0 O-C-N 121.459 -0.776 . . . . 0.0 111.672 -170.504 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -58.56 -27.23 64.37 Favored 'General case' 0 N--CA 1.5 2.045 0 O-C-N 121.562 -0.711 . . . . 0.0 111.315 -173.261 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 4.6 p30 -82.41 0.86 40.1 Favored 'General case' 0 N--CA 1.497 1.884 0 C-N-CA 119.502 -0.879 . . . . 0.0 111.113 176.932 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 76.1 mt -79.45 132.18 32.6 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.096 0 O-C-N 121.167 -0.958 . . . . 0.0 109.923 175.649 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 23.5 ttmt -92.42 -24.32 18.89 Favored 'General case' 0 N--CA 1.494 1.746 0 C-N-CA 120.427 -0.509 . . . . 0.0 110.22 173.278 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -164.08 152.43 13.06 Favored 'General case' 0 N--CA 1.501 2.125 0 O-C-N 121.502 -0.749 . . . . 0.0 110.489 -175.949 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 4.7 mp -132.92 152.35 51.91 Favored 'General case' 0 N--CA 1.495 1.818 0 O-C-N 121.725 -0.609 . . . . 0.0 110.364 178.494 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 19.8 ptp180 -151.84 146.15 25.47 Favored 'General case' 0 N--CA 1.496 1.842 0 O-C-N 121.636 -0.665 . . . . 0.0 109.926 175.081 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 57.5 mt -87.09 133.23 30.54 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.871 0 O-C-N 121.483 -0.761 . . . . 0.0 110.0 174.092 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 78.1 mt -83.94 137.41 40.65 Favored Pre-proline 0 N--CA 1.497 1.886 0 O-C-N 121.537 -0.727 . . . . 0.0 110.018 -179.785 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 46.0 Cg_endo -74.34 99.21 1.18 Allowed 'Trans proline' 0 N--CA 1.486 1.069 0 O-C-N 123.434 1.228 . . . . 0.0 110.259 179.211 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 42.6 tptt -137.38 126.32 24.2 Favored 'General case' 0 N--CA 1.495 1.81 0 O-C-N 121.723 -0.611 . . . . 0.0 110.234 -179.466 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 89.6 m-20 53.36 41.75 32.09 Favored 'General case' 0 N--CA 1.506 2.34 0 O-C-N 121.628 -0.67 . . . . 0.0 110.973 178.235 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 45.9 tt0 -66.78 -38.26 86.2 Favored 'General case' 0 N--CA 1.501 2.08 0 O-C-N 121.563 -0.711 . . . . 0.0 110.223 179.943 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 51.6 mm -71.15 -39.28 73.54 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.033 0 O-C-N 121.581 -0.699 . . . . 0.0 109.71 179.785 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 64' ' ' MET . . . . . . . . . . . . . 8.6 tpt 51.57 57.72 16.39 Favored Pre-proline 0 N--CA 1.505 2.292 0 O-C-N 121.627 -0.671 . . . . 0.0 110.989 -179.284 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 28.6 Cg_endo -67.42 141.51 56.3 Favored 'Trans proline' 0 N--CA 1.488 1.181 0 O-C-N 123.503 1.265 . . . . 0.0 110.418 -179.664 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 97.3 mttt -127.08 143.96 51.15 Favored 'General case' 0 N--CA 1.495 1.802 0 O-C-N 121.727 -0.608 . . . . 0.0 110.151 179.131 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 38.7 p-10 -122.37 31.98 5.95 Favored 'General case' 0 N--CA 1.497 1.878 0 O-C-N 121.705 -0.622 . . . . 0.0 110.518 -179.539 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . -156.38 91.96 0.12 Allowed Glycine 0 N--CA 1.494 2.553 0 N-CA-C 109.572 -1.411 . . . . 0.0 109.572 -179.854 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 24.7 m -125.92 137.86 53.74 Favored 'General case' 0 N--CA 1.495 1.789 0 O-C-N 121.648 -0.913 . . . . 0.0 110.114 179.358 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 93.4 mttt -112.97 142.14 46.0 Favored 'General case' 0 N--CA 1.497 1.876 0 O-C-N 121.669 -0.644 . . . . 0.0 110.207 179.856 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 2.3 t -128.34 80.66 72.0 Favored Pre-proline 0 N--CA 1.495 1.798 0 O-C-N 121.748 -0.595 . . . . 0.0 110.074 179.468 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 27.5 Cg_endo -66.7 -33.08 36.24 Favored 'Trans proline' 0 N--CA 1.488 1.187 0 O-C-N 123.513 1.27 . . . . 0.0 110.517 -179.602 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 49.6 m -122.52 147.24 46.6 Favored 'General case' 0 N--CA 1.496 1.853 0 O-C-N 121.695 -0.628 . . . . 0.0 110.204 -179.911 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 24.2 m -66.52 -38.75 87.86 Favored 'General case' 0 N--CA 1.499 2.019 0 O-C-N 121.649 -0.657 . . . . 0.0 110.277 179.818 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 29.8 m120 -108.7 125.04 51.46 Favored 'General case' 0 N--CA 1.496 1.835 0 O-C-N 121.622 -0.674 . . . . 0.0 110.112 179.728 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 3.0 m -138.65 33.53 2.23 Favored 'General case' 0 N--CA 1.494 1.773 0 O-C-N 121.683 -0.636 . . . . 0.0 110.258 179.853 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 24.4 m -120.24 138.66 53.53 Favored 'General case' 0 N--CA 1.495 1.813 0 O-C-N 121.657 -0.652 . . . . 0.0 110.183 -179.709 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 98.0 mttt -122.72 149.16 44.45 Favored 'General case' 0 N--CA 1.495 1.815 0 O-C-N 121.687 -0.633 . . . . 0.0 110.241 -179.933 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 83.4 mt -92.41 150.55 20.74 Favored 'General case' 0 N--CA 1.497 1.914 0 O-C-N 121.746 -0.596 . . . . 0.0 110.103 179.518 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 17.3 ttmm -62.61 -39.19 93.0 Favored 'General case' 0 N--CA 1.503 2.176 0 O-C-N 121.673 -0.642 . . . . 0.0 110.586 -178.747 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 89.3 p -130.12 142.56 50.58 Favored 'General case' 0 N--CA 1.495 1.813 0 O-C-N 121.639 -0.663 . . . . 0.0 110.33 179.756 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -162.47 149.2 13.22 Favored 'General case' 0 N--CA 1.495 1.821 0 O-C-N 121.691 -0.631 . . . . 0.0 110.061 178.821 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 42.3 tt0 -160.28 -63.97 0.07 Allowed 'General case' 0 N--CA 1.495 1.776 0 O-C-N 121.688 -0.633 . . . . 0.0 110.258 179.269 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 9.9 t -147.03 163.87 34.83 Favored 'General case' 0 N--CA 1.496 1.855 0 O-C-N 121.599 -0.688 . . . . 0.0 110.462 -178.494 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 36.8 t80 57.74 167.22 0.04 OUTLIER 'General case' 0 N--CA 1.507 2.38 0 O-C-N 121.712 -0.618 . . . . 0.0 111.045 -179.864 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 9.6 t -119.5 145.86 45.95 Favored 'General case' 0 N--CA 1.495 1.797 0 O-C-N 121.539 -0.726 . . . . 0.0 110.222 179.82 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 24.2 t -93.24 169.44 10.39 Favored 'General case' 0 N--CA 1.496 1.826 0 O-C-N 121.75 -0.594 . . . . 0.0 110.33 -178.717 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 49.5 mttp 54.53 39.71 31.31 Favored 'General case' 0 N--CA 1.505 2.297 0 O-C-N 121.682 -0.636 . . . . 0.0 110.961 178.937 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 55.1 m-20 -130.37 34.36 4.19 Favored 'General case' 0 N--CA 1.494 1.764 0 O-C-N 121.655 -0.653 . . . . 0.0 110.191 178.81 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 88.1 mttt -87.14 142.21 28.08 Favored 'General case' 0 N--CA 1.497 1.903 0 O-C-N 121.652 -0.655 . . . . 0.0 110.166 -179.368 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 91' ' ' TRP . . . . . . . . . . . . . 60.6 t-105 -64.63 -35.04 79.72 Favored 'General case' 0 N--CA 1.501 2.089 0 O-C-N 121.721 -0.612 . . . . 0.0 110.455 -179.857 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 27.7 m -63.56 -33.81 76.41 Favored 'General case' 0 N--CA 1.503 2.181 0 O-C-N 121.715 -0.615 . . . . 0.0 110.474 -179.237 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 93' ' ' MET . . . . . . . . . . . . . 88.7 mmm -103.27 148.28 26.02 Favored 'General case' 0 N--CA 1.495 1.81 0 O-C-N 121.736 -0.602 . . . . 0.0 110.156 -179.977 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 20.4 t70 . . . . . 0 N--CA 1.495 1.784 0 CA-C-O 118.027 -0.987 . . . . 0.0 110.129 -179.567 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' B' B ' 240' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.343 0 N-CA-C 109.599 -1.4 . . . . 0.0 109.599 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' B' B ' 241' ' ' ALA . . . . . . . . . . . . . . . -105.48 148.31 27.35 Favored 'General case' 0 N--CA 1.494 1.757 0 O-C-N 121.63 -0.923 . . . . 0.0 110.265 -179.937 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 242' ' ' THR . . . . . . . . . . . . . 24.8 m -114.35 132.43 56.2 Favored 'General case' 0 N--CA 1.495 1.807 0 O-C-N 121.642 -0.661 . . . . 0.0 110.081 179.834 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 243' ' ' THR . . . . . . . . . . . . . 23.5 m -68.79 -42.15 77.75 Favored 'General case' 0 N--CA 1.498 1.933 0 O-C-N 121.604 -0.685 . . . . 0.0 110.246 -179.757 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 244' ' ' LYS . . . . . . . . . . . . . 72.5 mttt -133.04 145.12 50.53 Favored 'General case' 0 N--CA 1.496 1.86 0 O-C-N 121.639 -0.663 . . . . 0.0 110.223 -179.395 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 245' ' ' GLU . . . . . . . . . . . . . 51.0 mt-10 -112.87 133.89 54.64 Favored 'General case' 0 N--CA 1.496 1.836 0 O-C-N 121.667 -0.645 . . . . 0.0 110.119 178.992 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 246' ' ' LYS . . . . . . . . . . . . . 58.8 mttm -89.08 -32.92 17.31 Favored 'General case' 0 N--CA 1.497 1.919 0 O-C-N 121.672 -0.643 . . . . 0.0 110.287 179.86 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 247' ' ' ASN . . . . . . . . . . . . . 90.6 m-20 -66.48 -34.54 78.15 Favored 'General case' 0 N--CA 1.5 2.066 0 O-C-N 121.588 -0.695 . . . . 0.0 110.307 179.822 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 248' ' ' ILE . . . . . . . . . . . . . 47.5 mm 57.87 164.33 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.509 2.518 0 O-C-N 121.777 -0.577 . . . . 0.0 110.773 -178.729 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 249' ' ' SER . . . . . . . . . . . . . 54.6 p -121.8 148.98 43.98 Favored 'General case' 0 N--CA 1.495 1.801 0 O-C-N 121.499 -0.751 . . . . 0.0 110.236 -179.963 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 250' ' ' VAL . . . . . . . . . . . . . 26.1 m -151.58 -169.5 0.12 Allowed 'Isoleucine or valine' 0 N--CA 1.5 2.061 0 O-C-N 121.687 -0.633 . . . . 0.0 110.118 -178.631 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 251' ' ' ASP . . . . . . . . . . . . . 9.9 m-20 54.08 43.99 29.91 Favored 'General case' 0 N--CA 1.505 2.278 0 O-C-N 121.609 -0.682 . . . . 0.0 111.178 178.063 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 252' ' ' VAL . . . . . . . . . . . . . 43.0 t 58.64 165.84 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.51 2.54 0 O-C-N 121.66 -0.65 . . . . 0.0 110.747 177.593 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 253' ' ' ASP . . . . . . . . . . . . . 74.5 m-20 53.26 48.59 21.73 Favored 'General case' 0 N--CA 1.506 2.347 0 O-C-N 121.534 -0.729 . . . . 0.0 110.812 178.9 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 254' ' ' ALA . . . . . . . . . . . . . . . -67.66 -47.4 69.62 Favored 'General case' 0 N--CA 1.498 1.958 0 O-C-N 121.698 -0.626 . . . . 0.0 110.36 -178.635 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 255' ' ' ASP . . . . . . . . . . . . . 74.4 m-20 -74.04 -35.39 64.32 Favored 'General case' 0 N--CA 1.499 1.993 0 O-C-N 121.7 -0.625 . . . . 0.0 110.293 -178.564 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 256' ' ' ALA . . . . . . . . . . . . . . . -63.88 -45.06 91.09 Favored 'General case' 0 N--CA 1.5 2.046 0 O-C-N 121.665 -0.647 . . . . 0.0 110.355 -179.35 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 257' ' ' SER . . . . . . . . . . . . . 33.7 m -55.68 -35.31 65.89 Favored 'General case' 0 N--CA 1.502 2.17 0 O-C-N 121.586 -0.696 . . . . 0.0 110.487 177.745 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 258' ' ' SER . . . . . . . . . . . . . 22.6 t -69.67 -32.82 71.69 Favored 'General case' 0 N--CA 1.498 1.932 0 O-C-N 121.862 -0.524 . . . . 0.0 110.419 -179.401 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 259' ' ' GLN . . . . . . . . . . . . . 99.5 mt-30 -63.22 -37.96 89.29 Favored 'General case' 0 N--CA 1.501 2.082 0 O-C-N 121.57 -0.706 . . . . 0.0 110.634 -178.442 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 260' ' ' LEU . . . . . . . . . . . . . 84.1 mt -69.43 -41.72 75.94 Favored 'General case' 0 N--CA 1.499 1.981 0 O-C-N 121.535 -0.728 . . . . 0.0 110.296 179.915 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 261' ' ' LEU . . . . . . . . . . . . . 32.8 tp -70.26 -40.21 74.53 Favored 'General case' 0 N--CA 1.496 1.872 0 O-C-N 121.572 -0.705 . . . . 0.0 109.915 177.83 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 262' ' ' SER . . . . . . . . . . . . . 86.8 p -63.18 -35.9 81.85 Favored 'General case' 0 N--CA 1.5 2.06 0 O-C-N 121.675 -0.64 . . . . 0.0 110.484 177.374 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 263' ' ' LEU . . . . . . . . . . . . . 25.2 mt -65.7 -41.39 92.42 Favored 'General case' 0 N--CA 1.499 2.005 0 O-C-N 121.631 -0.668 . . . . 0.0 110.456 179.214 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 264' ' ' LEU . . . . . . . . . . . . . 49.5 mt -62.44 -35.87 80.62 Favored 'General case' 0 N--CA 1.502 2.127 0 O-C-N 121.71 -0.618 . . . . 0.0 110.515 178.841 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 265' ' ' LYS . . . . . . . . . . . . . 84.7 tttt -75.88 -45.06 37.47 Favored 'General case' 0 N--CA 1.498 1.947 0 O-C-N 121.642 -0.662 . . . . 0.0 109.988 179.753 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 266' ' ' SER . . . . . . . . . . . . . 85.1 p -82.4 59.16 4.44 Favored 'General case' 0 N--CA 1.497 1.914 0 O-C-N 121.672 -0.642 . . . . 0.0 110.338 178.536 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 267' ' ' SER . . . . . . . . . . . . . 36.2 m -96.73 -65.05 0.99 Allowed 'General case' 0 N--CA 1.495 1.812 0 O-C-N 121.446 -0.784 . . . . 0.0 110.328 -178.555 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 268' ' ' THR . . . . . . . . . . . . . 38.1 p -88.97 -33.15 17.32 Favored 'General case' 0 N--CA 1.497 1.883 0 O-C-N 121.751 -0.593 . . . . 0.0 110.419 -179.269 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 269' ' ' ALA . . . . . . . . . . . . . . . 48.7 62.96 11.2 Favored Pre-proline 0 N--CA 1.507 2.381 0 O-C-N 121.696 -0.627 . . . . 0.0 111.166 -178.348 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 270' ' ' PRO . . . . . . . . . . . . . 29.6 Cg_endo -67.73 148.76 78.13 Favored 'Trans proline' 0 N--CA 1.487 1.143 0 O-C-N 123.555 1.292 . . . . 0.0 110.423 -179.141 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 271' ' ' SER . . . . . . . . . . . . . 73.5 m -94.37 18.74 10.6 Favored 'General case' 0 N--CA 1.497 1.881 0 O-C-N 121.73 -0.606 . . . . 0.0 111.066 179.073 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 272' ' ' ASP . . . . . . . . . . . . . 74.6 m-20 -101.06 31.31 3.68 Favored 'General case' 0 N--CA 1.495 1.819 0 O-C-N 121.306 -0.871 . . . . 0.0 110.317 -179.893 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 273' ' ' LEU . . . . . . . . . . . . . 22.5 tp 59.65 -79.86 0.02 OUTLIER 'General case' 0 N--CA 1.506 2.339 0 O-C-N 121.918 -0.489 . . . . 0.0 111.076 -177.966 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 274' ' ' ALA . . . . . . . . . . . . . . . -166.66 159.74 14.34 Favored 'General case' 0 N--CA 1.498 1.974 0 O-C-N 121.17 -0.956 . . . . 0.0 110.14 -178.509 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 275' ' ' THR . . . . . . . . . . . . . 20.9 m -121.9 81.96 42.61 Favored Pre-proline 0 N--CA 1.496 1.834 0 O-C-N 121.738 -0.601 . . . . 0.0 110.06 178.841 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 276' ' ' PRO . . . . . . . . . . . . . 27.6 Cg_endo -67.05 146.22 76.26 Favored 'Trans proline' 0 N--CA 1.488 1.153 0 O-C-N 123.481 1.253 . . . . 0.0 110.482 -178.509 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 277' ' ' GLN . . . . . . . . . . . . . 13.7 tt0 52.56 57.82 15.04 Favored Pre-proline 0 N--CA 1.505 2.314 0 O-C-N 121.699 -0.626 . . . . 0.0 111.041 179.151 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 278' ' ' PRO . . . . . . . . . . . . . 36.0 Cg_endo -70.4 107.45 1.98 Allowed 'Trans proline' 0 N--CA 1.487 1.093 0 O-C-N 123.475 1.25 . . . . 0.0 110.169 178.175 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 279' ' ' SER . . . . . . . . . . . . . 50.5 m -126.31 141.43 51.91 Favored 'General case' 0 N--CA 1.495 1.781 0 O-C-N 121.631 -0.668 . . . . 0.0 110.318 -179.727 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 280' ' ' THR . . . . . . . . . . . . . 25.0 m -133.67 136.26 44.62 Favored 'General case' 0 N--CA 1.495 1.798 0 O-C-N 121.743 -0.598 . . . . 0.0 110.157 178.651 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 281' ' ' PHE . . . . . . . . . . . . . 51.1 m-85 -145.18 154.15 53.7 Favored Pre-proline 0 N--CA 1.495 1.779 0 O-C-N 121.617 -0.677 . . . . 0.0 110.254 179.856 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 282' ' ' PRO . . . . . . . . . . . . . 32.6 Cg_endo -68.96 151.5 73.57 Favored 'Trans proline' 0 N--CA 1.488 1.199 0 O-C-N 123.662 1.348 . . . . 0.0 110.325 179.244 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 283' ' ' GLN . . . . . . . . . . . . . 51.7 mt-30 -95.95 126.93 42.86 Favored Pre-proline 0 N--CA 1.495 1.795 0 O-C-N 121.594 -0.691 . . . . 0.0 110.047 179.195 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 284' ' ' PRO . . . . . . . . . . . . . 31.8 Cg_endo -68.65 153.16 73.93 Favored 'Trans proline' 0 N--CA 1.488 1.175 0 O-C-N 123.369 1.194 . . . . 0.0 110.292 -179.003 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 285' ' ' PRO . . . . . . . . . . . . . 30.5 Cg_endo -68.34 147.98 72.93 Favored 'Trans proline' 0 N--CA 1.487 1.13 0 O-C-N 123.672 1.354 . . . . 0.0 110.366 179.804 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 286' ' ' VAL . . . . . . . . . . . . . 12.5 p -131.1 138.24 53.86 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.864 0 O-C-N 121.725 -0.609 . . . . 0.0 110.076 179.3 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 287' ' ' GLU . . . . . . . . . . . . . 41.7 tt0 -90.51 -53.11 4.58 Favored 'General case' 0 N--CA 1.495 1.823 0 O-C-N 121.718 -0.614 . . . . 0.0 110.172 -179.873 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 288' ' ' SER . . . . . . . . . . . . . 50.5 m -126.53 151.41 47.92 Favored 'General case' 0 N--CA 1.495 1.792 0 O-C-N 121.674 -0.641 . . . . 0.0 110.294 -179.506 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 289' ' ' HIS . . . . . . . . . . . . . 99.2 m-70 -64.92 -33.49 76.16 Favored 'General case' 0 N--CA 1.5 2.041 0 O-C-N 121.589 -0.695 . . . . 0.0 110.337 179.59 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 290' ' ' SER . . . . . . . . . . . . . 93.2 p -120.72 155.15 34.52 Favored 'General case' 0 N--CA 1.495 1.816 0 O-C-N 121.715 -0.616 . . . . 0.0 110.232 179.871 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 291' ' ' SER . . . . . . . . . . . . . 46.5 m . . . . . 0 N--CA 1.496 1.833 0 CA-C-O 117.994 -1.003 . . . . 0.0 110.169 -179.934 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' -1' ' ' MET . . . . . . . . . . . . . 67.7 mmm . . . . . 0 N--CA 1.491 1.611 0 CA-C-O 121.048 0.451 . . . . 0.0 110.18 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 0' ' ' GLY . . . . . . . . . . . . . . . -174.26 102.62 0.17 Allowed Glycine 0 N--CA 1.493 2.496 0 N-CA-C 109.548 -1.421 . . . . 0.0 109.548 179.829 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 44.7 ttm -101.07 122.23 43.21 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.63 -0.923 . . . . 0.0 109.986 179.607 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 74.3 m -100.99 178.76 4.58 Favored 'General case' 0 N--CA 1.494 1.768 0 O-C-N 121.635 -0.666 . . . . 0.0 110.533 -176.945 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 56.7 t -64.67 -27.97 43.76 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.24 0 O-C-N 121.699 -0.626 . . . . 0.0 110.279 179.716 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -55.06 -30.96 60.72 Favored 'General case' 0 N--CA 1.504 2.235 0 O-C-N 121.452 -0.78 . . . . 0.0 110.393 -179.669 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 74.5 m-20 -68.73 -35.26 76.89 Favored 'General case' 0 N--CA 1.498 1.95 0 C-N-CA 120.413 -0.515 . . . . 0.0 109.968 174.658 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 95.0 m-85 -98.05 9.86 41.81 Favored 'General case' 0 N--CA 1.498 1.931 0 O-C-N 121.782 -0.574 . . . . 0.0 111.263 179.072 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -67.48 128.48 36.6 Favored 'General case' 0 N--CA 1.5 2.071 0 O-C-N 121.198 -0.939 . . . . 0.0 110.046 179.533 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 81.98 -0.59 88.35 Favored Glycine 0 N--CA 1.495 2.623 0 N-CA-C 110.757 -0.937 . . . . 0.0 110.757 -175.594 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 49.1 m -76.3 137.34 39.82 Favored 'General case' 0 N--CA 1.497 1.904 0 O-C-N 120.958 -1.319 . . . . 0.0 110.469 178.042 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 14.0 t-20 -84.51 119.12 24.8 Favored 'General case' 0 N--CA 1.497 1.886 0 O-C-N 121.683 -0.636 . . . . 0.0 109.774 174.567 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 35.8 m -142.12 162.46 19.53 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.808 0 O-C-N 121.847 -0.533 . . . . 0.0 109.636 -179.872 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . 0.409 ' HA ' ' HA ' ' A' ' 22' ' ' ARG . 48.4 tt0 -109.42 128.45 55.14 Favored 'General case' 0 N--CA 1.494 1.765 0 C-N-CA 119.914 -0.714 . . . . 0.0 110.01 178.05 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 60.8 t -106.74 127.71 62.04 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.765 0 O-C-N 121.642 -0.661 . . . . 0.0 109.893 -178.882 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 27.0 tp -95.83 125.87 40.7 Favored 'General case' 0 N--CA 1.493 1.7 0 N-CA-C 109.14 -0.689 . . . . 0.0 109.14 174.327 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 86.6 mt -95.08 167.33 11.45 Favored 'General case' 0 N--CA 1.496 1.828 0 O-C-N 121.6 -0.687 . . . . 0.0 111.102 -172.561 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 24.2 p30 -58.54 -21.9 53.91 Favored 'General case' 0 N--CA 1.507 2.4 0 O-C-N 121.933 -0.479 . . . . 0.0 111.575 -176.786 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 39.2 p-10 -93.06 23.76 4.12 Favored 'General case' 0 N--CA 1.498 1.936 0 O-C-N 121.6 -0.688 . . . . 0.0 110.878 -176.354 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 10.4 m-20 59.09 27.66 16.7 Favored 'General case' 0 N--CA 1.506 2.367 0 O-C-N 121.483 -0.76 . . . . 0.0 110.611 175.579 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 50.9 m -106.52 142.57 35.96 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.492 -0.755 . . . . 0.0 109.61 172.975 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 95.0 mttt -109.66 143.68 39.07 Favored 'General case' 0 N--CA 1.494 1.748 0 O-C-N 121.594 -0.691 . . . . 0.0 110.731 -176.668 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -153.1 156.06 37.96 Favored 'General case' 0 N--CA 1.497 1.907 0 O-C-N 121.752 -0.593 . . . . 0.0 110.018 175.96 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . 0.409 ' HA ' ' HA ' ' A' ' 12' ' ' GLU . 40.5 ptt85 -142.64 153.51 43.51 Favored 'General case' 0 N--CA 1.496 1.862 0 O-C-N 121.515 -0.74 . . . . 0.0 110.482 178.545 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -171.81 171.17 43.96 Favored Glycine 0 N--CA 1.494 2.517 0 N-CA-C 109.051 -1.62 . . . . 0.0 109.051 -178.965 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 44.6 t -94.65 127.12 46.88 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.898 0 O-C-N 121.604 -0.939 . . . . 0.0 109.305 176.943 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 49.2 mt -61.5 138.31 22.32 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.227 0 O-C-N 121.632 -0.668 . . . . 0.0 110.864 -171.01 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 12.5 p -121.16 -20.53 6.73 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.875 -0.515 . . . . 0.0 111.485 -179.699 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 30.9 t30 -165.77 158.58 15.32 Favored 'General case' 0 N--CA 1.504 2.262 0 O-C-N 120.902 -1.124 . . . . 0.0 111.798 176.764 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 66.8 t80 -150.27 123.08 8.68 Favored 'General case' 0 N--CA 1.494 1.761 0 N-CA-C 109.177 -0.675 . . . . 0.0 109.177 173.217 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 17.9 t70 -98.05 130.16 44.87 Favored 'General case' 0 N--CA 1.493 1.689 0 N-CA-C 109.106 -0.702 . . . . 0.0 109.106 -177.849 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 23.2 t -69.63 -51.82 31.5 Favored 'General case' 0 N--CA 1.498 1.963 0 C-N-CA 119.981 -0.688 . . . . 0.0 110.648 -175.985 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 22.1 t -59.94 -41.58 92.13 Favored 'General case' 0 N--CA 1.501 2.099 0 O-C-N 121.624 -0.672 . . . . 0.0 110.938 -174.652 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 91.6 m-20 -104.17 -9.88 18.35 Favored 'General case' 0 N--CA 1.497 1.894 0 O-C-N 121.668 -0.645 . . . . 0.0 111.663 -177.453 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 3.7 m 50.13 67.35 0.93 Allowed 'General case' 0 N--CA 1.508 2.431 0 O-C-N 120.971 -1.08 . . . . 0.0 110.85 -174.43 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 44.6 mm -120.67 125.8 74.5 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.024 0 O-C-N 121.598 -0.688 . . . . 0.0 109.332 -175.827 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 10.8 tp -115.9 119.47 36.05 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.691 -0.631 . . . . 0.0 110.548 -169.699 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 56.9 mt-30 -91.0 132.51 35.94 Favored 'General case' 0 N--CA 1.489 1.504 0 N-CA-C 109.304 -0.628 . . . . 0.0 109.304 171.441 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 51.4 mt -117.79 123.54 46.21 Favored 'General case' 0 N--CA 1.495 1.789 0 C-N-CA 120.129 -0.628 . . . . 0.0 110.001 175.81 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 57.1 ttt85 -105.86 106.18 16.57 Favored 'General case' 0 N--CA 1.496 1.85 0 O-C-N 121.753 -0.592 . . . . 0.0 110.191 173.885 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 65.4 tp -83.78 156.76 22.36 Favored 'General case' 0 N--CA 1.499 1.978 0 O-C-N 121.678 -0.639 . . . . 0.0 110.587 -177.138 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -68.19 -3.02 9.23 Favored 'General case' 0 N--CA 1.504 2.226 0 O-C-N 121.903 -0.498 . . . . 0.0 112.178 -170.804 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 91.7 m-20 -86.96 29.1 0.84 Allowed 'General case' 0 N--CA 1.498 1.963 0 O-C-N 121.04 -1.038 . . . . 0.0 110.682 173.84 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 73.1 m-20 60.74 31.67 20.14 Favored 'General case' 0 N--CA 1.505 2.316 0 O-C-N 121.242 -0.911 . . . . 0.0 110.271 175.82 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 73.5 m -125.78 138.33 53.84 Favored 'General case' 0 N--CA 1.494 1.739 0 O-C-N 121.457 -0.777 . . . . 0.0 110.006 177.212 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 9.3 t -128.18 148.88 50.63 Favored 'General case' 0 N--CA 1.497 1.881 0 O-C-N 121.659 -0.651 . . . . 0.0 110.042 179.955 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 79.2 tttt -150.37 136.09 18.28 Favored 'General case' 0 N--CA 1.495 1.822 0 O-C-N 121.718 -0.614 . . . . 0.0 110.584 -178.32 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 89.8 p -94.39 121.49 35.98 Favored 'General case' 0 N--CA 1.494 1.769 0 O-C-N 121.718 -0.614 . . . . 0.0 110.073 176.935 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 79.7 mt -129.2 135.09 62.71 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.837 0 O-C-N 121.602 -0.686 . . . . 0.0 109.44 -179.424 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 62.1 t -82.31 127.63 39.46 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.929 0 N-CA-C 109.265 -0.643 . . . . 0.0 109.265 179.032 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 57.7 p -58.36 -25.0 61.51 Favored 'General case' 0 N--CA 1.507 2.382 0 O-C-N 121.533 -0.729 . . . . 0.0 111.814 -169.148 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 49.0 tptt -56.87 -26.1 57.98 Favored 'General case' 0 N--CA 1.5 2.061 0 O-C-N 121.414 -0.804 . . . . 0.0 111.069 -177.049 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 5.3 p30 -84.64 5.88 26.27 Favored 'General case' 0 N--CA 1.499 2.009 0 C-N-CA 119.676 -0.809 . . . . 0.0 111.33 176.501 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 98.7 mt -75.32 126.46 36.11 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.107 0 O-C-N 121.184 -0.948 . . . . 0.0 109.988 175.726 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 77.0 tttt -92.91 -29.35 15.96 Favored 'General case' 0 N--CA 1.494 1.768 0 O-C-N 121.803 -0.561 . . . . 0.0 109.887 170.708 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 5.4 m-20 -163.63 154.6 16.24 Favored 'General case' 0 N--CA 1.5 2.075 0 O-C-N 121.76 -0.587 . . . . 0.0 110.168 -177.926 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 83.9 mt -132.98 150.5 52.16 Favored 'General case' 0 N--CA 1.497 1.899 0 O-C-N 121.71 -0.619 . . . . 0.0 110.424 -179.163 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 4.5 ptm180 -152.66 141.91 21.48 Favored 'General case' 0 N--CA 1.495 1.791 0 O-C-N 121.757 -0.589 . . . . 0.0 109.869 174.83 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 69.4 mt -85.19 133.34 29.61 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.883 0 O-C-N 121.453 -0.779 . . . . 0.0 109.864 174.472 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 63.9 mt -82.27 163.03 54.55 Favored Pre-proline 0 N--CA 1.497 1.923 0 O-C-N 121.591 -0.693 . . . . 0.0 110.113 -179.031 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 21.4 Cg_exo -61.35 -62.38 0.13 Allowed 'Trans proline' 0 N--CA 1.49 1.285 0 O-C-N 123.635 1.334 . . . . 0.0 110.882 -176.992 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 82.7 tttt 58.66 -78.26 0.02 OUTLIER 'General case' 0 N--CA 1.507 2.401 0 O-C-N 122.012 -0.43 . . . . 0.0 111.098 -177.048 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 15.4 t-20 53.73 47.48 23.65 Favored 'General case' 0 N--CA 1.505 2.276 0 O-C-N 121.083 -1.011 . . . . 0.0 110.965 179.98 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 41.9 tt0 -92.02 128.53 37.9 Favored 'General case' 0 N--CA 1.496 1.837 0 O-C-N 121.555 -0.715 . . . . 0.0 110.023 179.751 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 84.0 mt -69.53 -34.14 60.35 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.033 0 O-C-N 121.744 -0.598 . . . . 0.0 109.9 -179.477 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 64' ' ' MET . . . . . . . . . . . . . 41.3 mtp 57.87 160.75 0.09 OUTLIER Pre-proline 0 N--CA 1.508 2.447 0 O-C-N 121.866 -0.521 . . . . 0.0 111.161 -178.322 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 38.3 Cg_endo -71.91 66.86 3.22 Favored 'Trans proline' 0 N--CA 1.487 1.122 0 O-C-N 123.34 1.179 . . . . 0.0 110.398 179.482 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 59.2 tttt -149.33 125.67 10.85 Favored 'General case' 0 N--CA 1.496 1.826 0 O-C-N 121.499 -0.75 . . . . 0.0 110.046 179.441 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 91.7 m-20 -134.23 -63.71 0.71 Allowed 'General case' 0 N--CA 1.495 1.805 0 O-C-N 121.725 -0.61 . . . . 0.0 110.09 178.991 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . -156.93 -49.49 0.01 OUTLIER Glycine 0 N--CA 1.493 2.477 0 N-CA-C 109.343 -1.503 . . . . 0.0 109.343 179.244 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 9.3 t -136.62 158.54 44.19 Favored 'General case' 0 N--CA 1.496 1.868 0 O-C-N 121.707 -0.878 . . . . 0.0 110.297 179.194 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 82.8 tttt -90.51 134.35 34.43 Favored 'General case' 0 N--CA 1.496 1.844 0 O-C-N 121.719 -0.613 . . . . 0.0 110.138 179.39 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 18.7 p -83.48 154.66 65.95 Favored Pre-proline 0 N--CA 1.498 1.937 0 O-C-N 121.773 -0.579 . . . . 0.0 110.214 -179.225 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 29.0 Cg_endo -67.46 149.87 80.33 Favored 'Trans proline' 0 N--CA 1.488 1.151 0 O-C-N 123.67 1.352 . . . . 0.0 110.426 -179.695 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 87.4 p -91.69 161.7 14.79 Favored 'General case' 0 N--CA 1.496 1.831 0 O-C-N 121.615 -0.678 . . . . 0.0 110.103 179.162 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 44.1 p -127.24 -42.59 1.68 Allowed 'General case' 0 N--CA 1.497 1.924 0 O-C-N 121.648 -0.658 . . . . 0.0 110.502 -178.792 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 91.7 m-20 -94.29 143.46 26.37 Favored 'General case' 0 N--CA 1.495 1.804 0 O-C-N 121.605 -0.684 . . . . 0.0 110.22 -179.645 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 73.3 p -112.06 150.72 30.27 Favored 'General case' 0 N--CA 1.496 1.842 0 O-C-N 121.693 -0.63 . . . . 0.0 110.277 -179.494 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 42.6 p -76.98 -33.61 57.6 Favored 'General case' 0 N--CA 1.498 1.948 0 O-C-N 121.712 -0.618 . . . . 0.0 110.248 -179.697 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 16.4 pttp -157.16 44.71 0.37 Allowed 'General case' 0 N--CA 1.496 1.869 0 O-C-N 121.583 -0.698 . . . . 0.0 110.444 -179.568 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 4.6 mm? 52.09 -172.43 0.03 OUTLIER 'General case' 0 N--CA 1.506 2.356 0 O-C-N 121.538 -0.726 . . . . 0.0 111.003 -179.596 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 73.1 tttt -131.51 136.25 47.73 Favored 'General case' 0 N--CA 1.496 1.829 0 O-C-N 121.628 -0.67 . . . . 0.0 110.206 -179.943 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 94.6 p -119.09 154.38 33.29 Favored 'General case' 0 N--CA 1.495 1.81 0 O-C-N 121.64 -0.662 . . . . 0.0 110.075 179.54 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -124.42 -45.01 1.97 Allowed 'General case' 0 N--CA 1.494 1.771 0 O-C-N 121.594 -0.691 . . . . 0.0 110.298 -179.381 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 54.8 mt-10 -104.35 157.24 17.28 Favored 'General case' 0 N--CA 1.495 1.776 0 O-C-N 121.64 -0.663 . . . . 0.0 110.233 -179.1 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 24.1 m -86.12 135.17 33.71 Favored 'General case' 0 N--CA 1.497 1.893 0 O-C-N 121.763 -0.586 . . . . 0.0 109.98 179.56 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 41.1 p90 -149.21 160.03 43.74 Favored 'General case' 0 N--CA 1.495 1.805 0 O-C-N 121.666 -0.646 . . . . 0.0 110.377 -178.071 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 15.4 m -84.7 -35.89 22.23 Favored 'General case' 0 N--CA 1.497 1.877 0 O-C-N 121.708 -0.62 . . . . 0.0 109.958 177.006 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 90.3 p -150.45 162.19 41.07 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.772 -0.58 . . . . 0.0 110.152 178.88 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 40.5 mtmt -99.88 125.03 45.79 Favored 'General case' 0 N--CA 1.495 1.789 0 O-C-N 121.67 -0.644 . . . . 0.0 110.369 -179.891 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 92.2 m-20 -133.75 27.88 3.94 Favored 'General case' 0 N--CA 1.496 1.858 0 O-C-N 121.686 -0.633 . . . . 0.0 110.449 177.391 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 72.2 mttt -139.08 149.3 44.41 Favored 'General case' 0 N--CA 1.496 1.835 0 O-C-N 121.624 -0.673 . . . . 0.0 110.107 -179.56 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 91' ' ' TRP . . . . . . . . . . . . . 62.3 p-90 -147.7 32.86 0.86 Allowed 'General case' 0 N--CA 1.497 1.88 0 O-C-N 121.633 -0.667 . . . . 0.0 110.323 179.733 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 88.4 p -129.42 153.01 48.34 Favored 'General case' 0 N--CA 1.495 1.811 0 O-C-N 121.606 -0.684 . . . . 0.0 110.255 -179.799 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 93' ' ' MET . . . . . . . . . . . . . 89.4 mtp -67.38 -35.07 78.59 Favored 'General case' 0 N--CA 1.499 2.011 0 O-C-N 121.68 -0.637 . . . . 0.0 110.29 179.583 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 74.4 m-20 . . . . . 0 N--CA 1.495 1.802 0 CA-C-O 118.021 -0.99 . . . . 0.0 110.256 -179.831 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' B' B ' 240' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.272 0 N-CA-C 109.536 -1.426 . . . . 0.0 109.536 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' B' B ' 241' ' ' ALA . . . . . . . . . . . . . . . -68.07 -37.67 81.54 Favored 'General case' 0 N--CA 1.499 2.002 0 O-C-N 121.702 -0.881 . . . . 0.0 110.272 -179.651 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 242' ' ' THR . . . . . . . . . . . . . 22.6 m -125.61 130.31 51.39 Favored 'General case' 0 N--CA 1.496 1.832 0 O-C-N 121.713 -0.617 . . . . 0.0 110.237 179.812 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 243' ' ' THR . . . . . . . . . . . . . 22.6 m -70.86 -40.69 72.16 Favored 'General case' 0 N--CA 1.499 1.981 0 O-C-N 121.67 -0.643 . . . . 0.0 110.27 -179.236 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 244' ' ' LYS . . . . . . . . . . . . . 78.7 mttt -118.07 157.33 27.04 Favored 'General case' 0 N--CA 1.496 1.856 0 O-C-N 121.671 -0.643 . . . . 0.0 110.265 -178.275 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 245' ' ' GLU . . . . . . . . . . . . . 78.8 mt-10 -94.11 67.09 3.59 Favored 'General case' 0 N--CA 1.496 1.85 0 O-C-N 121.748 -0.595 . . . . 0.0 110.237 -179.019 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 246' ' ' LYS . . . . . . . . . . . . . 50.7 tptt 53.31 94.9 0.02 OUTLIER 'General case' 0 N--CA 1.505 2.304 0 O-C-N 121.454 -0.779 . . . . 0.0 111.025 179.436 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 247' ' ' ASN . . . . . . . . . . . . . 30.1 m120 -78.38 -177.37 5.19 Favored 'General case' 0 N--CA 1.499 1.978 0 O-C-N 121.657 -0.652 . . . . 0.0 110.206 -179.204 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 248' ' ' ILE . . . . . . . . . . . . . 84.3 mt 58.82 -81.77 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.508 2.431 0 O-C-N 122.017 -0.427 . . . . 0.0 110.84 -179.476 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 249' ' ' SER . . . . . . . . . . . . . 33.0 t -112.29 144.08 42.3 Favored 'General case' 0 N--CA 1.495 1.805 0 O-C-N 121.152 -0.968 . . . . 0.0 110.342 -177.411 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 250' ' ' VAL . . . . . . . . . . . . . 58.4 t -85.61 -32.39 7.08 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.983 0 O-C-N 121.71 -0.619 . . . . 0.0 109.735 178.73 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 251' ' ' ASP . . . . . . . . . . . . . 12.7 t70 -161.18 164.72 30.31 Favored 'General case' 0 N--CA 1.494 1.754 0 O-C-N 121.661 -0.649 . . . . 0.0 110.03 179.366 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 252' ' ' VAL . . . . . . . . . . . . . 40.1 t 58.0 164.18 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.509 2.486 0 O-C-N 121.719 -0.613 . . . . 0.0 110.563 -177.955 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 253' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -157.63 166.88 31.67 Favored 'General case' 0 N--CA 1.496 1.842 0 O-C-N 121.526 -0.734 . . . . 0.0 110.037 -178.048 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 254' ' ' ALA . . . . . . . . . . . . . . . -66.66 -29.48 69.51 Favored 'General case' 0 N--CA 1.502 2.145 0 O-C-N 121.78 -0.575 . . . . 0.0 110.492 179.733 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 255' ' ' ASP . . . . . . . . . . . . . 74.4 m-20 -72.13 -29.04 63.66 Favored 'General case' 0 N--CA 1.499 1.977 0 O-C-N 121.634 -0.666 . . . . 0.0 110.396 179.937 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 256' ' ' ALA . . . . . . . . . . . . . . . -62.77 -30.65 71.61 Favored 'General case' 0 N--CA 1.501 2.091 0 O-C-N 121.557 -0.714 . . . . 0.0 110.303 177.777 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 257' ' ' SER . . . . . . . . . . . . . 69.2 m -54.36 -34.93 62.15 Favored 'General case' 0 N--CA 1.503 2.186 0 O-C-N 121.682 -0.636 . . . . 0.0 110.48 176.728 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 258' ' ' SER . . . . . . . . . . . . . 27.6 m -68.27 -31.43 70.88 Favored 'General case' 0 N--CA 1.499 2.009 0 C-N-CA 120.438 -0.505 . . . . 0.0 110.296 179.186 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 259' ' ' GLN . . . . . . . . . . . . . 58.4 tp60 -63.59 -37.31 86.85 Favored 'General case' 0 N--CA 1.501 2.075 0 O-C-N 121.638 -0.664 . . . . 0.0 110.64 -179.472 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 260' ' ' LEU . . . . . . . . . . . . . 83.2 mt -70.89 -43.86 67.48 Favored 'General case' 0 N--CA 1.499 1.983 0 O-C-N 121.524 -0.735 . . . . 0.0 110.214 179.946 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 261' ' ' LEU . . . . . . . . . . . . . 24.2 tp -69.1 -39.04 79.24 Favored 'General case' 0 N--CA 1.498 1.963 0 O-C-N 121.737 -0.602 . . . . 0.0 109.844 178.023 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 262' ' ' SER . . . . . . . . . . . . . 84.9 p -62.99 -34.78 78.28 Favored 'General case' 0 N--CA 1.499 2.019 0 O-C-N 121.687 -0.633 . . . . 0.0 110.611 177.539 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 263' ' ' LEU . . . . . . . . . . . . . 23.5 mt -65.45 -41.84 92.99 Favored 'General case' 0 N--CA 1.501 2.105 0 O-C-N 121.58 -0.7 . . . . 0.0 110.357 179.409 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 264' ' ' LEU . . . . . . . . . . . . . 84.1 mt -62.28 -37.8 86.89 Favored 'General case' 0 N--CA 1.501 2.123 0 O-C-N 121.624 -0.673 . . . . 0.0 110.421 178.224 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 265' ' ' LYS . . . . . . . . . . . . . 75.8 mttt -76.47 -33.17 58.7 Favored 'General case' 0 N--CA 1.497 1.897 0 O-C-N 121.747 -0.596 . . . . 0.0 110.235 179.392 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 266' ' ' SER . . . . . . . . . . . . . 84.7 p -78.93 164.77 24.15 Favored 'General case' 0 N--CA 1.498 1.966 0 O-C-N 121.744 -0.597 . . . . 0.0 110.213 -179.716 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 267' ' ' SER . . . . . . . . . . . . . 85.8 p -75.86 165.68 24.64 Favored 'General case' 0 N--CA 1.499 1.979 0 O-C-N 121.731 -0.606 . . . . 0.0 110.185 -179.742 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 268' ' ' THR . . . . . . . . . . . . . 40.1 p -118.68 168.66 10.51 Favored 'General case' 0 N--CA 1.496 1.856 0 O-C-N 121.71 -0.619 . . . . 0.0 110.115 -179.629 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 269' ' ' ALA . . . . . . . . . . . . . . . 49.46 88.05 0.12 Allowed Pre-proline 0 N--CA 1.506 2.338 0 O-C-N 121.679 -0.638 . . . . 0.0 111.19 -178.568 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 270' ' ' PRO . . . . . . . . . . . . . 20.6 Cg_exo -62.18 147.24 95.39 Favored 'Trans proline' 0 N--CA 1.491 1.333 0 O-C-N 123.553 1.291 . . . . 0.0 110.66 -179.98 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 271' ' ' SER . . . . . . . . . . . . . 88.7 p -66.49 -29.76 69.94 Favored 'General case' 0 N--CA 1.5 2.042 0 O-C-N 121.651 -0.656 . . . . 0.0 110.595 179.773 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 272' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -63.05 -32.71 74.15 Favored 'General case' 0 N--CA 1.501 2.125 0 O-C-N 121.589 -0.694 . . . . 0.0 110.549 -179.819 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 273' ' ' LEU . . . . . . . . . . . . . 81.2 mt 52.63 -168.66 0.05 OUTLIER 'General case' 0 N--CA 1.507 2.375 0 O-C-N 121.693 -0.629 . . . . 0.0 110.987 179.976 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 274' ' ' ALA . . . . . . . . . . . . . . . -165.54 165.11 19.19 Favored 'General case' 0 N--CA 1.497 1.887 0 O-C-N 121.637 -0.665 . . . . 0.0 110.008 -179.722 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 275' ' ' THR . . . . . . . . . . . . . 23.7 p -117.31 87.37 24.1 Favored Pre-proline 0 N--CA 1.494 1.761 0 O-C-N 121.674 -0.641 . . . . 0.0 110.186 -179.117 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 276' ' ' PRO . . . . . . . . . . . . . 25.1 Cg_endo -66.0 -29.34 49.02 Favored 'Trans proline' 0 N--CA 1.489 1.247 0 O-C-N 123.537 1.283 . . . . 0.0 110.728 179.35 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 277' ' ' GLN . . . . . . . . . . . . . 9.2 pt20 -65.05 157.66 75.35 Favored Pre-proline 0 N--CA 1.501 2.102 0 O-C-N 121.495 -0.753 . . . . 0.0 110.584 -179.263 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 278' ' ' PRO . . . . . . . . . . . . . 26.7 Cg_endo -66.5 161.21 42.21 Favored 'Trans proline' 0 N--CA 1.488 1.19 0 O-C-N 123.698 1.367 . . . . 0.0 110.49 -179.602 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 279' ' ' SER . . . . . . . . . . . . . 29.9 t -97.24 151.41 19.88 Favored 'General case' 0 N--CA 1.496 1.845 0 O-C-N 121.772 -0.58 . . . . 0.0 110.206 -179.826 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 280' ' ' THR . . . . . . . . . . . . . 42.6 p -81.71 160.8 23.58 Favored 'General case' 0 N--CA 1.498 1.946 0 O-C-N 121.742 -0.599 . . . . 0.0 110.164 -179.147 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 281' ' ' PHE . . . . . . . . . . . . . 9.9 t80 -141.64 144.59 33.79 Favored Pre-proline 0 N--CA 1.495 1.785 0 O-C-N 121.673 -0.642 . . . . 0.0 109.977 -179.415 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 282' ' ' PRO . . . . . . . . . . . . . 19.2 Cg_endo -64.02 -50.61 2.83 Favored 'Trans proline' 0 N--CA 1.49 1.319 0 O-C-N 123.453 1.239 . . . . 0.0 110.601 -178.864 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 283' ' ' GLN . . . . . . . . . . . . . 31.2 mt-30 -79.08 162.57 63.91 Favored Pre-proline 0 N--CA 1.497 1.897 0 O-C-N 121.68 -0.638 . . . . 0.0 110.077 178.572 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 284' ' ' PRO . . . . . . . . . . . . . 17.6 Cg_exo -62.95 151.96 81.73 Favored 'Trans proline' 0 N--CA 1.489 1.248 0 O-C-N 123.605 1.318 . . . . 0.0 110.595 -178.932 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 285' ' ' PRO . . . . . . . . . . . . . 31.3 Cg_endo -68.55 161.13 46.39 Favored 'Trans proline' 0 N--CA 1.488 1.177 0 O-C-N 123.604 1.318 . . . . 0.0 110.346 -179.963 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 286' ' ' VAL . . . . . . . . . . . . . 60.5 t -100.11 135.76 34.45 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.909 0 O-C-N 121.698 -0.626 . . . . 0.0 109.668 179.273 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 287' ' ' GLU . . . . . . . . . . . . . 13.2 pt-20 -63.16 136.06 57.53 Favored 'General case' 0 N--CA 1.502 2.134 0 O-C-N 121.698 -0.627 . . . . 0.0 110.743 -178.691 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 288' ' ' SER . . . . . . . . . . . . . 51.1 m -129.76 151.05 50.76 Favored 'General case' 0 N--CA 1.495 1.777 0 O-C-N 121.742 -0.599 . . . . 0.0 110.179 179.617 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 289' ' ' HIS . . . . . . . . . . . . . 99.1 m-70 -112.13 135.17 53.13 Favored 'General case' 0 N--CA 1.495 1.803 0 O-C-N 121.602 -0.686 . . . . 0.0 110.184 179.853 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 290' ' ' SER . . . . . . . . . . . . . 27.4 m -65.71 -34.48 78.3 Favored 'General case' 0 N--CA 1.5 2.051 0 O-C-N 121.612 -0.68 . . . . 0.0 110.384 179.932 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 291' ' ' SER . . . . . . . . . . . . . 18.7 t . . . . . 0 N--CA 1.495 1.792 0 CA-C-O 117.979 -1.01 . . . . 0.0 110.268 179.967 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' -1' ' ' MET . . . . . . . . . . . . . 49.0 ttm . . . . . 0 N--CA 1.492 1.644 0 CA-C-O 120.975 0.417 . . . . 0.0 110.211 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 0' ' ' GLY . . . . . . . . . . . . . . . -83.88 -177.71 51.6 Favored Glycine 0 N--CA 1.494 2.518 0 N-CA-C 109.509 -1.437 . . . . 0.0 109.509 179.709 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 89.9 mtp -111.97 141.04 46.12 Favored 'General case' 0 N--CA 1.496 1.85 0 O-C-N 121.703 -0.88 . . . . 0.0 110.227 -179.968 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 69.8 m -101.09 167.22 10.37 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.626 -0.671 . . . . 0.0 110.021 179.536 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 79.8 t -66.67 -27.81 41.23 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.036 0 O-C-N 121.58 -0.7 . . . . 0.0 110.263 -179.684 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -55.15 -30.83 60.61 Favored 'General case' 0 N--CA 1.505 2.315 0 O-C-N 121.461 -0.774 . . . . 0.0 110.389 -178.925 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 74.6 m-20 -68.76 -30.52 69.14 Favored 'General case' 0 N--CA 1.499 2.025 0 O-C-N 121.813 -0.555 . . . . 0.0 110.223 174.821 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 96.2 m-85 -95.4 10.07 37.69 Favored 'General case' 0 N--CA 1.498 1.953 0 O-C-N 121.645 -0.659 . . . . 0.0 111.512 -178.367 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 3.7 m-30 -67.18 137.82 56.53 Favored 'General case' 0 N--CA 1.502 2.16 0 O-C-N 121.131 -0.98 . . . . 0.0 110.106 173.979 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 83.07 -1.08 89.3 Favored Glycine 0 N--CA 1.496 2.694 0 N-CA-C 110.718 -0.953 . . . . 0.0 110.718 -177.352 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 68.9 m -77.2 136.82 38.58 Favored 'General case' 0 N--CA 1.499 1.979 0 O-C-N 121.031 -1.276 . . . . 0.0 110.417 177.747 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 16.1 t-20 -84.16 117.11 23.27 Favored 'General case' 0 N--CA 1.498 1.944 0 O-C-N 121.633 -0.667 . . . . 0.0 109.628 173.4 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 35.7 m -142.71 162.7 17.99 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.705 0 N-CA-C 109.387 -0.597 . . . . 0.0 109.387 -178.206 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 45.3 tt0 -109.34 130.3 55.5 Favored 'General case' 0 N--CA 1.492 1.661 0 C-N-CA 119.838 -0.745 . . . . 0.0 109.863 176.918 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 60.0 t -106.69 126.67 62.54 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.679 0 O-C-N 121.623 -0.673 . . . . 0.0 109.841 -179.597 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 27.1 tp -95.93 130.22 42.96 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.697 -0.627 . . . . 0.0 109.358 176.512 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 86.3 mt -97.38 160.12 14.51 Favored 'General case' 0 N--CA 1.496 1.875 0 O-C-N 121.59 -0.694 . . . . 0.0 111.067 -174.25 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 24.4 p30 -58.24 -21.87 49.95 Favored 'General case' 0 N--CA 1.506 2.345 0 O-C-N 121.756 -0.59 . . . . 0.0 111.503 -178.477 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 38.3 p-10 -93.14 23.93 4.07 Favored 'General case' 0 N--CA 1.498 1.927 0 O-C-N 121.5 -0.75 . . . . 0.0 110.778 -177.154 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 74.3 m-20 59.42 28.08 17.35 Favored 'General case' 0 N--CA 1.505 2.322 0 O-C-N 121.493 -0.754 . . . . 0.0 110.644 175.8 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 51.0 m -104.04 141.43 36.22 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.57 -0.706 . . . . 0.0 109.516 171.964 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 52.8 mttp -109.69 143.43 39.47 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.593 -0.692 . . . . 0.0 110.553 -176.013 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -153.1 154.6 35.16 Favored 'General case' 0 N--CA 1.497 1.889 0 O-C-N 121.722 -0.612 . . . . 0.0 110.3 176.477 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 31.0 ptt180 -144.07 154.98 43.78 Favored 'General case' 0 N--CA 1.498 1.947 0 O-C-N 121.705 -0.622 . . . . 0.0 110.463 177.573 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -171.93 171.18 44.0 Favored Glycine 0 N--CA 1.494 2.522 0 N-CA-C 109.237 -1.545 . . . . 0.0 109.237 -178.967 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 41.0 t -94.5 119.51 42.58 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.926 0 O-C-N 121.596 -0.944 . . . . 0.0 109.02 174.252 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 76.0 mt -63.52 143.75 15.31 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.23 0 CA-C-O 121.304 0.573 . . . . 0.0 110.66 -167.749 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 2.3 p -121.15 -25.87 5.21 Favored 'General case' 0 N--CA 1.494 1.768 0 O-C-N 121.831 -0.543 . . . . 0.0 111.379 179.934 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 7.3 t30 -163.94 160.0 21.5 Favored 'General case' 0 N--CA 1.501 2.091 0 O-C-N 120.952 -1.092 . . . . 0.0 111.774 -179.844 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 91.5 t80 -150.1 128.78 12.37 Favored 'General case' 0 N--CA 1.5 2.028 0 N-CA-C 109.223 -0.658 . . . . 0.0 109.223 170.279 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 20.2 t0 -98.86 130.84 45.29 Favored 'General case' 0 N--CA 1.49 1.559 0 N-CA-C 108.941 -0.763 . . . . 0.0 108.941 179.994 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 88.6 p -70.84 -51.48 26.31 Favored 'General case' 0 N--CA 1.497 1.922 0 C-N-CA 119.98 -0.688 . . . . 0.0 110.686 -175.175 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 6.3 t -61.25 -40.47 94.18 Favored 'General case' 0 N--CA 1.501 2.124 0 O-C-N 121.517 -0.74 . . . . 0.0 110.718 -175.737 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 28.8 m120 -103.27 -9.07 19.83 Favored 'General case' 0 N--CA 1.498 1.941 0 O-C-N 121.738 -0.601 . . . . 0.0 111.615 -176.877 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 28.6 p 46.79 67.13 0.83 Allowed 'General case' 0 N--CA 1.509 2.477 0 O-C-N 121.385 -0.822 . . . . 0.0 111.266 -175.009 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 46.0 mm -122.53 125.83 73.2 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.059 0 N-CA-C 109.138 -0.69 . . . . 0.0 109.138 -176.881 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 12.5 tp -115.98 122.25 44.69 Favored 'General case' 0 N--CA 1.495 1.776 0 O-C-N 121.677 -0.639 . . . . 0.0 110.7 -169.888 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 77.9 mt-30 -90.93 142.1 28.13 Favored 'General case' 0 N--CA 1.489 1.524 0 N-CA-C 109.358 -0.608 . . . . 0.0 109.358 171.097 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 6.4 mt -133.53 123.57 25.41 Favored 'General case' 0 N--CA 1.495 1.803 0 O-C-N 121.76 -0.588 . . . . 0.0 109.783 178.846 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 23.2 mtm180 -102.25 104.83 15.41 Favored 'General case' 0 N--CA 1.496 1.863 0 O-C-N 121.738 -0.601 . . . . 0.0 110.38 173.392 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 62.8 tp -84.19 157.33 21.68 Favored 'General case' 0 N--CA 1.497 1.901 0 O-C-N 121.509 -0.744 . . . . 0.0 110.49 -177.946 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -66.43 -2.91 5.09 Favored 'General case' 0 N--CA 1.504 2.227 0 O-C-N 121.911 -0.493 . . . . 0.0 112.126 -171.154 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 91.4 m-20 -84.87 28.98 0.65 Allowed 'General case' 0 N--CA 1.499 1.993 0 O-C-N 121.112 -0.993 . . . . 0.0 110.856 172.267 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 74.4 m-20 59.43 31.17 20.87 Favored 'General case' 0 N--CA 1.504 2.272 0 O-C-N 121.108 -0.995 . . . . 0.0 110.433 174.148 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 50.8 m -126.26 137.76 53.55 Favored 'General case' 0 N--CA 1.496 1.847 0 O-C-N 121.498 -0.751 . . . . 0.0 110.517 178.99 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 10.0 t -102.36 151.11 22.65 Favored 'General case' 0 N--CA 1.497 1.882 0 O-C-N 121.864 -0.523 . . . . 0.0 110.105 174.629 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 69.5 mttt -149.04 123.79 9.87 Favored 'General case' 0 N--CA 1.496 1.87 0 O-C-N 121.574 -0.704 . . . . 0.0 110.741 178.939 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 92.6 p -97.45 118.52 34.11 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.792 -0.568 . . . . 0.0 110.122 177.551 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 82.6 mt -129.34 140.1 50.03 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.842 0 O-C-N 121.675 -0.641 . . . . 0.0 109.369 179.665 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 58.1 t -81.85 127.65 39.42 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.863 0 C-N-CA 119.981 -0.688 . . . . 0.0 109.164 178.694 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 38.7 p -60.42 -27.18 67.27 Favored 'General case' 0 N--CA 1.502 2.128 0 O-C-N 121.62 -0.675 . . . . 0.0 111.926 -171.005 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 50.3 mmtt -58.58 -25.03 62.13 Favored 'General case' 0 N--CA 1.501 2.122 0 O-C-N 121.531 -0.731 . . . . 0.0 111.363 -173.776 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 6.4 p30 -82.44 -1.16 49.3 Favored 'General case' 0 N--CA 1.498 1.967 0 C-N-CA 119.635 -0.826 . . . . 0.0 111.084 176.41 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 75.3 mt -79.66 133.92 28.74 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.102 0 O-C-N 121.185 -0.947 . . . . 0.0 110.131 177.317 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 47.2 tptt -92.38 -27.51 17.48 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.854 -0.529 . . . . 0.0 109.928 171.412 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -164.34 155.5 15.53 Favored 'General case' 0 N--CA 1.502 2.17 0 O-C-N 121.684 -0.635 . . . . 0.0 110.47 -176.211 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 4.7 mp -132.91 155.36 49.2 Favored 'General case' 0 N--CA 1.497 1.88 0 O-C-N 121.877 -0.514 . . . . 0.0 110.175 178.191 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 19.6 ptp180 -151.6 148.93 28.57 Favored 'General case' 0 N--CA 1.497 1.891 0 O-C-N 121.693 -0.629 . . . . 0.0 109.976 175.801 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 67.5 mt -86.01 133.33 29.91 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.871 0 C-N-CA 119.944 -0.702 . . . . 0.0 109.868 172.808 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 72.7 mt -82.53 148.25 58.08 Favored Pre-proline 0 N--CA 1.498 1.928 0 O-C-N 121.613 -0.68 . . . . 0.0 110.045 -178.299 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 32.1 Cg_endo -68.62 -33.4 21.98 Favored 'Trans proline' 0 N--CA 1.488 1.2 0 O-C-N 123.552 1.29 . . . . 0.0 110.45 -178.952 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 50.7 mttp -103.03 139.09 39.04 Favored 'General case' 0 N--CA 1.495 1.787 0 O-C-N 121.631 -0.668 . . . . 0.0 110.229 -179.161 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 23.1 t30 -93.62 -61.93 1.46 Allowed 'General case' 0 N--CA 1.495 1.788 0 O-C-N 121.63 -0.669 . . . . 0.0 110.22 179.411 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 41.6 tt0 -121.8 136.42 54.93 Favored 'General case' 0 N--CA 1.495 1.822 0 O-C-N 121.6 -0.688 . . . . 0.0 110.238 -179.209 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 38.7 pt -127.34 159.13 38.11 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.974 0 O-C-N 121.681 -0.637 . . . . 0.0 110.187 178.806 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 64' ' ' MET . . . . . 0.458 ' CB ' ' HD3' ' A' ' 65' ' ' PRO . 1.9 mtt -163.38 -56.11 0.01 OUTLIER Pre-proline 0 N--CA 1.498 1.946 0 O-C-N 121.651 -0.656 . . . . 0.0 110.981 -179.914 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 65' ' ' PRO . . . . . 0.458 ' HD3' ' CB ' ' A' ' 64' ' ' MET . 22.7 Cg_exo -61.16 127.87 23.44 Favored 'Trans proline' 0 N--CA 1.493 1.483 0 O-C-N 122.946 0.972 . . . . 0.0 110.733 -179.08 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 76.1 tttt -143.97 122.03 12.13 Favored 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.697 -0.627 . . . . 0.0 110.042 178.795 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 92.0 m-20 -101.32 -38.86 7.87 Favored 'General case' 0 N--CA 1.495 1.808 0 O-C-N 121.669 -0.644 . . . . 0.0 110.581 -177.391 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . -66.36 -43.45 92.66 Favored Glycine 0 N--CA 1.497 2.717 0 N-CA-C 109.904 -1.278 . . . . 0.0 109.904 -177.363 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 5.2 m 55.37 33.84 21.66 Favored 'General case' 0 N--CA 1.506 2.363 0 O-C-N 121.575 -0.956 . . . . 0.0 110.771 -178.554 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 52.7 mttp -108.57 161.11 15.38 Favored 'General case' 0 N--CA 1.497 1.884 0 O-C-N 121.599 -0.688 . . . . 0.0 110.125 177.563 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 15.5 m -68.7 159.63 81.0 Favored Pre-proline 0 N--CA 1.499 2.004 0 O-C-N 121.755 -0.591 . . . . 0.0 110.15 179.444 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 22.3 Cg_exo -61.05 -42.24 37.92 Favored 'Trans proline' 0 N--CA 1.49 1.295 0 O-C-N 123.509 1.268 . . . . 0.0 110.76 -179.094 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 49.6 m -131.38 143.52 50.54 Favored 'General case' 0 N--CA 1.495 1.801 0 O-C-N 121.661 -0.649 . . . . 0.0 110.261 179.713 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 42.0 p -80.45 -32.12 37.28 Favored 'General case' 0 N--CA 1.499 1.996 0 O-C-N 121.686 -0.634 . . . . 0.0 110.251 178.665 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 17.1 t-20 -98.55 155.2 17.4 Favored 'General case' 0 N--CA 1.494 1.769 0 O-C-N 121.596 -0.69 . . . . 0.0 110.138 179.852 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 50.0 m -110.21 151.01 27.84 Favored 'General case' 0 N--CA 1.495 1.821 0 O-C-N 121.717 -0.614 . . . . 0.0 110.214 -179.715 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 9.5 t -130.27 166.09 21.08 Favored 'General case' 0 N--CA 1.497 1.893 0 O-C-N 121.657 -0.652 . . . . 0.0 110.439 -179.37 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 90.5 mttt -86.56 137.34 32.59 Favored 'General case' 0 N--CA 1.497 1.876 0 O-C-N 121.741 -0.6 . . . . 0.0 110.161 -179.438 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 83.4 mt -68.81 -34.78 76.09 Favored 'General case' 0 N--CA 1.499 1.992 0 O-C-N 121.639 -0.663 . . . . 0.0 110.23 179.826 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 98.9 mttt -65.24 -43.9 89.93 Favored 'General case' 0 N--CA 1.5 2.063 0 O-C-N 121.638 -0.663 . . . . 0.0 110.481 -178.568 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 49.4 m -135.22 148.0 49.49 Favored 'General case' 0 N--CA 1.495 1.816 0 O-C-N 121.646 -0.659 . . . . 0.0 110.253 -179.562 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -142.65 -63.07 0.42 Allowed 'General case' 0 N--CA 1.494 1.757 0 O-C-N 121.739 -0.6 . . . . 0.0 110.207 179.478 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 13.7 pt-20 -66.22 -31.03 71.61 Favored 'General case' 0 N--CA 1.5 2.056 0 O-C-N 121.696 -0.628 . . . . 0.0 110.669 -179.954 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 23.9 m -106.71 140.5 39.47 Favored 'General case' 0 N--CA 1.495 1.802 0 O-C-N 121.628 -0.67 . . . . 0.0 110.258 -179.27 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 53.8 p90 -141.73 166.41 24.82 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.671 -0.643 . . . . 0.0 110.305 179.864 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 48.2 m -118.78 147.48 43.84 Favored 'General case' 0 N--CA 1.495 1.814 0 O-C-N 121.606 -0.684 . . . . 0.0 110.178 -179.931 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 12.6 t -90.41 -41.21 11.6 Favored 'General case' 0 N--CA 1.497 1.879 0 O-C-N 121.664 -0.648 . . . . 0.0 110.204 -179.694 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 68.7 mttt -134.92 124.68 25.34 Favored 'General case' 0 N--CA 1.495 1.792 0 O-C-N 121.716 -0.615 . . . . 0.0 110.197 179.77 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 29.9 m120 -91.16 -37.29 13.45 Favored 'General case' 0 N--CA 1.496 1.844 0 O-C-N 121.689 -0.632 . . . . 0.0 110.191 179.638 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 84.0 tttt -65.69 -39.88 91.72 Favored 'General case' 0 N--CA 1.5 2.028 0 O-C-N 121.671 -0.643 . . . . 0.0 110.398 -179.514 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 91' ' ' TRP . . . . . . . . . . . . . 75.0 t-105 -89.97 -56.9 3.05 Favored 'General case' 0 N--CA 1.497 1.88 0 O-C-N 121.665 -0.647 . . . . 0.0 110.191 -179.71 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 36.5 t 52.66 -175.37 0.03 OUTLIER 'General case' 0 N--CA 1.506 2.326 0 O-C-N 121.588 -0.695 . . . . 0.0 110.999 -179.601 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 93' ' ' MET . . . . . . . . . . . . . 89.7 mtp -119.18 152.17 37.07 Favored 'General case' 0 N--CA 1.495 1.824 0 O-C-N 121.642 -0.661 . . . . 0.0 110.162 179.904 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 18.6 t70 . . . . . 0 N--CA 1.506 2.331 0 CA-C-O 118.027 -0.987 . . . . 0.0 110.964 -179.808 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' B' B ' 240' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.357 0 N-CA-C 109.573 -1.411 . . . . 0.0 109.573 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' B' B ' 241' ' ' ALA . . . . . . . . . . . . . . . -100.26 31.63 3.31 Favored 'General case' 0 N--CA 1.495 1.802 0 O-C-N 121.628 -0.925 . . . . 0.0 110.317 179.712 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 242' ' ' THR . . . . . . . . . . . . . 40.3 p -126.25 164.61 20.62 Favored 'General case' 0 N--CA 1.497 1.882 0 O-C-N 121.63 -0.669 . . . . 0.0 110.065 179.639 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 243' ' ' THR . . . . . . . . . . . . . 36.6 p -103.21 151.53 22.53 Favored 'General case' 0 N--CA 1.495 1.804 0 O-C-N 121.682 -0.636 . . . . 0.0 110.161 179.561 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 244' ' ' LYS . . . . . . . . . . . . . 21.7 ttmt -97.6 -34.69 10.86 Favored 'General case' 0 N--CA 1.495 1.809 0 O-C-N 121.72 -0.613 . . . . 0.0 110.306 -179.168 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 245' ' ' GLU . . . . . . . . . . . . . 45.6 tt0 -65.95 -37.51 86.2 Favored 'General case' 0 N--CA 1.499 1.995 0 O-C-N 121.706 -0.621 . . . . 0.0 110.339 -178.66 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 246' ' ' LYS . . . . . . . . . . . . . 47.7 mtmt -131.1 139.5 49.86 Favored 'General case' 0 N--CA 1.496 1.85 0 O-C-N 121.705 -0.622 . . . . 0.0 110.291 -179.72 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 247' ' ' ASN . . . . . . . . . . . . . 29.8 m120 -130.58 32.38 4.41 Favored 'General case' 0 N--CA 1.496 1.845 0 O-C-N 121.573 -0.705 . . . . 0.0 110.24 178.974 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 248' ' ' ILE . . . . . . . . . . . . . 51.2 mm -77.94 -34.44 19.46 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.03 0 O-C-N 121.549 -0.719 . . . . 0.0 109.884 -178.904 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 249' ' ' SER . . . . . . . . . . . . . 24.4 m -64.69 -41.51 95.99 Favored 'General case' 0 N--CA 1.5 2.063 0 O-C-N 121.617 -0.677 . . . . 0.0 110.479 -178.685 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 250' ' ' VAL . . . . . . . . . . . . . 46.0 t -87.44 -51.82 12.31 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.975 0 O-C-N 121.633 -0.667 . . . . 0.0 109.545 179.449 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 251' ' ' ASP . . . . . . . . . . . . . 26.0 t0 52.18 71.28 0.48 Allowed 'General case' 0 N--CA 1.506 2.354 0 O-C-N 121.734 -0.604 . . . . 0.0 111.305 177.946 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 252' ' ' VAL . . . . . . . . . . . . . 13.5 p -161.6 124.22 0.36 Allowed 'Isoleucine or valine' 0 N--CA 1.497 1.899 0 O-C-N 121.51 -0.744 . . . . 0.0 110.152 176.174 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 253' ' ' ASP . . . . . . . . . . . . . 74.4 m-20 -82.87 121.04 26.43 Favored 'General case' 0 N--CA 1.496 1.862 0 O-C-N 121.635 -0.666 . . . . 0.0 110.261 178.479 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 254' ' ' ALA . . . . . . . . . . . . . . . -67.5 -36.14 80.51 Favored 'General case' 0 N--CA 1.499 2.01 0 O-C-N 121.594 -0.692 . . . . 0.0 110.305 179.36 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 255' ' ' ASP . . . . . . . . . . . . . 4.0 p30 -73.02 -28.12 62.17 Favored 'General case' 0 N--CA 1.5 2.035 0 O-C-N 121.709 -0.619 . . . . 0.0 110.652 -179.777 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 256' ' ' ALA . . . . . . . . . . . . . . . -63.02 -33.55 75.67 Favored 'General case' 0 N--CA 1.501 2.089 0 O-C-N 121.535 -0.728 . . . . 0.0 110.414 -179.561 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 257' ' ' SER . . . . . . . . . . . . . 22.0 m -55.49 -36.33 66.54 Favored 'General case' 0 N--CA 1.503 2.185 0 O-C-N 121.565 -0.709 . . . . 0.0 110.361 177.67 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 258' ' ' SER . . . . . . . . . . . . . 23.8 m -69.33 -34.28 74.41 Favored 'General case' 0 N--CA 1.498 1.95 0 C-N-CA 120.402 -0.519 . . . . 0.0 110.176 179.303 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 259' ' ' GLN . . . . . . . . . . . . . 78.2 mt-30 -64.66 -34.47 78.36 Favored 'General case' 0 N--CA 1.5 2.058 0 O-C-N 121.606 -0.684 . . . . 0.0 110.407 -179.931 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 260' ' ' LEU . . . . . . . . . . . . . 77.9 mt -66.57 -41.57 88.39 Favored 'General case' 0 N--CA 1.5 2.028 0 O-C-N 121.716 -0.615 . . . . 0.0 110.223 179.371 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 261' ' ' LEU . . . . . . . . . . . . . 33.5 tp -70.03 -35.67 74.49 Favored 'General case' 0 N--CA 1.498 1.973 0 C-N-CA 120.132 -0.627 . . . . 0.0 109.798 176.997 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 262' ' ' SER . . . . . . . . . . . . . 23.2 m -62.47 -37.68 86.89 Favored 'General case' 0 N--CA 1.5 2.067 0 O-C-N 121.683 -0.636 . . . . 0.0 110.468 177.241 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 263' ' ' LEU . . . . . . . . . . . . . 21.6 mt -65.02 -43.02 93.83 Favored 'General case' 0 N--CA 1.5 2.067 0 O-C-N 121.718 -0.613 . . . . 0.0 110.292 179.195 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 264' ' ' LEU . . . . . . . . . . . . . 79.7 mt -62.76 -32.75 73.95 Favored 'General case' 0 N--CA 1.502 2.145 0 O-C-N 121.744 -0.597 . . . . 0.0 110.726 179.036 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 265' ' ' LYS . . . . . . . . . . . . . 53.2 tttm -74.54 -39.44 62.32 Favored 'General case' 0 N--CA 1.498 1.928 0 O-C-N 121.677 -0.639 . . . . 0.0 110.142 -177.97 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 266' ' ' SER . . . . . . . . . . . . . 9.6 m -163.05 155.93 19.06 Favored 'General case' 0 N--CA 1.496 1.829 0 O-C-N 121.697 -0.627 . . . . 0.0 110.203 -179.829 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 267' ' ' SER . . . . . . . . . . . . . 51.0 m -121.37 154.39 36.53 Favored 'General case' 0 N--CA 1.495 1.804 0 O-C-N 121.734 -0.604 . . . . 0.0 110.099 179.455 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 268' ' ' THR . . . . . . . . . . . . . 23.5 m -69.12 134.65 49.6 Favored 'General case' 0 N--CA 1.498 1.953 0 O-C-N 121.682 -0.636 . . . . 0.0 110.119 -179.676 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 269' ' ' ALA . . . . . . . . . . . . . . . 54.0 178.07 0.03 OUTLIER Pre-proline 0 N--CA 1.507 2.39 0 O-C-N 121.508 -0.745 . . . . 0.0 111.088 -178.115 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 270' ' ' PRO . . . . . . . . . . . . . 17.7 Cg_exo -63.28 132.39 35.97 Favored 'Trans proline' 0 N--CA 1.491 1.329 0 O-C-N 123.516 1.272 . . . . 0.0 110.479 179.416 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 271' ' ' SER . . . . . . . . . . . . . 11.0 t -98.3 -47.6 5.38 Favored 'General case' 0 N--CA 1.494 1.763 0 O-C-N 121.61 -0.682 . . . . 0.0 110.242 179.812 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 272' ' ' ASP . . . . . . . . . . . . . 9.7 m-20 -67.24 -38.92 85.99 Favored 'General case' 0 N--CA 1.5 2.05 0 O-C-N 121.708 -0.62 . . . . 0.0 110.322 179.994 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 273' ' ' LEU . . . . . . . . . . . . . 6.7 tt 51.15 90.6 0.02 OUTLIER 'General case' 0 N--CA 1.505 2.311 0 O-C-N 121.545 -0.722 . . . . 0.0 111.029 -179.111 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 274' ' ' ALA . . . . . . . . . . . . . . . 50.15 -171.7 0.02 OUTLIER 'General case' 0 N--CA 1.506 2.37 0 O-C-N 121.62 -0.675 . . . . 0.0 111.211 -178.687 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 275' ' ' THR . . . . . . . . . . . . . 6.0 t -123.65 61.91 23.42 Favored Pre-proline 0 N--CA 1.498 1.933 0 O-C-N 121.618 -0.676 . . . . 0.0 110.284 179.511 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 276' ' ' PRO . . . . . . . . . . . . . 29.7 Cg_endo -67.79 150.98 79.12 Favored 'Trans proline' 0 N--CA 1.487 1.144 0 O-C-N 123.531 1.279 . . . . 0.0 110.404 179.637 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 277' ' ' GLN . . . . . . . . . . . . . 40.6 mt-30 -82.37 156.19 68.83 Favored Pre-proline 0 N--CA 1.497 1.883 0 O-C-N 121.665 -0.647 . . . . 0.0 110.11 179.496 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 278' ' ' PRO . . . . . . . . . . . . . 25.8 Cg_endo -66.5 137.39 46.45 Favored 'Trans proline' 0 N--CA 1.489 1.218 0 O-C-N 123.687 1.362 . . . . 0.0 110.408 -179.232 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 279' ' ' SER . . . . . . . . . . . . . 49.8 m -123.79 144.17 49.87 Favored 'General case' 0 N--CA 1.495 1.788 0 O-C-N 121.607 -0.683 . . . . 0.0 110.272 179.492 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 280' ' ' THR . . . . . . . . . . . . . 24.7 m -128.93 140.15 51.8 Favored 'General case' 0 N--CA 1.496 1.866 0 O-C-N 121.708 -0.62 . . . . 0.0 110.124 179.792 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 281' ' ' PHE . . . . . . . . . . . . . 60.1 m-85 -127.38 154.92 77.23 Favored Pre-proline 0 N--CA 1.495 1.78 0 O-C-N 121.671 -0.643 . . . . 0.0 110.206 179.177 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 282' ' ' PRO . . . . . . . . . . . . . 30.4 Cg_endo -68.27 137.66 40.83 Favored 'Trans proline' 0 N--CA 1.486 1.074 0 O-C-N 123.636 1.335 . . . . 0.0 110.465 -179.007 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 283' ' ' GLN . . . . . . . . . . . . . 1.8 mp0 52.33 89.16 0.1 Allowed Pre-proline 0 N--CA 1.506 2.332 0 O-C-N 121.656 -0.652 . . . . 0.0 111.137 178.769 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 284' ' ' PRO . . . . . . . . . . . . . 30.4 Cg_endo -68.51 154.33 71.92 Favored 'Trans proline' 0 N--CA 1.486 1.081 0 O-C-N 123.485 1.255 . . . . 0.0 110.27 178.625 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 285' ' ' PRO . . . . . . . . . . . . . 26.2 Cg_endo -66.56 131.25 25.63 Favored 'Trans proline' 0 N--CA 1.49 1.271 0 O-C-N 123.632 1.333 . . . . 0.0 110.393 -179.323 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 286' ' ' VAL . . . . . . . . . . . . . 57.8 t -87.13 -56.38 5.36 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.912 0 O-C-N 121.686 -0.634 . . . . 0.0 109.803 179.874 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 287' ' ' GLU . . . . . . . . . . . . . 34.3 tt0 -104.61 -54.23 2.55 Favored 'General case' 0 N--CA 1.495 1.784 0 O-C-N 121.651 -0.655 . . . . 0.0 110.27 -178.851 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 288' ' ' SER . . . . . . . . . . . . . 23.3 t 54.0 178.98 0.03 OUTLIER 'General case' 0 N--CA 1.505 2.3 0 O-C-N 121.596 -0.69 . . . . 0.0 111.147 -178.82 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 289' ' ' HIS . . . . . . . . . . . . . 76.4 m80 -95.39 -49.2 5.55 Favored 'General case' 0 N--CA 1.495 1.79 0 O-C-N 121.614 -0.679 . . . . 0.0 110.268 -179.686 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 290' ' ' SER . . . . . . . . . . . . . 50.6 m -124.49 148.7 47.54 Favored 'General case' 0 N--CA 1.495 1.812 0 O-C-N 121.671 -0.643 . . . . 0.0 110.267 -179.896 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 291' ' ' SER . . . . . . . . . . . . . 1.9 t . . . . . 0 N--CA 1.506 2.346 0 CA-C-O 117.996 -1.002 . . . . 0.0 110.988 179.794 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' -1' ' ' MET . . . . . . . . . . . . . 84.0 mtp . . . . . 0 N--CA 1.492 1.666 0 CA-C-O 120.962 0.411 . . . . 0.0 110.216 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 0' ' ' GLY . . . . . . . . . . . . . . . -175.48 -172.37 40.28 Favored Glycine 0 N--CA 1.494 2.514 0 N-CA-C 109.502 -1.439 . . . . 0.0 109.502 -179.853 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 74.5 mtm -110.69 170.65 7.95 Favored 'General case' 0 N--CA 1.496 1.827 0 O-C-N 121.719 -0.871 . . . . 0.0 110.149 179.92 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 63.5 m -101.03 163.68 12.17 Favored 'General case' 0 N--CA 1.495 1.79 0 O-C-N 121.701 -0.624 . . . . 0.0 110.076 -179.175 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 74.6 t -66.77 -27.71 40.79 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.014 0 O-C-N 121.65 -0.656 . . . . 0.0 110.099 179.798 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -55.12 -30.94 60.79 Favored 'General case' 0 N--CA 1.504 2.228 0 O-C-N 121.434 -0.791 . . . . 0.0 110.369 -179.854 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -68.76 -30.88 69.57 Favored 'General case' 0 N--CA 1.499 1.991 0 O-C-N 121.783 -0.573 . . . . 0.0 110.24 174.676 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 91.1 m-85 -95.81 10.11 38.21 Favored 'General case' 0 N--CA 1.497 1.895 0 O-C-N 121.584 -0.697 . . . . 0.0 111.637 -178.0 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 3.1 m-30 -67.35 133.36 49.48 Favored 'General case' 0 N--CA 1.502 2.174 0 O-C-N 121.088 -1.007 . . . . 0.0 110.043 173.801 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 82.38 1.88 90.51 Favored Glycine 0 N--CA 1.496 2.644 0 N-CA-C 110.625 -0.99 . . . . 0.0 110.625 -176.854 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 52.8 m -77.42 137.13 38.52 Favored 'General case' 0 N--CA 1.498 1.955 0 O-C-N 121.111 -1.229 . . . . 0.0 110.476 176.365 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 2.6 m-20 -85.24 121.85 28.57 Favored 'General case' 0 N--CA 1.499 1.981 0 O-C-N 121.606 -0.684 . . . . 0.0 109.506 173.739 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 30.9 m -144.0 161.08 15.77 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.774 0 C-N-CA 120.151 -0.62 . . . . 0.0 109.885 -179.403 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 48.1 tt0 -109.33 147.23 33.03 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.737 -0.602 . . . . 0.0 109.6 177.124 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 60.1 t -135.74 126.96 44.37 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.825 0 O-C-N 121.559 -0.713 . . . . 0.0 109.924 -173.758 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 26.3 tp -95.91 125.6 40.58 Favored 'General case' 0 N--CA 1.492 1.665 0 N-CA-C 109.192 -0.67 . . . . 0.0 109.192 173.955 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 87.5 mt -93.12 170.51 9.59 Favored 'General case' 0 N--CA 1.497 1.889 0 O-C-N 121.67 -0.644 . . . . 0.0 110.951 -174.372 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 24.7 p30 -57.19 -21.55 34.15 Favored 'General case' 0 N--CA 1.505 2.309 0 O-C-N 121.738 -0.601 . . . . 0.0 111.575 -178.213 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 53.1 p-10 -91.6 22.04 4.31 Favored 'General case' 0 N--CA 1.499 1.975 0 O-C-N 121.571 -0.706 . . . . 0.0 110.933 -177.989 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 74.4 m-20 58.9 27.92 16.85 Favored 'General case' 0 N--CA 1.506 2.331 0 O-C-N 121.433 -0.792 . . . . 0.0 110.714 175.399 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 50.7 m -108.98 145.84 34.85 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.494 -0.754 . . . . 0.0 109.674 173.128 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 80.3 mttt -109.68 140.03 44.02 Favored 'General case' 0 N--CA 1.495 1.777 0 O-C-N 121.57 -0.706 . . . . 0.0 110.481 -177.342 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -153.14 137.83 16.95 Favored 'General case' 0 N--CA 1.497 1.878 0 O-C-N 121.785 -0.572 . . . . 0.0 110.178 177.008 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 9.7 ptp180 -124.37 158.59 32.32 Favored 'General case' 0 N--CA 1.497 1.899 0 O-C-N 121.575 -0.703 . . . . 0.0 110.197 -179.219 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -171.82 171.24 44.01 Favored Glycine 0 N--CA 1.493 2.447 0 N-CA-C 109.087 -1.605 . . . . 0.0 109.087 -178.337 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 20.0 t -94.69 122.15 45.9 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.878 0 O-C-N 121.626 -0.926 . . . . 0.0 109.162 175.803 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 87.9 mt -63.05 141.39 18.18 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.272 0 O-C-N 121.508 -0.745 . . . . 0.0 110.351 -171.988 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 13.7 p -121.11 -26.04 5.19 Favored 'General case' 0 N--CA 1.495 1.785 0 O-C-N 121.728 -0.607 . . . . 0.0 111.304 -179.906 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 26.9 t30 -162.87 160.24 24.78 Favored 'General case' 0 N--CA 1.5 2.062 0 O-C-N 120.965 -1.084 . . . . 0.0 111.789 179.936 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 87.8 t80 -150.09 127.1 11.18 Favored 'General case' 0 N--CA 1.498 1.96 0 N-CA-C 109.468 -0.568 . . . . 0.0 109.468 169.804 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 21.7 t70 -97.89 127.73 44.03 Favored 'General case' 0 N--CA 1.493 1.681 0 N-CA-C 109.111 -0.7 . . . . 0.0 109.111 -178.675 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 88.3 p -65.82 -44.62 85.03 Favored 'General case' 0 N--CA 1.499 1.985 0 O-C-N 121.607 -0.683 . . . . 0.0 110.755 -174.745 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 22.4 t -58.86 -48.1 82.57 Favored 'General case' 0 N--CA 1.502 2.158 0 O-C-N 121.446 -0.784 . . . . 0.0 111.002 -173.372 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 91.4 m-20 -107.03 -2.66 20.87 Favored 'General case' 0 N--CA 1.498 1.963 0 O-C-N 121.616 -0.678 . . . . 0.0 111.62 -178.932 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 3.4 m 49.2 67.24 0.91 Allowed 'General case' 0 N--CA 1.507 2.416 0 O-C-N 121.058 -1.026 . . . . 0.0 110.903 -174.027 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 44.8 mm -116.22 125.83 73.45 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.025 0 O-C-N 121.512 -0.743 . . . . 0.0 109.162 -175.656 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 8.1 tp -115.83 121.53 42.69 Favored 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.636 -0.665 . . . . 0.0 110.569 -167.805 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 98.5 mt-30 -91.0 133.16 35.52 Favored 'General case' 0 N--CA 1.489 1.515 0 N-CA-C 109.351 -0.611 . . . . 0.0 109.351 172.392 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 19.2 mt -117.84 123.58 46.25 Favored 'General case' 0 N--CA 1.495 1.793 0 C-N-CA 120.294 -0.562 . . . . 0.0 110.086 175.579 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 56.3 ttt85 -103.86 104.93 14.99 Favored 'General case' 0 N--CA 1.496 1.843 0 O-C-N 121.803 -0.561 . . . . 0.0 110.125 173.632 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 61.1 tp -84.38 155.66 22.2 Favored 'General case' 0 N--CA 1.498 1.938 0 O-C-N 121.577 -0.702 . . . . 0.0 110.639 -176.647 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -68.3 -2.93 9.32 Favored 'General case' 0 N--CA 1.502 2.141 0 O-C-N 121.865 -0.522 . . . . 0.0 112.213 -170.548 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 7.0 m120 -86.7 28.16 0.91 Allowed 'General case' 0 N--CA 1.497 1.925 0 O-C-N 121.039 -1.038 . . . . 0.0 110.954 174.551 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 13.4 t0 64.9 28.77 12.64 Favored 'General case' 0 N--CA 1.505 2.298 0 O-C-N 121.205 -0.934 . . . . 0.0 110.388 175.528 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 66.5 m -125.92 138.03 53.75 Favored 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.437 -0.79 . . . . 0.0 110.113 178.633 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 9.8 t -128.29 146.78 50.65 Favored 'General case' 0 N--CA 1.495 1.813 0 O-C-N 121.702 -0.624 . . . . 0.0 109.928 178.197 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 46.3 mtmt -150.18 141.84 23.6 Favored 'General case' 0 N--CA 1.497 1.894 0 C-N-CA 120.129 -0.628 . . . . 0.0 110.655 -177.812 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 89.8 p -95.84 121.95 38.11 Favored 'General case' 0 N--CA 1.495 1.799 0 O-C-N 121.839 -0.538 . . . . 0.0 110.089 176.771 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 83.1 mt -129.32 135.8 60.92 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.789 0 O-C-N 121.616 -0.677 . . . . 0.0 109.349 -179.76 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 65.4 t -81.84 127.69 39.38 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.861 0 O-C-N 121.577 -0.702 . . . . 0.0 109.224 179.755 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 37.5 p -58.7 -24.87 62.21 Favored 'General case' 0 N--CA 1.505 2.298 0 O-C-N 121.547 -0.721 . . . . 0.0 111.915 -169.959 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 33.5 tttp -56.46 -23.14 36.98 Favored 'General case' 0 N--CA 1.503 2.214 0 O-C-N 121.485 -0.759 . . . . 0.0 111.09 -177.141 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 51.7 p30 -83.05 0.73 43.55 Favored 'General case' 0 N--CA 1.5 2.029 0 C-N-CA 119.762 -0.775 . . . . 0.0 111.24 176.199 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 98.8 mt -75.81 126.79 36.92 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.038 0 O-C-N 121.193 -0.942 . . . . 0.0 109.955 177.829 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 79.6 tttt -91.28 -29.5 17.13 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.829 -0.545 . . . . 0.0 109.849 171.165 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 5.4 m-20 -164.15 157.3 17.9 Favored 'General case' 0 N--CA 1.5 2.063 0 O-C-N 121.768 -0.582 . . . . 0.0 110.093 -178.585 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 84.6 mt -133.01 151.24 52.09 Favored 'General case' 0 N--CA 1.497 1.894 0 O-C-N 121.674 -0.641 . . . . 0.0 110.576 -179.525 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 6.2 ptm180 -152.63 136.87 16.56 Favored 'General case' 0 N--CA 1.495 1.798 0 O-C-N 121.833 -0.542 . . . . 0.0 109.732 174.818 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 64.6 mt -83.51 133.17 29.74 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.846 0 O-C-N 121.522 -0.736 . . . . 0.0 109.81 176.212 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 22.6 mt -82.21 157.62 67.97 Favored Pre-proline 0 N--CA 1.497 1.915 0 O-C-N 121.633 -0.667 . . . . 0.0 109.964 -179.301 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 22.3 Cg_endo -65.39 134.23 37.94 Favored 'Trans proline' 0 N--CA 1.489 1.235 0 O-C-N 123.722 1.38 . . . . 0.0 110.585 -177.565 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 48.0 mttp -114.2 175.16 5.59 Favored 'General case' 0 N--CA 1.495 1.807 0 O-C-N 121.7 -0.625 . . . . 0.0 110.155 178.797 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 26.7 t30 -98.76 30.64 3.23 Favored 'General case' 0 N--CA 1.494 1.774 0 O-C-N 121.715 -0.616 . . . . 0.0 110.567 179.458 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 26.9 tp10 -123.55 147.47 47.24 Favored 'General case' 0 N--CA 1.495 1.783 0 O-C-N 121.578 -0.701 . . . . 0.0 110.0 179.799 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 85.9 mt -67.58 -36.2 75.47 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.088 0 O-C-N 121.654 -0.654 . . . . 0.0 109.818 -178.895 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 64' ' ' MET . . . . . . . . . . . . . 6.8 tpt 52.27 90.52 0.08 OUTLIER Pre-proline 0 N--CA 1.507 2.389 0 O-C-N 121.595 -0.691 . . . . 0.0 110.905 -179.888 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 23.2 Cg_endo -65.79 145.56 81.11 Favored 'Trans proline' 0 N--CA 1.489 1.244 0 O-C-N 123.513 1.27 . . . . 0.0 110.493 -179.668 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 50.1 tttm -119.93 146.43 45.81 Favored 'General case' 0 N--CA 1.495 1.814 0 O-C-N 121.709 -0.62 . . . . 0.0 110.123 -179.927 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 42.8 t30 -92.52 120.9 33.44 Favored 'General case' 0 N--CA 1.495 1.82 0 O-C-N 121.72 -0.612 . . . . 0.0 110.256 -179.502 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 157.3 90.19 0.08 OUTLIER Glycine 0 N--CA 1.494 2.501 0 N-CA-C 109.496 -1.442 . . . . 0.0 109.496 -179.892 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 23.9 m -66.35 -38.93 88.75 Favored 'General case' 0 N--CA 1.5 2.032 0 O-C-N 121.764 -0.845 . . . . 0.0 110.306 -179.455 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 34.6 tptt -109.11 129.12 55.47 Favored 'General case' 0 N--CA 1.495 1.794 0 O-C-N 121.672 -0.642 . . . . 0.0 110.19 -179.879 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 1.6 t -142.89 151.19 55.75 Favored Pre-proline 0 N--CA 1.494 1.766 0 O-C-N 121.65 -0.656 . . . . 0.0 110.121 179.195 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 35.8 Cg_endo -70.08 102.38 1.07 Allowed 'Trans proline' 0 N--CA 1.487 1.104 0 O-C-N 123.528 1.278 . . . . 0.0 110.285 -179.907 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 27.4 t -160.52 -65.33 0.07 Allowed 'General case' 0 N--CA 1.496 1.847 0 O-C-N 121.733 -0.605 . . . . 0.0 110.203 179.457 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 25.5 m -129.57 136.9 50.37 Favored 'General case' 0 N--CA 1.495 1.792 0 O-C-N 121.705 -0.622 . . . . 0.0 110.162 179.969 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 39.4 t30 -112.1 99.55 8.15 Favored 'General case' 0 N--CA 1.495 1.792 0 O-C-N 121.618 -0.676 . . . . 0.0 110.181 179.033 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 51.1 m -125.99 146.86 49.7 Favored 'General case' 0 N--CA 1.495 1.797 0 O-C-N 121.729 -0.607 . . . . 0.0 110.246 -179.792 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 18.9 m -119.29 31.74 6.45 Favored 'General case' 0 N--CA 1.496 1.863 0 O-C-N 121.756 -0.59 . . . . 0.0 110.312 179.203 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 53.7 tptt -83.22 -62.26 1.64 Allowed 'General case' 0 N--CA 1.497 1.888 0 O-C-N 121.608 -0.683 . . . . 0.0 110.181 -178.912 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . 0.428 ' N ' ' CD1' ' A' ' 79' ' ' LEU . 0.0 OUTLIER -161.12 179.04 8.72 Favored 'General case' 0 N--CA 1.496 1.842 0 O-C-N 121.655 -0.653 . . . . 0.0 110.596 -179.3 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 50.1 mttp -114.74 149.13 37.36 Favored 'General case' 0 N--CA 1.495 1.821 0 O-C-N 121.598 -0.689 . . . . 0.0 110.212 -179.896 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 27.2 t -98.94 146.08 26.37 Favored 'General case' 0 N--CA 1.495 1.808 0 O-C-N 121.751 -0.593 . . . . 0.0 110.259 -179.248 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -81.87 -173.12 4.28 Favored 'General case' 0 N--CA 1.498 1.93 0 O-C-N 121.73 -0.607 . . . . 0.0 110.161 -179.538 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 54.5 mt-10 -66.15 -33.04 74.87 Favored 'General case' 0 N--CA 1.5 2.053 0 O-C-N 121.668 -0.645 . . . . 0.0 110.435 -179.526 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 40.9 p -90.92 156.0 18.31 Favored 'General case' 0 N--CA 1.497 1.905 0 O-C-N 121.682 -0.636 . . . . 0.0 110.101 -179.598 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 70.7 t80 -135.57 142.13 45.28 Favored 'General case' 0 N--CA 1.495 1.781 0 O-C-N 121.752 -0.592 . . . . 0.0 110.186 -179.959 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 49.7 m -120.09 144.92 47.35 Favored 'General case' 0 N--CA 1.494 1.773 0 O-C-N 121.661 -0.649 . . . . 0.0 110.147 179.376 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 29.4 t -135.66 140.94 44.89 Favored 'General case' 0 N--CA 1.496 1.842 0 O-C-N 121.756 -0.59 . . . . 0.0 110.248 179.916 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 88.2 mttt -105.5 142.66 34.86 Favored 'General case' 0 N--CA 1.495 1.788 0 O-C-N 121.722 -0.611 . . . . 0.0 110.159 179.407 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 30.0 m120 -64.82 -35.59 81.61 Favored 'General case' 0 N--CA 1.501 2.111 0 O-C-N 121.679 -0.638 . . . . 0.0 110.238 179.161 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 52.5 mttp -128.28 143.8 51.06 Favored 'General case' 0 N--CA 1.494 1.765 0 O-C-N 121.704 -0.622 . . . . 0.0 110.068 178.573 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 91' ' ' TRP . . . . . . . . . . . . . 74.3 t-105 -101.84 126.5 48.74 Favored 'General case' 0 N--CA 1.494 1.751 0 O-C-N 121.672 -0.643 . . . . 0.0 110.175 179.665 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 65.0 m 51.99 -172.41 0.03 OUTLIER 'General case' 0 N--CA 1.506 2.365 0 O-C-N 121.609 -0.682 . . . . 0.0 111.055 -179.759 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 93' ' ' MET . . . . . . . . . . . . . 74.2 mtm -63.03 -34.04 76.72 Favored 'General case' 0 N--CA 1.501 2.09 0 O-C-N 121.659 -0.65 . . . . 0.0 110.413 179.755 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 3.3 p30 . . . . . 0 N--CA 1.497 1.917 0 CA-C-O 117.972 -1.013 . . . . 0.0 110.307 179.817 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' B' B ' 240' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.367 0 N-CA-C 109.576 -1.41 . . . . 0.0 109.576 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' B' B ' 241' ' ' ALA . . . . . . . . . . . . . . . -66.76 -32.99 74.64 Favored 'General case' 0 N--CA 1.501 2.093 0 O-C-N 121.696 -0.884 . . . . 0.0 110.283 179.958 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 242' ' ' THR . . . . . . . . . . . . . 24.2 m -116.13 138.23 51.43 Favored 'General case' 0 N--CA 1.496 1.827 0 O-C-N 121.676 -0.64 . . . . 0.0 110.159 179.83 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 243' ' ' THR . . . . . . . . . . . . . 6.4 t -136.72 159.6 41.35 Favored 'General case' 0 N--CA 1.498 1.938 0 O-C-N 121.707 -0.62 . . . . 0.0 110.406 179.695 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 244' ' ' LYS . . . . . . . . . . . . . 51.5 tttm -65.62 -37.56 86.95 Favored 'General case' 0 N--CA 1.5 2.067 0 O-C-N 121.677 -0.639 . . . . 0.0 110.475 -178.972 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 245' ' ' GLU . . . . . . . . . . . . . 80.4 mt-10 -95.79 146.76 24.28 Favored 'General case' 0 N--CA 1.496 1.842 0 O-C-N 121.665 -0.647 . . . . 0.0 110.217 -178.806 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 246' ' ' LYS . . . . . . . . . . . . . 84.3 mttt -105.85 121.49 44.17 Favored 'General case' 0 N--CA 1.494 1.759 0 O-C-N 121.729 -0.607 . . . . 0.0 110.326 -179.283 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 247' ' ' ASN . . . . . . . . . . . . . 92.7 m-20 -118.62 124.03 46.44 Favored 'General case' 0 N--CA 1.496 1.845 0 O-C-N 121.69 -0.631 . . . . 0.0 109.992 177.584 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 248' ' ' ILE . . . . . . . . . . . . . 50.6 mm 52.24 93.3 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.507 2.383 0 O-C-N 121.572 -0.705 . . . . 0.0 110.51 -178.416 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 249' ' ' SER . . . . . . . . . . . . . 95.1 p -101.24 152.3 20.83 Favored 'General case' 0 N--CA 1.496 1.838 0 O-C-N 121.675 -0.641 . . . . 0.0 110.291 -177.851 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 250' ' ' VAL . . . . . . . . . . . . . 31.6 m -150.89 33.26 0.09 OUTLIER 'Isoleucine or valine' 0 N--CA 1.498 1.968 0 O-C-N 121.761 -0.587 . . . . 0.0 109.99 179.824 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 251' ' ' ASP . . . . . . . . . . . . . 74.4 m-20 51.85 37.62 21.15 Favored 'General case' 0 N--CA 1.506 2.35 0 O-C-N 121.586 -0.696 . . . . 0.0 110.992 -179.362 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 252' ' ' VAL . . . . . . . . . . . . . 53.2 t 52.69 94.37 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.508 2.451 0 O-C-N 121.588 -0.695 . . . . 0.0 110.84 179.252 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 253' ' ' ASP . . . . . . . . . . . . . 74.6 m-20 53.53 55.43 8.62 Favored 'General case' 0 N--CA 1.506 2.372 0 O-C-N 121.639 -0.663 . . . . 0.0 111.055 177.787 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 254' ' ' ALA . . . . . . . . . . . . . . . -65.97 -32.82 74.54 Favored 'General case' 0 N--CA 1.501 2.104 0 O-C-N 121.495 -0.753 . . . . 0.0 110.236 179.53 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 255' ' ' ASP . . . . . . . . . . . . . 74.3 m-20 -73.88 -31.66 63.24 Favored 'General case' 0 N--CA 1.499 1.984 0 O-C-N 121.542 -0.724 . . . . 0.0 110.327 179.147 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 256' ' ' ALA . . . . . . . . . . . . . . . -63.67 -37.84 88.86 Favored 'General case' 0 N--CA 1.5 2.055 0 O-C-N 121.539 -0.725 . . . . 0.0 110.32 179.603 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 257' ' ' SER . . . . . . . . . . . . . 54.6 p -55.75 -36.64 67.52 Favored 'General case' 0 N--CA 1.503 2.199 0 O-C-N 121.643 -0.661 . . . . 0.0 110.462 178.551 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 258' ' ' SER . . . . . . . . . . . . . 23.8 m -70.21 -31.95 69.62 Favored 'General case' 0 N--CA 1.498 1.955 0 C-N-CA 120.383 -0.527 . . . . 0.0 110.47 -179.335 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 259' ' ' GLN . . . . . . . . . . . . . 98.6 mt-30 -63.66 -40.84 97.85 Favored 'General case' 0 N--CA 1.501 2.109 0 O-C-N 121.511 -0.743 . . . . 0.0 110.542 -178.536 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 260' ' ' LEU . . . . . . . . . . . . . 84.2 mt -72.96 -41.63 64.21 Favored 'General case' 0 N--CA 1.498 1.955 0 O-C-N 121.635 -0.666 . . . . 0.0 110.295 -179.587 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 261' ' ' LEU . . . . . . . . . . . . . 20.7 tp -69.75 -38.46 76.82 Favored 'General case' 0 N--CA 1.497 1.909 0 O-C-N 121.655 -0.653 . . . . 0.0 109.884 178.857 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 262' ' ' SER . . . . . . . . . . . . . 88.8 p -63.32 -35.5 80.58 Favored 'General case' 0 N--CA 1.499 1.987 0 O-C-N 121.71 -0.619 . . . . 0.0 110.674 177.263 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 263' ' ' LEU . . . . . . . . . . . . . 26.7 mt -64.99 -42.05 94.86 Favored 'General case' 0 N--CA 1.501 2.098 0 O-C-N 121.564 -0.71 . . . . 0.0 110.366 -179.734 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 264' ' ' LEU . . . . . . . . . . . . . 86.4 mt -62.68 -38.72 91.47 Favored 'General case' 0 N--CA 1.502 2.134 0 O-C-N 121.667 -0.646 . . . . 0.0 110.401 178.328 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 265' ' ' LYS . . . . . . . . . . . . . 92.9 mttt -76.38 -37.07 57.72 Favored 'General case' 0 N--CA 1.496 1.864 0 O-C-N 121.649 -0.657 . . . . 0.0 109.988 178.976 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 266' ' ' SER . . . . . . . . . . . . . 25.2 p 47.77 -169.06 0.02 OUTLIER 'General case' 0 N--CA 1.507 2.387 0 CA-C-O 121.049 0.452 . . . . 0.0 111.61 179.842 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 267' ' ' SER . . . . . . . . . . . . . 93.8 p -133.32 152.17 51.91 Favored 'General case' 0 N--CA 1.494 1.774 0 O-C-N 121.7 -0.625 . . . . 0.0 110.141 179.118 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 268' ' ' THR . . . . . . . . . . . . . 41.0 p -128.22 157.82 39.81 Favored 'General case' 0 N--CA 1.497 1.889 0 O-C-N 121.668 -0.645 . . . . 0.0 110.135 -179.945 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 269' ' ' ALA . . . . . 0.4 ' N ' ' CD ' ' B' ' 270' ' ' PRO . . . -70.91 -49.34 13.61 Favored Pre-proline 0 N--CA 1.499 1.981 0 O-C-N 121.672 -0.643 . . . . 0.0 110.764 -179.804 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 270' ' ' PRO . . . . . 0.4 ' CD ' ' N ' ' B' ' 269' ' ' ALA . 33.7 Cg_exo -57.14 151.86 48.4 Favored 'Trans proline' 0 N--CA 1.493 1.449 0 O-C-N 123.121 1.064 . . . . 0.0 110.975 179.3 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 271' ' ' SER . . . . . . . . . . . . . 86.9 p -70.68 172.26 8.99 Favored 'General case' 0 N--CA 1.498 1.931 0 O-C-N 121.721 -0.612 . . . . 0.0 110.317 -179.057 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 272' ' ' ASP . . . . . . . . . . . . . 3.9 p30 -99.03 34.21 2.17 Favored 'General case' 0 N--CA 1.497 1.891 0 O-C-N 121.73 -0.606 . . . . 0.0 110.372 -179.84 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 273' ' ' LEU . . . . . . . . . . . . . 20.8 tp -160.81 155.6 23.91 Favored 'General case' 0 N--CA 1.495 1.817 0 O-C-N 121.637 -0.664 . . . . 0.0 109.95 -179.186 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 274' ' ' ALA . . . . . . . . . . . . . . . 51.58 -167.28 0.04 OUTLIER 'General case' 0 N--CA 1.505 2.307 0 O-C-N 121.615 -0.678 . . . . 0.0 110.96 -177.95 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 275' ' ' THR . . . . . . . . . . . . . 18.3 p -68.67 151.62 97.14 Favored Pre-proline 0 N--CA 1.498 1.969 0 O-C-N 121.649 -0.657 . . . . 0.0 110.203 -178.573 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 276' ' ' PRO . . . . . . . . . . . . . 31.0 Cg_endo -68.58 155.69 68.1 Favored 'Trans proline' 0 N--CA 1.487 1.123 0 O-C-N 123.651 1.343 . . . . 0.0 110.346 -179.589 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 277' ' ' GLN . . . . . . . . . . . . . 13.6 mm100 -122.23 75.66 41.74 Favored Pre-proline 0 N--CA 1.496 1.856 0 O-C-N 121.718 -0.614 . . . . 0.0 110.067 179.262 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 278' ' ' PRO . . . . . . . . . . . . . 26.7 Cg_endo -66.68 -30.59 41.76 Favored 'Trans proline' 0 N--CA 1.489 1.228 0 O-C-N 123.492 1.259 . . . . 0.0 110.635 -179.748 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 279' ' ' SER . . . . . . . . . . . . . 33.3 t -103.27 146.56 28.26 Favored 'General case' 0 N--CA 1.494 1.766 0 O-C-N 121.619 -0.676 . . . . 0.0 110.279 -179.288 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 280' ' ' THR . . . . . . . . . . . . . 10.2 m 54.78 99.4 0.01 OUTLIER 'General case' 0 N--CA 1.506 2.349 0 O-C-N 121.734 -0.604 . . . . 0.0 110.997 -179.042 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 281' ' ' PHE . . . . . . . . . . . . . 1.9 m-85 -61.2 -48.24 92.28 Favored Pre-proline 0 N--CA 1.502 2.138 0 O-C-N 121.608 -0.682 . . . . 0.0 110.89 -179.554 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 282' ' ' PRO . . . . . . . . . . . . . 23.7 Cg_exo -59.49 144.17 99.49 Favored 'Trans proline' 0 N--CA 1.493 1.448 0 O-C-N 123.192 1.101 . . . . 0.0 110.633 175.544 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 283' ' ' GLN . . . . . . . . . . . . . 33.7 mt-30 -93.58 146.15 31.26 Favored Pre-proline 0 N--CA 1.494 1.762 0 O-C-N 121.69 -0.632 . . . . 0.0 110.165 -179.669 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 284' ' ' PRO . . . . . . . . . . . . . 40.2 Cg_endo -72.85 154.16 53.47 Favored 'Trans proline' 0 N--CA 1.486 1.078 0 O-C-N 123.597 1.314 . . . . 0.0 110.169 -179.992 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 285' ' ' PRO . . . . . . . . . . . . . 26.1 Cg_endo -67.11 142.84 62.89 Favored 'Trans proline' 0 N--CA 1.489 1.209 0 O-C-N 123.604 1.318 . . . . 0.0 110.342 178.766 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 286' ' ' VAL . . . . . . . . . . . . . 57.4 t -69.62 -34.46 61.46 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.032 0 O-C-N 121.637 -0.664 . . . . 0.0 109.871 -179.812 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 287' ' ' GLU . . . . . . . . . . . . . 55.1 mt-10 -64.82 -36.0 82.91 Favored 'General case' 0 N--CA 1.501 2.11 0 O-C-N 121.702 -0.624 . . . . 0.0 110.633 -177.096 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 288' ' ' SER . . . . . . . . . . . . . 28.2 t -138.77 144.74 39.53 Favored 'General case' 0 N--CA 1.495 1.823 0 O-C-N 121.647 -0.658 . . . . 0.0 110.364 -179.01 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 289' ' ' HIS . . . . . . . . . . . . . 50.5 p-80 -116.52 130.02 56.52 Favored 'General case' 0 N--CA 1.497 1.898 0 O-C-N 121.73 -0.606 . . . . 0.0 110.322 179.955 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 290' ' ' SER . . . . . . . . . . . . . 25.0 m -66.64 -34.4 77.8 Favored 'General case' 0 N--CA 1.5 2.074 0 O-C-N 121.729 -0.607 . . . . 0.0 110.261 179.63 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 291' ' ' SER . . . . . . . . . . . . . 49.1 m . . . . . 0 N--CA 1.495 1.781 0 CA-C-O 117.995 -1.003 . . . . 0.0 110.192 -179.658 . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' -1' ' ' MET . . . . . . . . . . . . . 56.5 ttp . . . . . 0 N--CA 1.492 1.644 0 CA-C-O 120.97 0.414 . . . . 0.0 110.161 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 0' ' ' GLY . . . . . . . . . . . . . . . 85.14 -169.09 43.53 Favored Glycine 0 N--CA 1.495 2.613 0 N-CA-C 109.376 -1.49 . . . . 0.0 109.376 -179.369 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 88.8 mtp -121.83 139.3 53.8 Favored 'General case' 0 N--CA 1.495 1.817 0 O-C-N 121.638 -0.919 . . . . 0.0 110.263 179.701 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 70.0 m -101.06 168.24 9.72 Favored 'General case' 0 N--CA 1.496 1.833 0 O-C-N 121.764 -0.585 . . . . 0.0 110.245 179.726 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 49.9 t -65.74 -27.92 42.68 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.198 0 O-C-N 121.654 -0.654 . . . . 0.0 110.138 179.595 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -55.58 -31.99 62.68 Favored 'General case' 0 N--CA 1.501 2.123 0 O-C-N 121.394 -0.816 . . . . 0.0 110.334 -179.838 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 74.2 m-20 -68.65 -35.38 77.18 Favored 'General case' 0 N--CA 1.498 1.937 0 O-C-N 121.809 -0.557 . . . . 0.0 109.956 175.387 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 97.6 m-85 -97.9 10.06 41.18 Favored 'General case' 0 N--CA 1.498 1.965 0 O-C-N 121.746 -0.596 . . . . 0.0 111.226 178.812 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -67.49 126.95 30.91 Favored 'General case' 0 N--CA 1.501 2.095 0 O-C-N 121.241 -0.912 . . . . 0.0 110.052 178.752 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 81.95 2.11 90.47 Favored Glycine 0 N--CA 1.497 2.716 0 N-CA-C 110.695 -0.962 . . . . 0.0 110.695 -176.938 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 59.6 p -77.86 142.66 38.37 Favored 'General case' 0 N--CA 1.497 1.924 0 O-C-N 121.061 -1.258 . . . . 0.0 110.065 175.31 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 1.9 m120 -85.27 117.53 24.26 Favored 'General case' 0 N--CA 1.5 2.028 0 N-CA-C 109.064 -0.717 . . . . 0.0 109.064 176.303 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 29.8 m -142.21 158.88 20.08 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.89 0 C-N-CA 120.164 -0.614 . . . . 0.0 109.983 -179.152 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . 0.447 ' HA ' ' HA ' ' A' ' 22' ' ' ARG . 46.4 tt0 -109.4 129.53 55.54 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.619 -0.676 . . . . 0.0 110.107 178.772 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 58.9 t -106.68 127.59 62.04 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.733 0 O-C-N 121.589 -0.695 . . . . 0.0 109.961 -178.917 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 28.3 tp -95.84 127.67 42.06 Favored 'General case' 0 N--CA 1.493 1.689 0 N-CA-C 109.096 -0.705 . . . . 0.0 109.096 173.947 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 87.9 mt -96.47 169.26 10.03 Favored 'General case' 0 N--CA 1.495 1.814 0 O-C-N 121.567 -0.708 . . . . 0.0 111.168 -172.793 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 24.2 p30 -57.59 -22.14 43.21 Favored 'General case' 0 N--CA 1.507 2.398 0 O-C-N 121.94 -0.475 . . . . 0.0 111.636 -177.123 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 44.6 p-10 -92.53 22.83 4.36 Favored 'General case' 0 N--CA 1.498 1.943 0 O-C-N 121.522 -0.736 . . . . 0.0 110.905 -176.995 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 74.5 m-20 58.56 27.5 15.77 Favored 'General case' 0 N--CA 1.505 2.312 0 O-C-N 121.465 -0.772 . . . . 0.0 110.637 176.078 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 48.0 m -106.29 143.6 34.18 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.519 -0.738 . . . . 0.0 109.597 172.859 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 66.5 mttt -109.73 148.86 30.66 Favored 'General case' 0 N--CA 1.494 1.749 0 O-C-N 121.579 -0.701 . . . . 0.0 110.556 -176.229 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -153.07 154.21 34.41 Favored 'General case' 0 N--CA 1.496 1.834 0 O-C-N 121.729 -0.607 . . . . 0.0 110.105 176.066 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . 0.447 ' HA ' ' HA ' ' A' ' 12' ' ' GLU . 30.8 ptt180 -138.69 151.17 46.94 Favored 'General case' 0 N--CA 1.497 1.913 0 O-C-N 121.597 -0.689 . . . . 0.0 110.466 179.341 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -171.9 171.27 44.04 Favored Glycine 0 N--CA 1.492 2.394 0 N-CA-C 108.956 -1.658 . . . . 0.0 108.956 -178.71 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 30.3 t -94.56 124.85 47.21 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.815 0 O-C-N 121.571 -0.958 . . . . 0.0 109.125 175.498 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 51.0 mt -61.87 134.77 27.07 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.171 0 O-C-N 121.428 -0.795 . . . . 0.0 110.834 -171.839 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 11.0 p -121.21 -16.94 7.84 Favored 'General case' 0 N--CA 1.494 1.765 0 O-C-N 121.916 -0.49 . . . . 0.0 111.61 -177.844 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 13.5 t30 -166.09 157.38 13.49 Favored 'General case' 0 N--CA 1.504 2.251 0 O-C-N 120.927 -1.108 . . . . 0.0 111.75 175.61 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 72.0 t80 -150.28 122.15 8.15 Favored 'General case' 0 N--CA 1.496 1.855 0 N-CA-C 109.225 -0.657 . . . . 0.0 109.225 173.459 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 26.6 t0 -99.12 130.45 45.44 Favored 'General case' 0 N--CA 1.491 1.614 0 N-CA-C 109.139 -0.689 . . . . 0.0 109.139 -178.022 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 19.3 m -70.55 -51.88 25.53 Favored 'General case' 0 N--CA 1.497 1.916 0 C-N-CA 120.0 -0.68 . . . . 0.0 110.54 -176.081 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 31.5 m -60.71 -40.79 93.6 Favored 'General case' 0 N--CA 1.501 2.116 0 O-C-N 121.617 -0.677 . . . . 0.0 110.847 -174.813 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 91.6 m-20 -103.85 -9.97 18.57 Favored 'General case' 0 N--CA 1.497 1.914 0 O-C-N 121.678 -0.639 . . . . 0.0 111.616 -177.579 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 15.0 m 49.83 67.26 0.93 Allowed 'General case' 0 N--CA 1.508 2.468 0 O-C-N 121.142 -0.974 . . . . 0.0 110.899 -174.665 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 43.9 mm -120.8 125.93 74.64 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.997 0 O-C-N 121.623 -0.673 . . . . 0.0 109.26 -175.645 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 14.8 tp -115.93 118.89 34.22 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.691 -0.63 . . . . 0.0 110.451 -170.659 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 78.4 mt-30 -90.96 132.75 35.77 Favored 'General case' 0 N--CA 1.489 1.517 0 N-CA-C 109.21 -0.663 . . . . 0.0 109.21 171.863 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 56.7 mt -117.77 123.57 46.32 Favored 'General case' 0 N--CA 1.493 1.693 0 C-N-CA 120.214 -0.594 . . . . 0.0 109.946 175.435 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 74.2 ttt-85 -104.27 104.87 14.84 Favored 'General case' 0 N--CA 1.496 1.835 0 O-C-N 121.716 -0.615 . . . . 0.0 109.97 173.643 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 63.7 tp -85.01 156.76 20.98 Favored 'General case' 0 N--CA 1.498 1.926 0 O-C-N 121.622 -0.674 . . . . 0.0 110.607 -176.339 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -66.82 -3.0 5.79 Favored 'General case' 0 N--CA 1.502 2.168 0 O-C-N 121.927 -0.483 . . . . 0.0 112.203 -170.954 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 91.6 m-20 -86.01 28.94 0.76 Allowed 'General case' 0 N--CA 1.498 1.946 0 O-C-N 120.97 -1.081 . . . . 0.0 110.765 172.364 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 10.2 m-20 59.34 31.4 21.1 Favored 'General case' 0 N--CA 1.504 2.243 0 O-C-N 121.244 -0.91 . . . . 0.0 110.419 174.372 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 66.2 m -124.64 137.83 54.35 Favored 'General case' 0 N--CA 1.496 1.865 0 O-C-N 121.486 -0.759 . . . . 0.0 110.439 178.877 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 8.5 t -103.93 151.13 23.53 Favored 'General case' 0 N--CA 1.498 1.933 0 O-C-N 121.816 -0.553 . . . . 0.0 110.262 176.32 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 39.0 ttmt -149.81 119.15 6.85 Favored 'General case' 0 N--CA 1.495 1.819 0 O-C-N 121.616 -0.677 . . . . 0.0 110.365 178.224 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 88.6 p -94.93 121.4 36.49 Favored 'General case' 0 N--CA 1.495 1.811 0 O-C-N 121.781 -0.575 . . . . 0.0 110.264 179.936 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 81.7 mt -129.28 135.14 62.5 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.853 0 O-C-N 121.686 -0.634 . . . . 0.0 109.342 179.572 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 67.6 t -81.61 127.63 39.42 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.862 0 N-CA-C 109.069 -0.715 . . . . 0.0 109.069 177.35 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 59.6 p -58.28 -24.85 60.82 Favored 'General case' 0 N--CA 1.503 2.2 0 O-C-N 121.492 -0.755 . . . . 0.0 111.855 -168.337 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 19.0 tptm -56.89 -26.65 59.4 Favored 'General case' 0 N--CA 1.501 2.118 0 O-C-N 121.531 -0.731 . . . . 0.0 111.024 -177.12 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 4.9 p30 -85.1 6.85 23.81 Favored 'General case' 0 N--CA 1.498 1.958 0 C-N-CA 119.748 -0.781 . . . . 0.0 111.42 176.562 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 98.4 mt -75.34 124.25 32.86 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.115 0 O-C-N 121.171 -0.956 . . . . 0.0 109.849 175.704 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 23.2 tptp -92.06 -29.11 16.74 Favored 'General case' 0 N--CA 1.494 1.774 0 O-C-N 121.801 -0.562 . . . . 0.0 109.879 171.081 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 5.2 m-20 -163.62 155.08 16.76 Favored 'General case' 0 N--CA 1.5 2.052 0 O-C-N 121.813 -0.554 . . . . 0.0 110.11 -178.145 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 85.1 mt -132.99 149.65 52.22 Favored 'General case' 0 N--CA 1.497 1.903 0 O-C-N 121.736 -0.603 . . . . 0.0 110.432 -179.04 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 7.7 ptm180 -151.74 141.59 21.98 Favored 'General case' 0 N--CA 1.494 1.757 0 O-C-N 121.706 -0.621 . . . . 0.0 109.925 175.861 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 69.5 mt -85.65 133.13 30.27 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.881 0 O-C-N 121.482 -0.762 . . . . 0.0 109.776 173.78 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 79.2 mt -84.56 161.16 54.72 Favored Pre-proline 0 N--CA 1.496 1.869 0 O-C-N 121.616 -0.677 . . . . 0.0 110.07 178.611 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 24.9 Cg_endo -66.15 131.73 27.71 Favored 'Trans proline' 0 N--CA 1.488 1.165 0 O-C-N 123.628 1.331 . . . . 0.0 110.477 179.658 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 52.9 tttm -102.78 -53.93 2.75 Favored 'General case' 0 N--CA 1.495 1.797 0 O-C-N 121.698 -0.627 . . . . 0.0 110.302 -179.669 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 37.6 t30 -98.4 136.15 38.96 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.681 -0.637 . . . . 0.0 110.279 -178.764 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 74.8 mm-40 -101.48 162.96 12.52 Favored 'General case' 0 N--CA 1.495 1.812 0 O-C-N 121.626 -0.671 . . . . 0.0 110.233 179.683 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 18.2 tt -121.66 141.19 43.15 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.859 0 O-C-N 121.655 -0.653 . . . . 0.0 110.179 -179.455 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 64' ' ' MET . . . . . . . . . . . . . 23.8 ttm 52.16 67.49 3.98 Favored Pre-proline 0 N--CA 1.505 2.292 0 O-C-N 121.569 -0.707 . . . . 0.0 110.884 -179.32 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 25.7 Cg_endo -66.28 -35.09 33.35 Favored 'Trans proline' 0 N--CA 1.488 1.159 0 O-C-N 123.434 1.229 . . . . 0.0 110.503 -179.139 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 73.7 tttt -140.43 115.52 9.8 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.605 -0.684 . . . . 0.0 110.243 -179.986 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 15.4 t-20 -74.4 -37.25 63.44 Favored 'General case' 0 N--CA 1.498 1.943 0 O-C-N 121.741 -0.599 . . . . 0.0 110.178 178.36 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 173.94 -173.36 45.86 Favored Glycine 0 N--CA 1.494 2.518 0 N-CA-C 109.448 -1.461 . . . . 0.0 109.448 -179.581 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 23.0 m -97.54 113.38 25.07 Favored 'General case' 0 N--CA 1.494 1.749 0 O-C-N 121.632 -0.922 . . . . 0.0 110.175 179.745 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 47.8 mttp -144.88 164.35 31.34 Favored 'General case' 0 N--CA 1.495 1.814 0 O-C-N 121.723 -0.611 . . . . 0.0 110.211 179.598 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 2.3 t -120.34 78.66 27.37 Favored Pre-proline 0 N--CA 1.495 1.825 0 O-C-N 121.656 -0.653 . . . . 0.0 109.955 178.355 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 27.8 Cg_endo -67.03 -38.3 16.63 Favored 'Trans proline' 0 N--CA 1.489 1.261 0 O-C-N 123.546 1.287 . . . . 0.0 110.493 -178.323 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 88.4 p -147.08 156.85 43.35 Favored 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.707 -0.62 . . . . 0.0 110.348 -179.309 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 24.3 m -68.04 -32.66 73.18 Favored 'General case' 0 N--CA 1.498 1.951 0 O-C-N 121.75 -0.594 . . . . 0.0 110.297 178.988 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 28.0 t30 55.97 40.15 30.45 Favored 'General case' 0 N--CA 1.505 2.314 0 O-C-N 121.508 -0.745 . . . . 0.0 110.748 -178.679 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 49.9 m -123.34 152.28 41.64 Favored 'General case' 0 N--CA 1.495 1.806 0 O-C-N 121.644 -0.66 . . . . 0.0 110.097 178.995 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 23.9 m -79.0 131.19 36.21 Favored 'General case' 0 N--CA 1.497 1.889 0 O-C-N 121.648 -0.658 . . . . 0.0 110.183 -179.15 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 43.7 mmtt -130.51 143.63 50.88 Favored 'General case' 0 N--CA 1.496 1.826 0 O-C-N 121.621 -0.674 . . . . 0.0 110.164 179.454 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 83.0 mt -67.12 -34.73 78.24 Favored 'General case' 0 N--CA 1.5 2.044 0 O-C-N 121.686 -0.633 . . . . 0.0 110.14 179.064 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 90.2 mttt -102.11 168.9 9.08 Favored 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.741 -0.599 . . . . 0.0 110.147 179.322 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 50.2 m -108.68 149.16 29.35 Favored 'General case' 0 N--CA 1.495 1.82 0 O-C-N 121.675 -0.641 . . . . 0.0 110.174 -179.784 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -68.61 151.36 46.83 Favored 'General case' 0 N--CA 1.498 1.96 0 O-C-N 121.65 -0.656 . . . . 0.0 110.173 -179.479 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 41.1 tt0 -94.54 137.09 34.08 Favored 'General case' 0 N--CA 1.495 1.777 0 O-C-N 121.648 -0.658 . . . . 0.0 110.184 -179.658 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 10.1 t -134.32 156.71 47.98 Favored 'General case' 0 N--CA 1.497 1.897 0 O-C-N 121.782 -0.574 . . . . 0.0 110.236 179.532 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 97.5 m-85 -113.7 103.24 11.02 Favored 'General case' 0 N--CA 1.495 1.796 0 O-C-N 121.642 -0.662 . . . . 0.0 110.23 179.896 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 93.3 p -163.92 99.4 0.87 Allowed 'General case' 0 N--CA 1.496 1.829 0 O-C-N 121.635 -0.665 . . . . 0.0 110.11 179.231 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 78.6 p -66.96 -30.35 70.46 Favored 'General case' 0 N--CA 1.5 2.032 0 O-C-N 121.711 -0.618 . . . . 0.0 110.374 179.908 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 71.4 tttt 54.0 47.07 24.22 Favored 'General case' 0 N--CA 1.505 2.296 0 O-C-N 121.556 -0.715 . . . . 0.0 110.969 178.196 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 28.0 p-10 -162.68 -39.55 0.04 OUTLIER 'General case' 0 N--CA 1.498 1.949 0 O-C-N 121.545 -0.722 . . . . 0.0 110.664 178.172 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 36.2 ttmt -131.85 125.81 32.71 Favored 'General case' 0 N--CA 1.496 1.826 0 O-C-N 121.552 -0.718 . . . . 0.0 110.086 177.859 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 91' ' ' TRP . . . . . . . . . . . . . 45.9 p-90 -143.27 162.93 34.36 Favored 'General case' 0 N--CA 1.496 1.841 0 O-C-N 121.688 -0.632 . . . . 0.0 110.299 -179.923 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 48.4 m -120.66 147.15 45.64 Favored 'General case' 0 N--CA 1.496 1.852 0 O-C-N 121.733 -0.605 . . . . 0.0 110.198 -179.88 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 93' ' ' MET . . . . . . . . . . . . . 24.0 ttt -106.96 137.48 44.95 Favored 'General case' 0 N--CA 1.494 1.771 0 O-C-N 121.724 -0.61 . . . . 0.0 110.209 179.993 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 4.5 p-10 . . . . . 0 N--CA 1.498 1.942 0 CA-C-O 117.997 -1.001 . . . . 0.0 110.253 179.856 . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' B' B ' 240' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.334 0 N-CA-C 109.529 -1.428 . . . . 0.0 109.529 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' B' B ' 241' ' ' ALA . . . . . . . . . . . . . . . -100.33 134.75 42.81 Favored 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.679 -0.895 . . . . 0.0 110.231 -179.867 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 242' ' ' THR . . . . . . . . . . . . . 9.8 t -139.15 161.42 37.45 Favored 'General case' 0 N--CA 1.496 1.827 0 O-C-N 121.676 -0.64 . . . . 0.0 110.356 179.721 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 243' ' ' THR . . . . . . . . . . . . . 24.6 m -113.95 128.78 56.54 Favored 'General case' 0 N--CA 1.495 1.824 0 O-C-N 121.636 -0.665 . . . . 0.0 110.215 -179.872 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 244' ' ' LYS . . . . . . . . . . . . . 67.7 mttt -140.75 155.15 46.5 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.71 -0.619 . . . . 0.0 110.132 179.126 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 245' ' ' GLU . . . . . . . . . . . . . 54.1 mt-10 -66.09 -33.68 76.34 Favored 'General case' 0 N--CA 1.5 2.048 0 O-C-N 121.69 -0.631 . . . . 0.0 110.318 179.775 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 246' ' ' LYS . . . . . . . . . . . . . 34.7 tttp -98.62 135.45 40.12 Favored 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.561 -0.712 . . . . 0.0 110.172 179.108 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 247' ' ' ASN . . . . . . . . . . . . . 27.2 p30 -140.35 -177.45 5.03 Favored 'General case' 0 N--CA 1.497 1.913 0 O-C-N 121.67 -0.644 . . . . 0.0 110.393 -179.55 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 248' ' ' ILE . . . . . . . . . . . . . 50.7 mm 54.11 96.82 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.508 2.452 0 O-C-N 121.631 -0.668 . . . . 0.0 110.659 -179.787 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 249' ' ' SER . . . . . . . . . . . . . 33.9 t -89.16 161.82 16.26 Favored 'General case' 0 N--CA 1.495 1.823 0 O-C-N 121.704 -0.622 . . . . 0.0 110.172 179.596 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 250' ' ' VAL . . . . . . . . . . . . . 35.1 m -90.21 14.45 1.33 Allowed 'Isoleucine or valine' 0 N--CA 1.503 2.181 0 O-C-N 121.698 -0.626 . . . . 0.0 111.435 -179.34 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 251' ' ' ASP . . . . . . . . . . . . . 74.3 m-20 -82.17 -3.22 54.5 Favored 'General case' 0 N--CA 1.499 1.995 0 O-C-N 121.266 -0.896 . . . . 0.0 111.37 179.407 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 252' ' ' VAL . . . . . . . . . . . . . 39.9 t 58.37 164.33 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.51 2.54 0 O-C-N 121.363 -0.836 . . . . 0.0 110.595 -178.994 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 253' ' ' ASP . . . . . . . . . . . . . 74.6 m-20 -81.42 117.82 22.18 Favored 'General case' 0 N--CA 1.497 1.913 0 O-C-N 121.417 -0.802 . . . . 0.0 110.294 -179.289 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 254' ' ' ALA . . . . . . . . . . . . . . . -67.42 -28.59 68.02 Favored 'General case' 0 N--CA 1.501 2.098 0 O-C-N 121.689 -0.632 . . . . 0.0 110.497 177.837 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 255' ' ' ASP . . . . . . . . . . . . . 74.5 m-20 -72.04 -25.97 62.01 Favored 'General case' 0 N--CA 1.499 2.019 0 O-C-N 121.62 -0.675 . . . . 0.0 110.751 -178.908 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 256' ' ' ALA . . . . . . . . . . . . . . . -61.67 -35.37 77.78 Favored 'General case' 0 N--CA 1.501 2.122 0 O-C-N 121.4 -0.813 . . . . 0.0 110.541 -178.056 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 257' ' ' SER . . . . . . . . . . . . . 32.2 t -55.14 -35.0 64.26 Favored 'General case' 0 N--CA 1.505 2.28 0 O-C-N 121.61 -0.681 . . . . 0.0 110.327 177.238 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 258' ' ' SER . . . . . . . . . . . . . 24.1 m -68.01 -31.39 71.05 Favored 'General case' 0 N--CA 1.497 1.919 0 C-N-CA 120.513 -0.475 . . . . 0.0 110.225 178.87 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 259' ' ' GLN . . . . . . . . . . . . . 48.7 tt0 -63.26 -37.12 86.01 Favored 'General case' 0 N--CA 1.5 2.027 0 O-C-N 121.647 -0.658 . . . . 0.0 110.37 178.714 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 260' ' ' LEU . . . . . . . . . . . . . 82.1 mt -64.18 -43.75 94.14 Favored 'General case' 0 N--CA 1.501 2.079 0 O-C-N 121.628 -0.67 . . . . 0.0 110.248 179.184 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 261' ' ' LEU . . . . . . . . . . . . . 17.5 tp -70.69 -38.36 73.68 Favored 'General case' 0 N--CA 1.497 1.915 0 O-C-N 121.662 -0.649 . . . . 0.0 109.733 175.919 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 262' ' ' SER . . . . . . . . . . . . . 23.1 t -62.38 -35.56 79.56 Favored 'General case' 0 N--CA 1.501 2.093 0 O-C-N 121.681 -0.637 . . . . 0.0 110.52 176.639 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 263' ' ' LEU . . . . . . . . . . . . . 18.3 mt -64.53 -42.0 96.01 Favored 'General case' 0 N--CA 1.501 2.101 0 O-C-N 121.689 -0.632 . . . . 0.0 110.254 179.679 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 264' ' ' LEU . . . . . . . . . . . . . 87.6 mt -62.51 -38.62 90.64 Favored 'General case' 0 N--CA 1.502 2.146 0 O-C-N 121.691 -0.631 . . . . 0.0 110.509 178.715 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 265' ' ' LYS . . . . . . . . . . . . . 96.1 mttt -75.71 -32.84 60.24 Favored 'General case' 0 N--CA 1.498 1.949 0 O-C-N 121.743 -0.598 . . . . 0.0 110.272 -179.874 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 266' ' ' SER . . . . . . . . . . . . . 7.7 m -162.94 149.08 12.26 Favored 'General case' 0 N--CA 1.494 1.762 0 O-C-N 121.589 -0.694 . . . . 0.0 110.069 179.262 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 267' ' ' SER . . . . . . . . . . . . . 14.2 m -120.91 32.34 6.01 Favored 'General case' 0 N--CA 1.495 1.809 0 O-C-N 121.63 -0.669 . . . . 0.0 110.421 -179.36 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 268' ' ' THR . . . . . . . . . . . . . 43.1 p -69.73 -35.66 75.18 Favored 'General case' 0 N--CA 1.498 1.958 0 O-C-N 121.564 -0.71 . . . . 0.0 110.016 179.564 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 269' ' ' ALA . . . . . . . . . . . . . . . 47.92 85.32 0.18 Allowed Pre-proline 0 N--CA 1.506 2.329 0 O-C-N 121.77 -0.582 . . . . 0.0 111.323 -179.16 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 270' ' ' PRO . . . . . . . . . . . . . 18.9 Cg_exo -62.75 142.13 87.91 Favored 'Trans proline' 0 N--CA 1.49 1.29 0 O-C-N 123.513 1.27 . . . . 0.0 110.524 179.318 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 271' ' ' SER . . . . . . . . . . . . . 90.5 p -143.77 157.81 44.12 Favored 'General case' 0 N--CA 1.495 1.813 0 O-C-N 121.704 -0.622 . . . . 0.0 110.291 -179.944 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 272' ' ' ASP . . . . . . . . . . . . . 74.2 m-20 -102.11 145.51 29.25 Favored 'General case' 0 N--CA 1.495 1.81 0 O-C-N 121.666 -0.646 . . . . 0.0 110.268 179.634 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 273' ' ' LEU . . . . . . . . . . . . . 4.3 mm? 51.12 -171.84 0.03 OUTLIER 'General case' 0 N--CA 1.505 2.318 0 O-C-N 121.651 -0.656 . . . . 0.0 111.184 -179.932 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 274' ' ' ALA . . . . . . . . . . . . . . . 51.22 -174.8 0.02 OUTLIER 'General case' 0 N--CA 1.505 2.292 0 O-C-N 121.682 -0.636 . . . . 0.0 111.275 -179.383 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 275' ' ' THR . . . . . . . . . . . . . 22.8 p -150.44 164.62 19.83 Favored Pre-proline 0 N--CA 1.494 1.751 0 O-C-N 121.636 -0.665 . . . . 0.0 110.259 -179.839 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 276' ' ' PRO . . . . . . . . . . . . . 19.9 Cg_exo -62.32 152.9 73.88 Favored 'Trans proline' 0 N--CA 1.491 1.34 0 O-C-N 123.591 1.311 . . . . 0.0 110.615 179.144 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 277' ' ' GLN . . . . . . . . . . . . . 13.3 pt20 -114.1 161.84 26.08 Favored Pre-proline 0 N--CA 1.498 1.973 0 O-C-N 121.641 -0.662 . . . . 0.0 110.347 -179.876 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 278' ' ' PRO . . . . . . . . . . . . . 19.7 Cg_exo -62.19 138.83 74.61 Favored 'Trans proline' 0 N--CA 1.491 1.34 0 O-C-N 123.656 1.345 . . . . 0.0 110.703 -179.24 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 279' ' ' SER . . . . . . . . . . . . . 86.8 p -122.81 32.52 5.7 Favored 'General case' 0 N--CA 1.495 1.822 0 O-C-N 121.628 -0.67 . . . . 0.0 110.207 178.7 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 280' ' ' THR . . . . . . . . . . . . . 24.3 m -65.56 -36.97 85.35 Favored 'General case' 0 N--CA 1.501 2.084 0 O-C-N 121.626 -0.671 . . . . 0.0 110.447 -178.301 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 281' ' ' PHE . . . . . . . . . . . . . 89.0 m-85 -109.03 162.6 19.46 Favored Pre-proline 0 N--CA 1.495 1.796 0 O-C-N 121.701 -0.624 . . . . 0.0 110.298 -178.692 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 282' ' ' PRO . . . . . . . . . . . . . 19.4 Cg_exo -62.36 153.91 67.36 Favored 'Trans proline' 0 N--CA 1.49 1.275 0 O-C-N 123.587 1.309 . . . . 0.0 110.626 179.759 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 283' ' ' GLN . . . . . . . . . . . . . 58.0 mm-40 -88.35 156.21 51.2 Favored Pre-proline 0 N--CA 1.496 1.832 0 O-C-N 121.651 -0.655 . . . . 0.0 110.24 179.975 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 284' ' ' PRO . . . . . . . . . . . . . 29.9 Cg_endo -68.06 157.39 61.99 Favored 'Trans proline' 0 N--CA 1.487 1.132 0 O-C-N 123.667 1.351 . . . . 0.0 110.383 -179.537 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 285' ' ' PRO . . . . . . . . . . . . . 26.1 Cg_endo -66.45 152.79 80.1 Favored 'Trans proline' 0 N--CA 1.487 1.146 0 O-C-N 123.652 1.343 . . . . 0.0 110.45 179.746 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 286' ' ' VAL . . . . . . . . . . . . . 62.0 t -109.45 135.39 48.55 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.884 0 O-C-N 121.651 -0.656 . . . . 0.0 109.775 -179.584 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 287' ' ' GLU . . . . . . . . . . . . . 79.2 mt-10 -109.82 157.88 18.72 Favored 'General case' 0 N--CA 1.496 1.834 0 O-C-N 121.718 -0.614 . . . . 0.0 110.194 179.875 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 288' ' ' SER . . . . . . . . . . . . . 49.1 m -68.22 153.77 43.07 Favored 'General case' 0 N--CA 1.498 1.975 0 O-C-N 121.591 -0.693 . . . . 0.0 110.266 -179.815 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 289' ' ' HIS . . . . . . . . . . . . . 48.3 p-80 -128.86 33.29 4.64 Favored 'General case' 0 N--CA 1.497 1.895 0 O-C-N 121.713 -0.617 . . . . 0.0 110.377 -179.78 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 290' ' ' SER . . . . . . . . . . . . . 85.3 p -80.44 160.89 25.17 Favored 'General case' 0 N--CA 1.498 1.946 0 O-C-N 121.62 -0.675 . . . . 0.0 110.222 -179.7 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 291' ' ' SER . . . . . . . . . . . . . 23.0 t . . . . . 0 N--CA 1.494 1.763 0 CA-C-O 118.029 -0.986 . . . . 0.0 110.242 -179.91 . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' -1' ' ' MET . . . . . . . . . . . . . 85.3 mtp . . . . . 0 N--CA 1.494 1.736 0 CA-C-O 120.994 0.426 . . . . 0.0 110.13 . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 0' ' ' GLY . . . . . . . . . . . . . . . 75.31 71.49 1.14 Allowed Glycine 0 N--CA 1.493 2.483 0 N-CA-C 109.598 -1.401 . . . . 0.0 109.598 179.708 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 89.4 mtp 52.66 95.19 0.02 OUTLIER 'General case' 0 N--CA 1.505 2.3 0 O-C-N 121.556 -0.967 . . . . 0.0 111.119 -179.97 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 69.7 m -99.58 168.76 9.75 Favored 'General case' 0 N--CA 1.494 1.725 0 O-C-N 121.668 -0.645 . . . . 0.0 110.146 -179.748 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 61.3 t -65.92 -27.86 42.3 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.111 0 O-C-N 121.707 -0.621 . . . . 0.0 110.241 -178.798 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -55.19 -30.84 60.73 Favored 'General case' 0 N--CA 1.504 2.255 0 O-C-N 121.4 -0.813 . . . . 0.0 110.44 -178.64 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 74.4 m-20 -68.77 -30.98 69.69 Favored 'General case' 0 N--CA 1.5 2.032 0 C-N-CA 120.33 -0.548 . . . . 0.0 110.252 174.854 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 96.7 m-85 -96.09 10.04 38.89 Favored 'General case' 0 N--CA 1.497 1.889 0 O-C-N 121.653 -0.655 . . . . 0.0 111.512 -178.168 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 3.3 m-30 -67.24 137.53 56.23 Favored 'General case' 0 N--CA 1.501 2.105 0 O-C-N 121.093 -1.004 . . . . 0.0 110.014 174.189 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 82.72 -0.64 89.3 Favored Glycine 0 N--CA 1.498 2.796 0 N-CA-C 110.704 -0.959 . . . . 0.0 110.704 -176.294 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 31.8 t -77.02 133.96 38.96 Favored 'General case' 0 N--CA 1.498 1.937 0 O-C-N 121.113 -1.228 . . . . 0.0 110.488 178.928 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 13.6 t-20 -83.13 120.53 25.89 Favored 'General case' 0 N--CA 1.497 1.887 0 O-C-N 121.694 -0.628 . . . . 0.0 109.526 173.399 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 35.2 m -143.15 165.42 15.45 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.734 0 N-CA-C 109.527 -0.546 . . . . 0.0 109.527 -178.329 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 47.0 tt0 -109.35 126.38 53.34 Favored 'General case' 0 N--CA 1.494 1.729 0 C-N-CA 119.897 -0.721 . . . . 0.0 109.752 176.54 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 54.1 t -106.79 125.1 62.77 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.745 0 O-C-N 121.614 -0.679 . . . . 0.0 109.891 -178.098 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 25.0 tp -95.94 128.59 42.97 Favored 'General case' 0 N--CA 1.494 1.734 0 N-CA-C 109.326 -0.62 . . . . 0.0 109.326 174.838 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 87.6 mt -96.68 169.5 9.83 Favored 'General case' 0 N--CA 1.496 1.837 0 O-C-N 121.677 -0.64 . . . . 0.0 111.004 -173.846 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 24.3 p30 -57.71 -22.2 44.94 Favored 'General case' 0 N--CA 1.505 2.307 0 O-C-N 121.701 -0.625 . . . . 0.0 111.615 -176.984 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 43.7 p-10 -93.05 23.16 4.44 Favored 'General case' 0 N--CA 1.497 1.902 0 O-C-N 121.523 -0.736 . . . . 0.0 110.867 -177.001 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 74.4 m-20 58.72 27.54 16.06 Favored 'General case' 0 N--CA 1.506 2.344 0 O-C-N 121.435 -0.79 . . . . 0.0 110.594 176.155 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 51.0 m -106.86 146.06 31.42 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.502 -0.749 . . . . 0.0 109.563 173.109 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 48.6 mttm -109.6 143.74 38.89 Favored 'General case' 0 N--CA 1.495 1.776 0 O-C-N 121.599 -0.688 . . . . 0.0 110.63 -176.599 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -153.07 123.64 7.23 Favored 'General case' 0 N--CA 1.497 1.876 0 O-C-N 121.778 -0.576 . . . . 0.0 110.048 176.575 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 8.9 ptp85 -118.32 147.61 43.31 Favored 'General case' 0 N--CA 1.498 1.96 0 O-C-N 121.615 -0.678 . . . . 0.0 110.375 -176.483 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -171.79 171.44 44.1 Favored Glycine 0 N--CA 1.495 2.63 0 N-CA-C 108.975 -1.65 . . . . 0.0 108.975 -176.148 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 47.2 t -94.58 119.41 42.53 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.925 0 O-C-N 121.433 -1.039 . . . . 0.0 109.355 -177.462 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 74.9 mt -64.25 143.58 15.55 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.155 0 O-C-N 121.7 -0.625 . . . . 0.0 110.449 -171.975 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 20.7 p -121.3 -27.31 4.88 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.785 -0.572 . . . . 0.0 111.233 179.176 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 26.9 t30 -161.39 160.91 30.06 Favored 'General case' 0 N--CA 1.501 2.078 0 C-N-CA 118.95 -1.1 . . . . 0.0 111.814 -178.854 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 69.5 t80 -150.02 128.37 12.14 Favored 'General case' 0 N--CA 1.496 1.86 0 N-CA-C 109.301 -0.629 . . . . 0.0 109.301 169.107 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 17.9 t70 -100.2 130.56 46.34 Favored 'General case' 0 N--CA 1.492 1.659 0 N-CA-C 109.04 -0.726 . . . . 0.0 109.04 -178.351 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 87.1 p -68.87 -48.59 63.03 Favored 'General case' 0 N--CA 1.498 1.963 0 C-N-CA 120.016 -0.674 . . . . 0.0 110.649 -175.925 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 23.0 m -59.76 -43.77 94.15 Favored 'General case' 0 N--CA 1.502 2.16 0 O-C-N 121.636 -0.665 . . . . 0.0 110.907 -174.221 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 91.5 m-20 -104.24 -8.66 19.18 Favored 'General case' 0 N--CA 1.497 1.919 0 O-C-N 121.687 -0.633 . . . . 0.0 111.619 -178.252 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 24.8 m 49.71 67.22 0.93 Allowed 'General case' 0 N--CA 1.508 2.442 0 O-C-N 121.131 -0.98 . . . . 0.0 110.929 -174.403 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 42.6 mm -122.52 126.1 73.6 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.028 0 O-C-N 121.635 -0.666 . . . . 0.0 109.356 -175.45 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 12.3 tp -115.78 120.47 39.41 Favored 'General case' 0 N--CA 1.494 1.739 0 O-C-N 121.699 -0.626 . . . . 0.0 110.589 -169.464 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 99.0 mt-30 -91.08 132.96 35.71 Favored 'General case' 0 N--CA 1.49 1.538 0 N-CA-C 109.517 -0.549 . . . . 0.0 109.517 174.506 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 15.5 mt -117.95 123.84 46.76 Favored 'General case' 0 N--CA 1.495 1.811 0 O-C-N 121.902 -0.498 . . . . 0.0 109.964 176.034 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 11.6 mtt85 -96.83 106.91 19.31 Favored 'General case' 0 N--CA 1.498 1.934 0 O-C-N 121.646 -0.659 . . . . 0.0 109.924 175.792 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 16.8 tp -84.67 152.48 23.75 Favored 'General case' 0 N--CA 1.495 1.777 0 C-N-CA 120.24 -0.584 . . . . 0.0 110.813 -174.807 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -66.8 -5.44 12.19 Favored 'General case' 0 N--CA 1.502 2.146 0 O-C-N 121.941 -0.474 . . . . 0.0 112.041 -171.658 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 91.6 m-20 -86.99 28.09 0.95 Allowed 'General case' 0 N--CA 1.499 2.001 0 O-C-N 121.115 -0.991 . . . . 0.0 110.879 174.547 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 8.5 t70 62.91 29.27 16.55 Favored 'General case' 0 N--CA 1.505 2.278 0 O-C-N 120.981 -1.074 . . . . 0.0 110.462 175.769 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 50.1 m -124.5 137.86 54.39 Favored 'General case' 0 N--CA 1.496 1.838 0 O-C-N 121.401 -0.812 . . . . 0.0 110.49 -179.438 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 9.8 t -97.7 150.99 20.59 Favored 'General case' 0 N--CA 1.497 1.911 0 O-C-N 121.818 -0.552 . . . . 0.0 110.194 175.47 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 41.3 tttp -149.3 119.13 7.07 Favored 'General case' 0 N--CA 1.495 1.786 0 O-C-N 121.546 -0.721 . . . . 0.0 110.313 178.679 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 90.2 p -95.61 122.27 38.18 Favored 'General case' 0 N--CA 1.494 1.769 0 O-C-N 121.701 -0.625 . . . . 0.0 110.194 179.005 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 82.3 mt -129.21 134.38 64.0 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.924 0 O-C-N 121.717 -0.614 . . . . 0.0 109.423 179.396 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 49.1 t -82.62 127.88 39.24 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.941 0 O-C-N 121.66 -0.65 . . . . 0.0 109.321 179.14 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 33.9 p -58.53 -24.98 61.93 Favored 'General case' 0 N--CA 1.505 2.285 0 O-C-N 121.649 -0.657 . . . . 0.0 112.332 -166.013 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 24.6 pttm -56.34 -22.59 31.87 Favored 'General case' 0 N--CA 1.505 2.278 0 O-C-N 121.488 -0.757 . . . . 0.0 111.239 -175.779 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 9.9 p30 -82.51 -0.53 46.98 Favored 'General case' 0 N--CA 1.5 2.042 0 O-C-N 121.563 -0.711 . . . . 0.0 111.199 176.253 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 94.1 mt -77.0 126.96 38.06 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.069 0 O-C-N 121.176 -0.953 . . . . 0.0 110.012 177.585 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 41.1 tttp -92.02 -29.84 16.38 Favored 'General case' 0 N--CA 1.494 1.765 0 O-C-N 121.809 -0.557 . . . . 0.0 109.822 170.592 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 5.3 m-20 -164.24 156.97 17.31 Favored 'General case' 0 N--CA 1.5 2.026 0 O-C-N 121.717 -0.614 . . . . 0.0 110.058 -177.923 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 74.4 mt -132.9 148.73 52.29 Favored 'General case' 0 N--CA 1.497 1.902 0 O-C-N 121.721 -0.612 . . . . 0.0 110.429 -179.287 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 7.0 ptm180 -151.06 141.53 22.5 Favored 'General case' 0 N--CA 1.496 1.863 0 O-C-N 121.694 -0.629 . . . . 0.0 109.868 175.634 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 59.1 mt -85.74 133.36 29.74 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.888 0 O-C-N 121.47 -0.769 . . . . 0.0 110.012 176.205 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 20.8 mt -83.6 116.95 67.16 Favored Pre-proline 0 N--CA 1.498 1.962 0 O-C-N 121.606 -0.684 . . . . 0.0 109.942 -179.202 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 26.7 Cg_endo -66.16 -30.46 46.51 Favored 'Trans proline' 0 N--CA 1.49 1.283 0 O-C-N 123.322 1.17 . . . . 0.0 110.763 -178.854 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 62.3 mttm -89.56 136.62 32.93 Favored 'General case' 0 N--CA 1.497 1.91 0 O-C-N 121.587 -0.696 . . . . 0.0 110.237 -178.956 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 91.7 m-20 -137.82 170.33 16.23 Favored 'General case' 0 N--CA 1.495 1.799 0 O-C-N 121.704 -0.622 . . . . 0.0 110.143 179.634 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 54.3 mt-10 -102.71 146.52 28.1 Favored 'General case' 0 N--CA 1.495 1.798 0 O-C-N 121.624 -0.672 . . . . 0.0 110.253 179.992 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 82.1 mt -116.96 135.84 56.03 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.922 0 O-C-N 121.608 -0.683 . . . . 0.0 109.613 179.945 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 64' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -79.15 -56.31 0.84 Allowed Pre-proline 0 N--CA 1.498 1.953 0 O-C-N 121.675 -0.641 . . . . 0.0 110.432 -179.965 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 39.1 Cg_endo -73.47 140.98 30.84 Favored 'Trans proline' 0 N--CA 1.487 1.097 0 O-C-N 123.303 1.16 . . . . 0.0 110.289 -177.837 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 76.4 mttt -93.19 -68.81 0.78 Allowed 'General case' 0 N--CA 1.495 1.806 0 O-C-N 121.704 -0.622 . . . . 0.0 110.22 179.941 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 15.4 t-20 -145.59 111.37 5.51 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.625 -0.672 . . . . 0.0 110.19 -179.849 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 160.84 -35.26 0.41 Allowed Glycine 0 N--CA 1.495 2.575 0 N-CA-C 109.642 -1.383 . . . . 0.0 109.642 179.817 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 23.8 m -95.78 136.22 36.48 Favored 'General case' 0 N--CA 1.496 1.837 0 O-C-N 121.761 -0.846 . . . . 0.0 110.146 -179.484 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 60.2 mttm -116.1 148.72 39.98 Favored 'General case' 0 N--CA 1.496 1.839 0 O-C-N 121.684 -0.635 . . . . 0.0 110.144 179.674 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 46.5 m -96.7 156.77 36.23 Favored Pre-proline 0 N--CA 1.494 1.739 0 O-C-N 121.666 -0.646 . . . . 0.0 110.226 -179.749 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 27.8 Cg_endo -66.87 152.95 79.49 Favored 'Trans proline' 0 N--CA 1.49 1.281 0 O-C-N 123.714 1.376 . . . . 0.0 110.402 179.922 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 30.4 t -108.61 141.5 40.45 Favored 'General case' 0 N--CA 1.495 1.806 0 O-C-N 121.675 -0.641 . . . . 0.0 110.196 179.902 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 24.2 m -66.38 -36.93 84.09 Favored 'General case' 0 N--CA 1.5 2.048 0 O-C-N 121.68 -0.638 . . . . 0.0 110.243 -179.494 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 2.6 m-20 -103.89 125.34 50.23 Favored 'General case' 0 N--CA 1.495 1.811 0 O-C-N 121.644 -0.66 . . . . 0.0 110.217 -179.357 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 29.3 t -143.27 146.79 33.91 Favored 'General case' 0 N--CA 1.495 1.819 0 O-C-N 121.725 -0.609 . . . . 0.0 110.156 179.722 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 38.1 p -106.49 30.05 6.35 Favored 'General case' 0 N--CA 1.495 1.822 0 O-C-N 121.646 -0.659 . . . . 0.0 110.487 179.295 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 38.5 tttp -98.38 145.35 26.8 Favored 'General case' 0 N--CA 1.496 1.825 0 O-C-N 121.618 -0.676 . . . . 0.0 110.178 -179.739 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 6.0 mp -89.5 136.37 33.07 Favored 'General case' 0 N--CA 1.496 1.866 0 O-C-N 121.702 -0.624 . . . . 0.0 110.176 -179.67 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 33.9 pttt -154.1 48.08 0.62 Allowed 'General case' 0 N--CA 1.495 1.82 0 O-C-N 121.707 -0.62 . . . . 0.0 110.283 -179.756 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 85.0 p -70.56 162.69 28.38 Favored 'General case' 0 N--CA 1.499 1.995 0 O-C-N 121.614 -0.679 . . . . 0.0 110.203 -179.261 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -159.03 -45.34 0.06 Allowed 'General case' 0 N--CA 1.495 1.802 0 O-C-N 121.713 -0.617 . . . . 0.0 110.234 -179.738 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 54.7 mt-10 -100.27 168.02 10.06 Favored 'General case' 0 N--CA 1.495 1.791 0 O-C-N 121.687 -0.633 . . . . 0.0 110.177 179.532 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 9.8 t -123.13 144.26 49.45 Favored 'General case' 0 N--CA 1.497 1.922 0 O-C-N 121.685 -0.634 . . . . 0.0 110.307 -179.543 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 97.8 m-85 -70.88 -35.85 72.52 Favored 'General case' 0 N--CA 1.498 1.956 0 O-C-N 121.743 -0.598 . . . . 0.0 110.375 -178.646 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 30.4 t -111.31 145.89 38.01 Favored 'General case' 0 N--CA 1.495 1.794 0 O-C-N 121.606 -0.684 . . . . 0.0 110.316 -179.18 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 88.4 p -113.69 158.55 20.75 Favored 'General case' 0 N--CA 1.496 1.867 0 O-C-N 121.692 -0.63 . . . . 0.0 110.073 179.492 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 69.5 tttt -63.08 -41.23 99.37 Favored 'General case' 0 N--CA 1.501 2.106 0 O-C-N 121.663 -0.648 . . . . 0.0 110.441 -179.27 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 91.8 m-20 -119.3 105.05 10.94 Favored 'General case' 0 N--CA 1.496 1.844 0 O-C-N 121.66 -0.65 . . . . 0.0 110.221 179.218 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 59.5 tttt -66.22 -38.62 88.37 Favored 'General case' 0 N--CA 1.5 2.054 0 O-C-N 121.742 -0.599 . . . . 0.0 110.283 179.83 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 91' ' ' TRP . . . . . . . . . . . . . 78.7 m95 -150.07 33.13 0.67 Allowed 'General case' 0 N--CA 1.495 1.787 0 O-C-N 121.657 -0.652 . . . . 0.0 110.297 179.186 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 46.7 m -120.11 144.98 47.33 Favored 'General case' 0 N--CA 1.495 1.811 0 O-C-N 121.59 -0.694 . . . . 0.0 110.237 -179.671 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 93' ' ' MET . . . . . . . . . . . . . 65.9 mtt -94.86 -63.85 1.13 Allowed 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.665 -0.647 . . . . 0.0 110.21 179.66 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 74.6 m-20 . . . . . 0 N--CA 1.506 2.36 0 CA-C-O 118.356 -0.83 . . . . 0.0 110.961 -179.917 . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' B' B ' 240' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.298 0 N-CA-C 109.582 -1.407 . . . . 0.0 109.582 . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' B' B ' 241' ' ' ALA . . . . . . . . . . . . . . . -102.07 138.81 38.53 Favored 'General case' 0 N--CA 1.495 1.799 0 O-C-N 121.701 -0.882 . . . . 0.0 110.249 -179.914 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 242' ' ' THR . . . . . . . . . . . . . 24.7 m -126.81 143.45 51.25 Favored 'General case' 0 N--CA 1.495 1.818 0 O-C-N 121.685 -0.635 . . . . 0.0 110.135 179.911 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 243' ' ' THR . . . . . . . . . . . . . 39.9 p -117.76 151.12 37.94 Favored 'General case' 0 N--CA 1.496 1.871 0 O-C-N 121.667 -0.645 . . . . 0.0 110.104 179.621 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 244' ' ' LYS . . . . . . . . . . . . . 59.6 mttm -100.77 -34.54 9.79 Favored 'General case' 0 N--CA 1.494 1.767 0 O-C-N 121.614 -0.678 . . . . 0.0 110.251 -179.73 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 245' ' ' GLU . . . . . . . . . . . . . 42.2 tt0 -102.52 128.06 49.33 Favored 'General case' 0 N--CA 1.495 1.795 0 O-C-N 121.675 -0.64 . . . . 0.0 110.195 -178.897 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 246' ' ' LYS . . . . . . . . . . . . . 81.1 mttt -110.03 -47.33 3.34 Favored 'General case' 0 N--CA 1.495 1.808 0 O-C-N 121.666 -0.646 . . . . 0.0 110.244 179.174 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 247' ' ' ASN . . . . . . . . . . . . . 17.4 t-20 -131.94 33.38 3.95 Favored 'General case' 0 N--CA 1.494 1.774 0 O-C-N 121.692 -0.63 . . . . 0.0 110.224 -179.358 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 248' ' ' ILE . . . . . . . . . . . . . 79.7 mt 52.75 93.23 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.507 2.393 0 O-C-N 121.581 -0.699 . . . . 0.0 110.556 -179.569 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 249' ' ' SER . . . . . . . . . . . . . 89.4 p -130.1 107.11 9.07 Favored 'General case' 0 N--CA 1.495 1.793 0 O-C-N 121.638 -0.663 . . . . 0.0 110.292 179.603 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 250' ' ' VAL . . . . . . . . . . . . . 12.3 p -154.07 139.51 10.86 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.807 0 O-C-N 121.776 -0.578 . . . . 0.0 109.982 178.8 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 251' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER 51.24 -167.26 0.04 OUTLIER 'General case' 0 N--CA 1.507 2.424 0 O-C-N 121.584 -0.698 . . . . 0.0 110.773 -178.793 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 252' ' ' VAL . . . . . . . . . . . . . 24.1 t 58.56 168.6 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.509 2.503 0 O-C-N 121.614 -0.679 . . . . 0.0 110.404 179.14 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 253' ' ' ASP . . . . . . . . . . . . . 4.3 m-20 54.73 57.77 5.42 Favored 'General case' 0 N--CA 1.507 2.384 0 O-C-N 121.333 -0.855 . . . . 0.0 110.779 179.249 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 254' ' ' ALA . . . . . . . . . . . . . . . -65.56 -18.47 65.35 Favored 'General case' 0 N--CA 1.501 2.09 0 O-C-N 121.49 -0.756 . . . . 0.0 110.885 178.467 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 255' ' ' ASP . . . . . . . . . . . . . 26.1 t0 -70.45 -26.0 63.45 Favored 'General case' 0 N--CA 1.499 1.989 0 O-C-N 121.41 -0.806 . . . . 0.0 110.463 179.335 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 256' ' ' ALA . . . . . . . . . . . . . . . -61.96 -30.5 70.96 Favored 'General case' 0 N--CA 1.502 2.14 0 O-C-N 121.413 -0.805 . . . . 0.0 110.432 178.951 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 257' ' ' SER . . . . . . . . . . . . . 58.4 m -54.75 -35.0 63.27 Favored 'General case' 0 N--CA 1.502 2.173 0 O-C-N 121.538 -0.726 . . . . 0.0 110.465 176.641 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 258' ' ' SER . . . . . . . . . . . . . 25.4 m -67.75 -33.19 74.36 Favored 'General case' 0 N--CA 1.498 1.936 0 O-C-N 121.827 -0.545 . . . . 0.0 110.204 -179.684 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 259' ' ' GLN . . . . . . . . . . . . . 98.4 mt-30 -64.76 -33.51 76.15 Favored 'General case' 0 N--CA 1.5 2.05 0 O-C-N 121.632 -0.668 . . . . 0.0 110.323 178.883 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 260' ' ' LEU . . . . . . . . . . . . . 82.2 mt -65.38 -40.05 93.01 Favored 'General case' 0 N--CA 1.5 2.071 0 O-C-N 121.636 -0.665 . . . . 0.0 110.181 178.808 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 261' ' ' LEU . . . . . . . . . . . . . 25.5 tp -69.15 -39.93 78.5 Favored 'General case' 0 N--CA 1.499 2.015 0 O-C-N 121.671 -0.643 . . . . 0.0 109.862 176.634 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 262' ' ' SER . . . . . . . . . . . . . 22.7 m -62.55 -37.14 84.98 Favored 'General case' 0 N--CA 1.502 2.136 0 O-C-N 121.74 -0.6 . . . . 0.0 110.493 177.853 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 263' ' ' LEU . . . . . . . . . . . . . 30.2 mt -64.4 -40.77 96.45 Favored 'General case' 0 N--CA 1.501 2.085 0 O-C-N 121.649 -0.657 . . . . 0.0 110.315 179.46 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 264' ' ' LEU . . . . . . . . . . . . . 84.6 mt -62.79 -39.01 92.94 Favored 'General case' 0 N--CA 1.5 2.063 0 O-C-N 121.627 -0.67 . . . . 0.0 110.466 178.874 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 265' ' ' LYS . . . . . . . . . . . . . 73.6 mttt -76.68 -38.86 53.72 Favored 'General case' 0 N--CA 1.498 1.942 0 O-C-N 121.746 -0.596 . . . . 0.0 110.163 -179.753 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 266' ' ' SER . . . . . . . . . . . . . 1.6 m 55.93 -81.78 0.01 OUTLIER 'General case' 0 N--CA 1.506 2.347 0 O-C-N 121.843 -0.536 . . . . 0.0 111.211 -177.151 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 267' ' ' SER . . . . . . . . . . . . . 49.6 m -113.7 157.79 21.74 Favored 'General case' 0 N--CA 1.494 1.774 0 O-C-N 121.237 -0.915 . . . . 0.0 110.167 -179.79 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 268' ' ' THR . . . . . . . . . . . . . 19.5 m -98.5 29.7 3.54 Favored 'General case' 0 N--CA 1.497 1.909 0 O-C-N 121.726 -0.609 . . . . 0.0 110.558 -179.455 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 269' ' ' ALA . . . . . . . . . . . . . . . 48.46 58.44 17.73 Favored Pre-proline 0 N--CA 1.505 2.319 0 O-C-N 121.593 -0.692 . . . . 0.0 111.364 -179.101 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 270' ' ' PRO . . . . . . . . . . . . . 26.7 Cg_endo -66.72 -33.79 33.79 Favored 'Trans proline' 0 N--CA 1.488 1.204 0 O-C-N 123.402 1.211 . . . . 0.0 110.373 178.472 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 271' ' ' SER . . . . . . . . . . . . . 87.8 p -70.2 -29.14 65.92 Favored 'General case' 0 N--CA 1.498 1.97 0 O-C-N 121.691 -0.631 . . . . 0.0 110.547 178.803 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 272' ' ' ASP . . . . . . . . . . . . . 20.5 t70 -80.89 122.71 27.56 Favored 'General case' 0 N--CA 1.497 1.915 0 O-C-N 121.586 -0.696 . . . . 0.0 110.286 -178.633 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 273' ' ' LEU . . . . . . . . . . . . . 84.4 mt 56.69 -84.32 0.02 OUTLIER 'General case' 0 N--CA 1.505 2.304 0 O-C-N 121.955 -0.466 . . . . 0.0 111.269 179.774 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 274' ' ' ALA . . . . . . . . . . . . . . . 49.89 93.77 0.01 OUTLIER 'General case' 0 N--CA 1.506 2.362 0 O-C-N 121.165 -0.959 . . . . 0.0 111.201 -177.006 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 275' ' ' THR . . . . . . . . . . . . . 7.6 t -112.54 154.33 44.67 Favored Pre-proline 0 N--CA 1.498 1.967 0 O-C-N 121.578 -0.701 . . . . 0.0 110.241 -179.572 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 276' ' ' PRO . . . . . . . . . . . . . 22.7 Cg_exo -61.1 138.17 76.33 Favored 'Trans proline' 0 N--CA 1.491 1.329 0 O-C-N 123.458 1.241 . . . . 0.0 110.703 179.736 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 277' ' ' GLN . . . . . . . . . . . . . 28.6 tt0 -133.19 89.64 32.63 Favored Pre-proline 0 N--CA 1.496 1.829 0 O-C-N 121.693 -0.629 . . . . 0.0 110.124 179.72 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 278' ' ' PRO . . . . . . . . . . . . . 22.7 Cg_endo -65.64 144.79 79.77 Favored 'Trans proline' 0 N--CA 1.489 1.235 0 O-C-N 123.56 1.295 . . . . 0.0 110.494 -179.933 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 279' ' ' SER . . . . . . . . . . . . . 95.7 p -132.95 160.61 36.59 Favored 'General case' 0 N--CA 1.495 1.791 0 O-C-N 121.737 -0.602 . . . . 0.0 110.235 -179.361 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 280' ' ' THR . . . . . . . . . . . . . 40.9 p -94.76 165.59 12.41 Favored 'General case' 0 N--CA 1.496 1.858 0 O-C-N 121.698 -0.626 . . . . 0.0 110.208 -179.936 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 281' ' ' PHE . . . . . . . . . . . . . 30.1 m-85 -119.09 89.75 39.98 Favored Pre-proline 0 N--CA 1.496 1.841 0 O-C-N 121.682 -0.636 . . . . 0.0 110.117 -179.681 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 282' ' ' PRO . . . . . . . . . . . . . 21.2 Cg_endo -65.3 -31.15 53.44 Favored 'Trans proline' 0 N--CA 1.49 1.318 0 O-C-N 123.525 1.276 . . . . 0.0 110.574 179.964 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 283' ' ' GLN . . . . . . . . . . . . . 37.3 mt-30 -95.24 156.46 37.72 Favored Pre-proline 0 N--CA 1.496 1.826 0 O-C-N 121.598 -0.689 . . . . 0.0 110.13 179.236 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 284' ' ' PRO . . . . . . . . . . . . . 30.1 Cg_endo -68.19 152.32 76.2 Favored 'Trans proline' 0 N--CA 1.487 1.099 0 O-C-N 123.555 1.292 . . . . 0.0 110.264 -179.868 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 285' ' ' PRO . . . . . . . . . . . . . 30.1 Cg_endo -68.06 132.55 26.5 Favored 'Trans proline' 0 N--CA 1.488 1.182 0 O-C-N 123.591 1.311 . . . . 0.0 110.28 -179.559 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 286' ' ' VAL . . . . . . . . . . . . . 26.9 m -134.35 149.12 29.74 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.032 0 O-C-N 121.639 -0.663 . . . . 0.0 110.208 179.321 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 287' ' ' GLU . . . . . . . . . . . . . 74.7 mm-40 -68.61 -34.99 76.71 Favored 'General case' 0 N--CA 1.499 2.019 0 O-C-N 121.706 -0.621 . . . . 0.0 110.179 179.408 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 288' ' ' SER . . . . . . . . . . . . . 10.4 m 52.91 -178.77 0.02 OUTLIER 'General case' 0 N--CA 1.506 2.357 0 O-C-N 121.671 -0.643 . . . . 0.0 111.158 -179.906 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 289' ' ' HIS . . . . . . . . . . . . . 57.0 t-80 -141.2 138.58 33.44 Favored 'General case' 0 N--CA 1.495 1.793 0 O-C-N 121.597 -0.689 . . . . 0.0 110.138 179.436 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 290' ' ' SER . . . . . . . . . . . . . 91.9 p -123.38 154.4 39.02 Favored 'General case' 0 N--CA 1.495 1.821 0 O-C-N 121.658 -0.651 . . . . 0.0 110.194 179.87 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 291' ' ' SER . . . . . . . . . . . . . 17.2 m . . . . . 0 N--CA 1.496 1.83 0 CA-C-O 117.941 -1.028 . . . . 0.0 110.206 179.827 . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' -1' ' ' MET . . . . . . . . . . . . . 61.4 mtt . . . . . 0 N--CA 1.493 1.704 0 CA-C-O 121.012 0.435 . . . . 0.0 110.148 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 0' ' ' GLY . . . . . . . . . . . . . . . -159.8 119.82 0.92 Allowed Glycine 0 N--CA 1.493 2.474 0 N-CA-C 109.542 -1.423 . . . . 0.0 109.542 179.699 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 6.3 mmm -128.93 163.08 26.07 Favored 'General case' 0 N--CA 1.495 1.818 0 O-C-N 121.64 -0.918 . . . . 0.0 110.166 -179.703 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 70.4 m -100.9 166.28 10.92 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.606 -0.684 . . . . 0.0 110.179 -179.828 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 63.2 t -66.35 -27.85 41.75 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.093 0 O-C-N 121.644 -0.66 . . . . 0.0 110.188 -179.467 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -55.06 -30.98 60.75 Favored 'General case' 0 N--CA 1.505 2.275 0 O-C-N 121.394 -0.816 . . . . 0.0 110.439 -179.214 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 74.3 m-20 -68.57 -30.8 69.65 Favored 'General case' 0 N--CA 1.499 1.996 0 O-C-N 121.81 -0.556 . . . . 0.0 110.226 174.776 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 96.7 m-85 -95.8 10.15 38.06 Favored 'General case' 0 N--CA 1.496 1.859 0 O-C-N 121.574 -0.704 . . . . 0.0 111.524 -178.589 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 4.0 m-30 -67.34 139.43 57.22 Favored 'General case' 0 N--CA 1.504 2.228 0 O-C-N 121.211 -0.931 . . . . 0.0 109.964 174.123 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 82.06 3.14 90.67 Favored Glycine 0 N--CA 1.497 2.727 0 N-CA-C 110.56 -1.016 . . . . 0.0 110.56 -176.595 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 73.9 m -78.12 135.74 37.74 Favored 'General case' 0 N--CA 1.498 1.929 0 O-C-N 121.114 -1.227 . . . . 0.0 110.524 175.943 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 14.0 t-20 -83.92 117.43 23.34 Favored 'General case' 0 N--CA 1.497 1.91 0 O-C-N 121.6 -0.687 . . . . 0.0 109.588 172.169 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 35.4 m -142.29 164.39 17.9 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.691 0 N-CA-C 109.319 -0.622 . . . . 0.0 109.319 -179.275 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 44.8 tt0 -109.36 129.04 55.54 Favored 'General case' 0 N--CA 1.492 1.666 0 C-N-CA 119.739 -0.785 . . . . 0.0 109.914 177.453 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 58.3 t -106.74 125.14 62.69 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.697 0 O-C-N 121.575 -0.703 . . . . 0.0 109.873 -179.566 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 30.2 tp -95.85 128.43 42.72 Favored 'General case' 0 N--CA 1.494 1.728 0 N-CA-C 109.272 -0.64 . . . . 0.0 109.272 175.124 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 84.8 mt -98.28 166.31 11.45 Favored 'General case' 0 N--CA 1.496 1.846 0 O-C-N 121.683 -0.636 . . . . 0.0 111.047 -173.304 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 24.3 p30 -58.86 -21.66 57.55 Favored 'General case' 0 N--CA 1.504 2.271 0 O-C-N 121.769 -0.582 . . . . 0.0 111.64 -176.833 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 43.5 p-10 -92.64 23.4 4.09 Favored 'General case' 0 N--CA 1.498 1.953 0 O-C-N 121.547 -0.72 . . . . 0.0 110.905 -175.725 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 74.3 m-20 58.5 27.1 15.12 Favored 'General case' 0 N--CA 1.506 2.339 0 O-C-N 121.406 -0.809 . . . . 0.0 110.65 176.306 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 51.1 m -106.51 145.85 31.32 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.587 -0.696 . . . . 0.0 109.55 172.531 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 49.7 mttp -109.7 150.26 28.55 Favored 'General case' 0 N--CA 1.494 1.759 0 O-C-N 121.625 -0.672 . . . . 0.0 110.573 -175.531 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -152.97 150.37 29.16 Favored 'General case' 0 N--CA 1.496 1.861 0 O-C-N 121.682 -0.636 . . . . 0.0 110.111 176.05 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 5.8 ptm180 -144.06 140.26 29.4 Favored 'General case' 0 N--CA 1.498 1.934 0 O-C-N 121.614 -0.679 . . . . 0.0 110.509 179.407 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -171.8 171.4 44.09 Favored Glycine 0 N--CA 1.496 2.678 0 N-CA-C 109.085 -1.606 . . . . 0.0 109.085 -176.051 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 60.4 t -94.59 121.57 45.31 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.91 0 O-C-N 121.511 -0.993 . . . . 0.0 109.357 -177.338 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 91.9 mt -65.09 144.04 15.19 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.066 0 O-C-N 121.636 -0.665 . . . . 0.0 110.65 -171.332 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 7.0 p -121.23 -27.56 4.86 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.78 -0.575 . . . . 0.0 111.133 178.807 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 8.0 t30 -161.56 160.94 29.59 Favored 'General case' 0 N--CA 1.5 2.044 0 C-N-CA 118.985 -1.086 . . . . 0.0 111.904 -178.547 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 84.5 t80 -150.15 125.09 9.9 Favored 'General case' 0 N--CA 1.498 1.934 0 N-CA-C 108.87 -0.789 . . . . 0.0 108.87 170.366 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 18.0 t70 -99.44 130.31 45.69 Favored 'General case' 0 N--CA 1.491 1.591 0 N-CA-C 108.986 -0.746 . . . . 0.0 108.986 -176.449 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 20.1 m -69.75 -50.88 39.11 Favored 'General case' 0 N--CA 1.498 1.935 0 C-N-CA 120.004 -0.678 . . . . 0.0 110.449 -177.142 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 23.2 m -59.88 -41.95 92.71 Favored 'General case' 0 N--CA 1.501 2.104 0 O-C-N 121.597 -0.689 . . . . 0.0 110.781 -174.771 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 29.7 m120 -103.93 -10.13 18.38 Favored 'General case' 0 N--CA 1.497 1.915 0 O-C-N 121.676 -0.64 . . . . 0.0 111.644 -177.766 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 1.8 m 49.94 67.31 0.93 Allowed 'General case' 0 N--CA 1.508 2.442 0 O-C-N 121.046 -1.034 . . . . 0.0 111.037 -175.003 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 47.7 mm -126.26 127.39 70.66 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.089 0 O-C-N 121.51 -0.744 . . . . 0.0 109.46 -175.864 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 11.2 tp -115.89 120.59 39.7 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.742 -0.599 . . . . 0.0 110.511 -170.832 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 58.6 mt-30 -91.55 134.59 34.53 Favored 'General case' 0 N--CA 1.492 1.65 0 N-CA-C 109.481 -0.563 . . . . 0.0 109.481 174.639 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 89.4 mt -117.87 123.94 47.11 Favored 'General case' 0 N--CA 1.497 1.895 0 C-N-CA 120.406 -0.518 . . . . 0.0 109.929 174.641 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 57.7 ttt85 -96.34 107.21 19.54 Favored 'General case' 0 N--CA 1.497 1.914 0 O-C-N 121.596 -0.69 . . . . 0.0 109.736 175.79 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 18.4 tp -85.36 153.58 22.44 Favored 'General case' 0 N--CA 1.495 1.811 0 O-C-N 121.693 -0.629 . . . . 0.0 111.085 -173.65 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -62.99 -9.76 11.24 Favored 'General case' 0 N--CA 1.503 2.186 0 O-C-N 122.031 -0.418 . . . . 0.0 112.045 -170.475 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 53.6 p-10 -85.12 28.94 0.68 Allowed 'General case' 0 N--CA 1.499 2.011 0 O-C-N 121.024 -1.048 . . . . 0.0 111.049 175.064 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 74.4 m-20 57.95 29.59 17.88 Favored 'General case' 0 N--CA 1.504 2.252 0 O-C-N 121.112 -0.992 . . . . 0.0 110.404 176.619 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 28.2 m -119.71 137.9 53.63 Favored 'General case' 0 N--CA 1.496 1.852 0 O-C-N 121.518 -0.739 . . . . 0.0 110.306 178.604 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 9.8 t -97.86 150.07 21.69 Favored 'General case' 0 N--CA 1.495 1.79 0 O-C-N 121.728 -0.608 . . . . 0.0 110.327 176.608 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 19.9 mtpp -148.93 122.25 9.01 Favored 'General case' 0 N--CA 1.495 1.815 0 O-C-N 121.714 -0.616 . . . . 0.0 110.423 178.207 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 90.6 p -96.37 123.79 40.14 Favored 'General case' 0 N--CA 1.496 1.85 0 O-C-N 121.815 -0.553 . . . . 0.0 110.202 179.802 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 82.0 mt -129.28 134.23 64.18 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.858 0 O-C-N 121.673 -0.642 . . . . 0.0 109.269 179.111 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 57.8 t -81.93 127.61 39.46 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.9 0 C-N-CA 120.036 -0.666 . . . . 0.0 109.306 179.989 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 39.3 p -59.91 -24.79 64.6 Favored 'General case' 0 N--CA 1.504 2.241 0 O-C-N 121.582 -0.698 . . . . 0.0 112.054 -170.415 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 32.3 ttpt -56.25 -23.29 35.12 Favored 'General case' 0 N--CA 1.503 2.214 0 O-C-N 121.43 -0.794 . . . . 0.0 111.138 -177.037 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 48.5 p30 -84.16 1.95 41.94 Favored 'General case' 0 N--CA 1.498 1.933 0 O-C-N 121.463 -0.773 . . . . 0.0 111.342 176.61 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 97.4 mt -75.55 127.84 37.09 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.145 0 O-C-N 121.154 -0.966 . . . . 0.0 110.084 178.66 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 52.3 tttm -92.6 -30.4 15.64 Favored 'General case' 0 N--CA 1.494 1.77 0 O-C-N 121.843 -0.536 . . . . 0.0 109.687 169.379 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 5.1 m-20 -163.9 158.04 19.39 Favored 'General case' 0 N--CA 1.5 2.038 0 O-C-N 121.785 -0.572 . . . . 0.0 109.994 -178.304 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 83.4 mt -132.94 149.59 52.23 Favored 'General case' 0 N--CA 1.496 1.863 0 O-C-N 121.656 -0.653 . . . . 0.0 110.38 -179.201 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 20.1 ptp180 -151.51 144.84 24.76 Favored 'General case' 0 N--CA 1.497 1.895 0 O-C-N 121.705 -0.622 . . . . 0.0 110.16 175.813 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 66.4 mt -86.59 133.41 29.91 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.88 0 O-C-N 121.661 -0.649 . . . . 0.0 110.042 174.221 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 16.6 mt -83.45 116.97 67.19 Favored Pre-proline 0 N--CA 1.498 1.935 0 O-C-N 121.64 -0.662 . . . . 0.0 109.894 -179.092 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 26.2 Cg_endo -66.55 141.97 62.98 Favored 'Trans proline' 0 N--CA 1.488 1.186 0 O-C-N 123.286 1.15 . . . . 0.0 110.413 179.648 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 99.2 mttt -97.46 149.51 22.08 Favored 'General case' 0 N--CA 1.495 1.786 0 O-C-N 121.668 -0.645 . . . . 0.0 110.188 179.949 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 25.2 p30 -115.49 154.16 29.81 Favored 'General case' 0 N--CA 1.498 1.926 0 O-C-N 121.657 -0.652 . . . . 0.0 110.373 -179.869 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 12.5 pt-20 -161.86 40.05 0.13 Allowed 'General case' 0 N--CA 1.497 1.905 0 O-C-N 121.718 -0.614 . . . . 0.0 110.319 179.697 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 81.9 mt -111.68 136.83 46.58 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.882 0 O-C-N 121.587 -0.696 . . . . 0.0 109.705 -179.101 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 64' ' ' MET . . . . . . . . . . . . . 51.1 mtm 52.12 85.03 0.2 Allowed Pre-proline 0 N--CA 1.505 2.316 0 O-C-N 121.661 -0.65 . . . . 0.0 111.123 -179.871 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 28.4 Cg_endo -67.35 150.17 80.98 Favored 'Trans proline' 0 N--CA 1.488 1.202 0 O-C-N 123.626 1.329 . . . . 0.0 110.365 179.519 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 51.5 tttm -63.73 -35.17 79.69 Favored 'General case' 0 N--CA 1.501 2.094 0 O-C-N 121.664 -0.648 . . . . 0.0 110.4 179.941 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 23.7 p30 -79.0 173.0 13.02 Favored 'General case' 0 N--CA 1.499 1.993 0 O-C-N 121.66 -0.65 . . . . 0.0 110.315 179.97 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 123.23 -41.9 1.7 Allowed Glycine 0 N--CA 1.494 2.548 0 N-CA-C 109.544 -1.422 . . . . 0.0 109.544 -179.81 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 24.2 m -66.51 -37.25 84.65 Favored 'General case' 0 N--CA 1.5 2.063 0 O-C-N 121.703 -0.88 . . . . 0.0 110.13 179.193 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 62.4 mttm 53.4 42.61 32.0 Favored 'General case' 0 N--CA 1.506 2.336 0 O-C-N 121.607 -0.683 . . . . 0.0 110.914 179.144 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 1.8 t -77.93 158.86 77.19 Favored Pre-proline 0 N--CA 1.497 1.916 0 O-C-N 121.601 -0.687 . . . . 0.0 110.151 179.708 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 22.3 Cg_exo -61.19 139.07 81.67 Favored 'Trans proline' 0 N--CA 1.491 1.368 0 O-C-N 123.612 1.322 . . . . 0.0 110.751 -179.904 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 25.9 t -144.79 149.25 35.15 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.677 -0.64 . . . . 0.0 110.202 179.844 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 9.7 t -132.6 154.22 50.27 Favored 'General case' 0 N--CA 1.497 1.876 0 O-C-N 121.627 -0.671 . . . . 0.0 110.337 179.662 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 38.7 p-10 -126.82 31.47 5.3 Favored 'General case' 0 N--CA 1.496 1.861 0 O-C-N 121.647 -0.658 . . . . 0.0 110.565 -179.81 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 50.9 m -120.54 144.66 47.94 Favored 'General case' 0 N--CA 1.495 1.796 0 O-C-N 121.602 -0.686 . . . . 0.0 110.23 179.836 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 22.4 m -88.88 -60.9 1.83 Allowed 'General case' 0 N--CA 1.497 1.907 0 O-C-N 121.81 -0.556 . . . . 0.0 110.201 179.973 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 55.9 mttm -103.13 146.05 28.98 Favored 'General case' 0 N--CA 1.495 1.82 0 O-C-N 121.777 -0.577 . . . . 0.0 110.19 -179.644 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -100.31 -172.37 2.2 Favored 'General case' 0 N--CA 1.496 1.837 0 O-C-N 121.66 -0.65 . . . . 0.0 109.816 179.586 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 23.6 ttpp -63.05 -35.95 81.95 Favored 'General case' 0 N--CA 1.501 2.125 0 O-C-N 121.583 -0.698 . . . . 0.0 110.31 179.985 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 29.2 t -117.09 145.18 43.93 Favored 'General case' 0 N--CA 1.495 1.783 0 O-C-N 121.724 -0.61 . . . . 0.0 110.271 179.858 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -136.34 154.85 50.73 Favored 'General case' 0 N--CA 1.496 1.858 0 O-C-N 121.709 -0.619 . . . . 0.0 110.102 179.882 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 74.8 mm-40 -98.54 133.15 43.31 Favored 'General case' 0 N--CA 1.495 1.799 0 O-C-N 121.68 -0.638 . . . . 0.0 110.286 -179.303 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 23.4 m -68.89 -34.41 75.38 Favored 'General case' 0 N--CA 1.499 1.988 0 O-C-N 121.695 -0.628 . . . . 0.0 110.188 179.401 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 97.2 m-85 -66.62 158.54 29.66 Favored 'General case' 0 N--CA 1.5 2.05 0 O-C-N 121.7 -0.625 . . . . 0.0 110.326 -178.694 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 25.8 t -114.7 153.35 30.41 Favored 'General case' 0 N--CA 1.495 1.798 0 O-C-N 121.742 -0.599 . . . . 0.0 110.142 179.931 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 50.7 m -65.7 146.5 54.72 Favored 'General case' 0 N--CA 1.5 2.07 0 O-C-N 121.625 -0.672 . . . . 0.0 110.375 -179.007 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 97.5 mttt -66.58 -33.91 76.71 Favored 'General case' 0 N--CA 1.499 2.023 0 O-C-N 121.669 -0.644 . . . . 0.0 110.408 -179.343 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 35.9 t30 -98.11 107.14 19.54 Favored 'General case' 0 N--CA 1.495 1.79 0 O-C-N 121.684 -0.635 . . . . 0.0 110.306 -179.057 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 53.4 pttt -133.17 -39.31 0.94 Allowed 'General case' 0 N--CA 1.498 1.96 0 O-C-N 121.714 -0.617 . . . . 0.0 110.689 179.297 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 91' ' ' TRP . . . . . . . . . . . . . 10.8 m0 -95.06 145.94 24.62 Favored 'General case' 0 N--CA 1.495 1.776 0 O-C-N 121.466 -0.771 . . . . 0.0 110.262 178.753 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 95.9 p -138.21 160.65 38.87 Favored 'General case' 0 N--CA 1.496 1.828 0 O-C-N 121.718 -0.614 . . . . 0.0 110.145 179.476 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 93' ' ' MET . . . . . . . . . . . . . 74.5 mtm -116.41 155.27 28.82 Favored 'General case' 0 N--CA 1.496 1.848 0 O-C-N 121.657 -0.652 . . . . 0.0 110.242 -179.631 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 10.2 p-10 . . . . . 0 N--CA 1.498 1.946 0 CA-C-O 118.044 -0.979 . . . . 0.0 110.291 179.867 . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' B' B ' 240' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.286 0 N-CA-C 109.596 -1.402 . . . . 0.0 109.596 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' B' B ' 241' ' ' ALA . . . . . . . . . . . . . . . -143.0 153.31 42.86 Favored 'General case' 0 N--CA 1.494 1.766 0 O-C-N 121.708 -0.877 . . . . 0.0 110.269 179.959 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 242' ' ' THR . . . . . . . . . . . . . 36.8 p -110.77 31.79 5.73 Favored 'General case' 0 N--CA 1.496 1.861 0 O-C-N 121.674 -0.641 . . . . 0.0 110.344 -179.76 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 243' ' ' THR . . . . . . . . . . . . . 24.0 m -105.5 139.19 40.49 Favored 'General case' 0 N--CA 1.495 1.813 0 O-C-N 121.566 -0.709 . . . . 0.0 110.218 -179.456 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 244' ' ' LYS . . . . . . . . . . . . . 5.2 ttpm? -114.87 137.52 51.87 Favored 'General case' 0 N--CA 1.496 1.831 0 O-C-N 121.709 -0.619 . . . . 0.0 110.127 -179.893 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 245' ' ' GLU . . . . . . . . . . . . . 46.4 tt0 -130.97 70.48 1.46 Allowed 'General case' 0 N--CA 1.495 1.794 0 O-C-N 121.65 -0.656 . . . . 0.0 110.195 -179.767 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 246' ' ' LYS . . . . . . . . . . . . . 52.3 mttp 53.5 45.51 28.08 Favored 'General case' 0 N--CA 1.505 2.317 0 O-C-N 121.407 -0.808 . . . . 0.0 111.009 178.343 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 247' ' ' ASN . . . . . . . . . . . . . 36.0 t30 -62.83 -38.68 91.72 Favored 'General case' 0 N--CA 1.501 2.12 0 O-C-N 121.549 -0.719 . . . . 0.0 110.506 179.98 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 248' ' ' ILE . . . . . . . . . . . . . 82.0 mt 52.78 78.88 0.07 OUTLIER 'Isoleucine or valine' 0 N--CA 1.507 2.4 0 O-C-N 121.578 -0.701 . . . . 0.0 110.503 179.816 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 249' ' ' SER . . . . . . . . . . . . . 23.1 t -66.07 -36.19 82.54 Favored 'General case' 0 N--CA 1.5 2.046 0 O-C-N 121.536 -0.727 . . . . 0.0 110.332 179.69 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 250' ' ' VAL . . . . . . . . . . . . . 12.4 p -89.89 144.89 8.17 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.914 0 O-C-N 121.759 -0.588 . . . . 0.0 110.289 -179.903 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 251' ' ' ASP . . . . . . . . . . . . . 74.6 m-20 51.79 -174.39 0.02 OUTLIER 'General case' 0 N--CA 1.507 2.389 0 O-C-N 121.707 -0.621 . . . . 0.0 111.176 179.571 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 252' ' ' VAL . . . . . . . . . . . . . 61.5 t 52.0 84.51 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.507 2.412 0 O-C-N 121.633 -0.667 . . . . 0.0 110.603 179.975 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 253' ' ' ASP . . . . . . . . . . . . . 74.7 m-20 -81.77 111.05 17.65 Favored 'General case' 0 N--CA 1.498 1.936 0 O-C-N 121.659 -0.651 . . . . 0.0 110.191 179.659 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 254' ' ' ALA . . . . . . . . . . . . . . . -67.52 -34.03 76.29 Favored 'General case' 0 N--CA 1.498 1.971 0 O-C-N 121.643 -0.661 . . . . 0.0 110.28 179.308 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 255' ' ' ASP . . . . . . . . . . . . . 11.7 p-10 -72.64 -27.28 62.04 Favored 'General case' 0 N--CA 1.5 2.029 0 O-C-N 121.746 -0.597 . . . . 0.0 110.693 -179.887 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 256' ' ' ALA . . . . . . . . . . . . . . . -63.37 -33.9 76.55 Favored 'General case' 0 N--CA 1.501 2.111 0 O-C-N 121.437 -0.789 . . . . 0.0 110.347 179.024 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 257' ' ' SER . . . . . . . . . . . . . 59.2 m -56.62 -39.8 74.25 Favored 'General case' 0 N--CA 1.502 2.157 0 O-C-N 121.667 -0.646 . . . . 0.0 110.594 179.365 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 258' ' ' SER . . . . . . . . . . . . . 68.9 p -69.93 -31.86 69.83 Favored 'General case' 0 N--CA 1.498 1.96 0 C-N-CA 120.248 -0.581 . . . . 0.0 110.302 -178.983 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 259' ' ' GLN . . . . . . . . . . . . . 98.8 mt-30 -64.61 -37.02 86.13 Favored 'General case' 0 N--CA 1.501 2.081 0 O-C-N 121.54 -0.725 . . . . 0.0 110.39 -179.888 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 260' ' ' LEU . . . . . . . . . . . . . 47.1 mt -66.24 -42.22 88.92 Favored 'General case' 0 N--CA 1.501 2.075 0 O-C-N 121.699 -0.625 . . . . 0.0 110.199 179.637 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 261' ' ' LEU . . . . . . . . . . . . . 21.5 tp -70.57 -38.05 74.05 Favored 'General case' 0 N--CA 1.497 1.887 0 O-C-N 121.704 -0.623 . . . . 0.0 109.762 176.561 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 262' ' ' SER . . . . . . . . . . . . . 66.6 m -62.51 -36.04 81.3 Favored 'General case' 0 N--CA 1.501 2.124 0 O-C-N 121.733 -0.604 . . . . 0.0 110.444 176.724 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 263' ' ' LEU . . . . . . . . . . . . . 22.5 mt -64.59 -41.17 96.42 Favored 'General case' 0 N--CA 1.501 2.098 0 O-C-N 121.669 -0.644 . . . . 0.0 110.241 179.803 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 264' ' ' LEU . . . . . . . . . . . . . 85.3 mt -62.28 -37.73 86.62 Favored 'General case' 0 N--CA 1.503 2.182 0 O-C-N 121.667 -0.646 . . . . 0.0 110.353 177.317 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 265' ' ' LYS . . . . . . . . . . . . . 49.0 tttm -76.42 -35.81 58.34 Favored 'General case' 0 N--CA 1.497 1.912 0 O-C-N 121.769 -0.582 . . . . 0.0 110.098 178.903 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 266' ' ' SER . . . . . . . . . . . . . 3.5 m -163.31 113.28 1.34 Allowed 'General case' 0 N--CA 1.495 1.797 0 O-C-N 121.628 -0.67 . . . . 0.0 110.167 -179.757 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 267' ' ' SER . . . . . . . . . . . . . 34.2 m -79.53 -32.62 42.27 Favored 'General case' 0 N--CA 1.498 1.943 0 O-C-N 121.671 -0.643 . . . . 0.0 110.498 -178.965 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 268' ' ' THR . . . . . . . . . . . . . 39.7 p -108.72 167.63 9.93 Favored 'General case' 0 N--CA 1.495 1.815 0 O-C-N 121.574 -0.704 . . . . 0.0 110.41 -177.436 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 269' ' ' ALA . . . . . . . . . . . . . . . 54.93 172.86 0.04 OUTLIER Pre-proline 0 N--CA 1.507 2.405 0 O-C-N 121.707 -0.621 . . . . 0.0 111.312 -178.67 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 270' ' ' PRO . . . . . . . . . . . . . 16.2 Cg_exo -64.83 179.59 1.32 Allowed 'Trans proline' 0 N--CA 1.489 1.246 0 O-C-N 123.505 1.266 . . . . 0.0 110.451 179.5 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 271' ' ' SER . . . . . . . . . . . . . 50.2 m -109.83 149.2 30.19 Favored 'General case' 0 N--CA 1.496 1.826 0 O-C-N 121.758 -0.589 . . . . 0.0 110.204 179.914 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 272' ' ' ASP . . . . . . . . . . . . . 74.6 m-20 -90.38 172.26 8.87 Favored 'General case' 0 N--CA 1.496 1.862 0 O-C-N 121.69 -0.632 . . . . 0.0 110.241 -179.249 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 273' ' ' LEU . . . . . . . . . . . . . 4.6 mm? 52.33 91.06 0.02 OUTLIER 'General case' 0 N--CA 1.507 2.378 0 O-C-N 121.638 -0.664 . . . . 0.0 110.887 -179.505 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 274' ' ' ALA . . . . . . . . . . . . . . . -166.26 155.62 11.53 Favored 'General case' 0 N--CA 1.498 1.937 0 O-C-N 121.751 -0.593 . . . . 0.0 109.957 179.77 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 275' ' ' THR . . . . . . . . . . . . . 26.5 p -89.48 153.11 48.1 Favored Pre-proline 0 N--CA 1.495 1.823 0 O-C-N 121.65 -0.656 . . . . 0.0 110.131 179.806 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 276' ' ' PRO . . . . . . . . . . . . . 31.5 Cg_endo -68.8 129.54 18.84 Favored 'Trans proline' 0 N--CA 1.487 1.143 0 O-C-N 123.608 1.32 . . . . 0.0 110.348 -179.572 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 277' ' ' GLN . . . . . . . . . . . . . 7.1 tt0 -160.71 150.58 14.45 Favored Pre-proline 0 N--CA 1.494 1.745 0 O-C-N 121.746 -0.596 . . . . 0.0 110.117 178.757 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 278' ' ' PRO . . . . . . . . . . . . . 17.4 Cg_exo -62.89 133.16 40.25 Favored 'Trans proline' 0 N--CA 1.491 1.331 0 O-C-N 123.452 1.238 . . . . 0.0 110.506 178.632 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 279' ' ' SER . . . . . . . . . . . . . 66.9 p -99.36 -62.58 1.22 Allowed 'General case' 0 N--CA 1.495 1.818 0 O-C-N 121.67 -0.644 . . . . 0.0 110.217 179.655 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 280' ' ' THR . . . . . . . . . . . . . 25.6 m -129.46 138.91 51.68 Favored 'General case' 0 N--CA 1.494 1.77 0 O-C-N 121.654 -0.654 . . . . 0.0 110.134 179.249 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 281' ' ' PHE . . . . . . . . . . . . . 29.9 m-85 51.94 91.44 0.07 OUTLIER Pre-proline 0 N--CA 1.506 2.35 0 O-C-N 121.65 -0.656 . . . . 0.0 111.001 179.966 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 282' ' ' PRO . . . . . . . . . . . . . 19.6 Cg_endo -64.71 -32.06 57.7 Favored 'Trans proline' 0 N--CA 1.49 1.27 0 O-C-N 123.443 1.233 . . . . 0.0 110.506 179.961 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 283' ' ' GLN . . . . . . . . . . . . . 24.2 mt-30 -139.38 154.51 71.84 Favored Pre-proline 0 N--CA 1.495 1.78 0 O-C-N 121.565 -0.709 . . . . 0.0 110.126 178.531 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 284' ' ' PRO . . . . . . . . . . . . . 30.4 Cg_endo -68.49 112.81 2.94 Favored 'Trans proline' 0 N--CA 1.489 1.24 0 O-C-N 123.651 1.342 . . . . 0.0 110.297 -179.619 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 285' ' ' PRO . . . . . . . . . . . . . 33.1 Cg_endo -68.79 -33.82 19.87 Favored 'Trans proline' 0 N--CA 1.489 1.257 0 O-C-N 123.389 1.205 . . . . 0.0 110.363 179.234 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 286' ' ' VAL . . . . . . . . . . . . . 57.5 t -69.93 -37.36 72.62 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.046 0 O-C-N 121.664 -0.647 . . . . 0.0 109.78 -179.002 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 287' ' ' GLU . . . . . . . . . . . . . 46.3 tt0 -65.97 -38.54 88.84 Favored 'General case' 0 N--CA 1.501 2.108 0 O-C-N 121.689 -0.632 . . . . 0.0 110.43 -178.283 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 288' ' ' SER . . . . . . . . . . . . . 29.6 t -132.27 136.03 46.66 Favored 'General case' 0 N--CA 1.496 1.828 0 O-C-N 121.606 -0.684 . . . . 0.0 110.299 -179.623 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 289' ' ' HIS . . . . . . . . . . . . . 48.9 p-80 -128.53 150.24 50.26 Favored 'General case' 0 N--CA 1.496 1.835 0 O-C-N 121.711 -0.618 . . . . 0.0 110.244 179.856 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 290' ' ' SER . . . . . . . . . . . . . 47.5 m -119.57 147.43 44.49 Favored 'General case' 0 N--CA 1.495 1.817 0 O-C-N 121.687 -0.633 . . . . 0.0 110.172 -179.953 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 291' ' ' SER . . . . . . . . . . . . . 2.7 t . . . . . 0 N--CA 1.494 1.764 0 CA-C-O 118.051 -0.976 . . . . 0.0 110.237 -179.955 . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' -1' ' ' MET . . . . . . . . . . . . . 69.8 mmm . . . . . 0 N--CA 1.492 1.666 0 CA-C-O 120.993 0.425 . . . . 0.0 110.135 . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 0' ' ' GLY . . . . . . . . . . . . . . . 76.65 38.08 33.12 Favored Glycine 0 N--CA 1.495 2.58 0 N-CA-C 109.516 -1.434 . . . . 0.0 109.516 -179.821 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 65.1 mtt 52.2 84.55 0.05 OUTLIER 'General case' 0 N--CA 1.505 2.287 0 O-C-N 121.568 -0.96 . . . . 0.0 110.963 -179.319 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 75.5 m -100.99 -179.1 3.95 Favored 'General case' 0 N--CA 1.494 1.758 0 O-C-N 121.704 -0.622 . . . . 0.0 110.222 -179.681 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 58.1 t -65.78 -27.98 42.79 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.176 0 O-C-N 121.721 -0.612 . . . . 0.0 110.326 -179.146 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -55.63 -32.45 63.17 Favored 'General case' 0 N--CA 1.504 2.24 0 O-C-N 121.427 -0.796 . . . . 0.0 110.424 -178.319 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -68.7 -34.4 75.58 Favored 'General case' 0 N--CA 1.498 1.937 0 C-N-CA 120.389 -0.524 . . . . 0.0 109.971 174.79 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 96.2 m-85 -97.37 10.21 40.25 Favored 'General case' 0 N--CA 1.498 1.958 0 O-C-N 121.767 -0.583 . . . . 0.0 111.166 178.798 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -67.43 128.88 38.06 Favored 'General case' 0 N--CA 1.5 2.071 0 O-C-N 121.247 -0.908 . . . . 0.0 110.006 -179.832 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 82.77 -0.82 89.23 Favored Glycine 0 N--CA 1.497 2.723 0 N-CA-C 110.839 -0.904 . . . . 0.0 110.839 -176.463 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 57.7 p -76.37 138.7 40.59 Favored 'General case' 0 N--CA 1.497 1.918 0 O-C-N 121.07 -1.253 . . . . 0.0 110.335 177.171 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 11.3 t-20 -84.55 119.17 24.87 Favored 'General case' 0 N--CA 1.496 1.844 0 O-C-N 121.666 -0.646 . . . . 0.0 109.784 174.154 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 35.1 m -141.75 163.99 19.38 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.717 0 O-C-N 121.737 -0.602 . . . . 0.0 109.427 -179.41 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . 0.407 ' HA ' ' HA ' ' A' ' 22' ' ' ARG . 37.7 tt0 -109.37 130.15 55.51 Favored 'General case' 0 N--CA 1.492 1.649 0 C-N-CA 119.855 -0.738 . . . . 0.0 109.996 177.574 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 58.4 t -106.78 127.35 62.39 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.692 0 O-C-N 121.551 -0.718 . . . . 0.0 109.827 -179.799 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 29.4 tp -95.81 125.85 40.66 Favored 'General case' 0 N--CA 1.494 1.769 0 N-CA-C 109.102 -0.703 . . . . 0.0 109.102 174.344 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 85.0 mt -97.07 166.79 11.42 Favored 'General case' 0 N--CA 1.495 1.792 0 O-C-N 121.624 -0.672 . . . . 0.0 111.293 -171.968 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 24.4 p30 -58.0 -21.49 45.08 Favored 'General case' 0 N--CA 1.507 2.382 0 O-C-N 121.83 -0.544 . . . . 0.0 111.569 -177.296 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 43.5 p-10 -93.54 27.1 2.74 Favored 'General case' 0 N--CA 1.497 1.887 0 O-C-N 121.537 -0.727 . . . . 0.0 110.539 -178.135 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 1.1 p30 53.08 27.28 5.6 Favored 'General case' 0 N--CA 1.506 2.345 0 CA-C-O 121.173 0.511 . . . . 0.0 111.042 172.249 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 51.1 m -107.62 147.33 30.79 Favored 'General case' 0 N--CA 1.491 1.585 0 N-CA-C 109.149 -0.685 . . . . 0.0 109.149 171.026 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 49.6 mttp -109.62 147.81 32.4 Favored 'General case' 0 N--CA 1.495 1.784 0 O-C-N 121.595 -0.691 . . . . 0.0 110.62 -174.744 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -153.02 156.61 39.13 Favored 'General case' 0 N--CA 1.496 1.826 0 O-C-N 121.742 -0.599 . . . . 0.0 110.129 176.18 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . 0.407 ' HA ' ' HA ' ' A' ' 12' ' ' GLU . 30.8 ptt180 -144.07 152.84 41.52 Favored 'General case' 0 N--CA 1.496 1.838 0 O-C-N 121.679 -0.638 . . . . 0.0 110.416 178.464 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -171.9 171.07 43.93 Favored Glycine 0 N--CA 1.493 2.453 0 N-CA-C 109.184 -1.566 . . . . 0.0 109.184 179.597 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 45.4 t -94.57 126.31 47.02 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.925 0 O-C-N 121.643 -0.916 . . . . 0.0 109.178 175.498 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 52.7 mt -62.86 138.36 22.97 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.147 0 O-C-N 121.589 -0.694 . . . . 0.0 111.012 -170.806 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 18.1 p -121.25 -19.09 7.19 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.861 -0.524 . . . . 0.0 111.563 179.501 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 2.2 t-20 -165.26 157.94 15.87 Favored 'General case' 0 N--CA 1.504 2.263 0 O-C-N 120.949 -1.095 . . . . 0.0 111.732 175.329 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 64.3 t80 -150.29 121.11 7.58 Favored 'General case' 0 N--CA 1.495 1.79 0 N-CA-C 109.246 -0.65 . . . . 0.0 109.246 173.683 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 17.8 t70 -98.28 130.42 44.98 Favored 'General case' 0 N--CA 1.492 1.645 0 N-CA-C 109.114 -0.699 . . . . 0.0 109.114 -176.708 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 23.2 t -70.22 -52.32 24.07 Favored 'General case' 0 N--CA 1.497 1.91 0 C-N-CA 119.977 -0.689 . . . . 0.0 110.618 -176.653 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 22.5 m -60.42 -40.69 91.91 Favored 'General case' 0 N--CA 1.502 2.171 0 O-C-N 121.654 -0.654 . . . . 0.0 110.798 -174.993 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 29.8 m120 -104.0 -10.09 18.35 Favored 'General case' 0 N--CA 1.497 1.914 0 O-C-N 121.578 -0.701 . . . . 0.0 111.601 -177.266 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 7.7 m 49.54 67.22 0.93 Allowed 'General case' 0 N--CA 1.508 2.441 0 O-C-N 121.114 -0.991 . . . . 0.0 110.886 -174.606 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 44.7 mm -121.41 125.9 74.23 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.001 0 O-C-N 121.603 -0.686 . . . . 0.0 109.329 -175.886 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 15.8 tp -116.19 118.91 34.12 Favored 'General case' 0 N--CA 1.494 1.743 0 O-C-N 121.617 -0.677 . . . . 0.0 110.537 -171.088 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 92.1 mt-30 -91.35 131.24 36.97 Favored 'General case' 0 N--CA 1.491 1.624 0 N-CA-C 109.391 -0.596 . . . . 0.0 109.391 171.299 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 44.6 mt -117.81 123.54 46.2 Favored 'General case' 0 N--CA 1.494 1.764 0 O-C-N 121.752 -0.592 . . . . 0.0 110.15 176.41 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 66.0 mtt-85 -103.18 106.59 17.14 Favored 'General case' 0 N--CA 1.498 1.942 0 O-C-N 121.688 -0.632 . . . . 0.0 110.246 171.583 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 56.9 tp -83.53 151.76 25.24 Favored 'General case' 0 N--CA 1.497 1.925 0 O-C-N 121.527 -0.733 . . . . 0.0 110.488 -178.256 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -68.69 -2.95 10.37 Favored 'General case' 0 N--CA 1.503 2.202 0 O-C-N 121.722 -0.611 . . . . 0.0 112.172 -170.641 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 91.4 m-20 -87.89 28.83 0.98 Allowed 'General case' 0 N--CA 1.498 1.938 0 O-C-N 121.033 -1.042 . . . . 0.0 110.74 174.769 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 6.3 t70 64.99 28.8 12.46 Favored 'General case' 0 N--CA 1.506 2.326 0 O-C-N 121.205 -0.934 . . . . 0.0 110.397 175.771 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 67.2 m -123.97 139.72 53.67 Favored 'General case' 0 N--CA 1.495 1.777 0 O-C-N 121.449 -0.782 . . . . 0.0 110.035 177.869 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 7.6 t -128.16 147.1 50.54 Favored 'General case' 0 N--CA 1.496 1.861 0 O-C-N 121.736 -0.603 . . . . 0.0 109.939 179.486 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 21.8 ttpt -152.25 132.4 13.54 Favored 'General case' 0 N--CA 1.496 1.869 0 C-N-CA 120.1 -0.64 . . . . 0.0 110.686 -177.526 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 86.9 p -95.27 124.33 39.25 Favored 'General case' 0 N--CA 1.495 1.779 0 O-C-N 121.75 -0.594 . . . . 0.0 110.108 177.574 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 77.8 mt -129.25 134.94 62.97 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.855 0 O-C-N 121.651 -0.655 . . . . 0.0 109.333 179.724 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 64.2 t -81.78 127.67 39.39 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.916 0 N-CA-C 109.074 -0.713 . . . . 0.0 109.074 177.646 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 61.0 p -58.03 -24.96 60.41 Favored 'General case' 0 N--CA 1.506 2.365 0 O-C-N 121.49 -0.756 . . . . 0.0 111.872 -167.763 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 33.5 tttp -56.65 -24.8 50.95 Favored 'General case' 0 N--CA 1.503 2.196 0 O-C-N 121.444 -0.785 . . . . 0.0 111.014 -177.228 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 46.3 p30 -84.06 3.28 35.31 Favored 'General case' 0 N--CA 1.499 1.992 0 C-N-CA 119.725 -0.79 . . . . 0.0 111.363 176.691 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 98.9 mt -75.2 124.38 32.94 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.104 0 O-C-N 121.185 -0.947 . . . . 0.0 109.926 177.976 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 74.7 tttt -93.26 -28.59 16.15 Favored 'General case' 0 N--CA 1.495 1.786 0 O-C-N 121.81 -0.556 . . . . 0.0 109.959 171.227 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 5.0 m-20 -163.3 153.58 15.89 Favored 'General case' 0 N--CA 1.499 2.02 0 O-C-N 121.707 -0.62 . . . . 0.0 110.068 -178.094 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 83.8 mt -132.96 148.8 52.27 Favored 'General case' 0 N--CA 1.497 1.902 0 O-C-N 121.681 -0.637 . . . . 0.0 110.512 -178.535 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 20.2 ptp180 -151.97 145.19 24.66 Favored 'General case' 0 N--CA 1.495 1.799 0 O-C-N 121.7 -0.625 . . . . 0.0 110.123 175.152 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 67.1 mt -85.84 133.48 29.5 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.822 0 O-C-N 121.539 -0.726 . . . . 0.0 109.765 172.405 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 30.5 mt -79.34 123.92 84.36 Favored Pre-proline 0 N--CA 1.497 1.898 0 O-C-N 121.446 -0.784 . . . . 0.0 109.802 -177.215 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 31.7 Cg_endo -68.05 142.72 57.31 Favored 'Trans proline' 0 N--CA 1.489 1.231 0 O-C-N 123.359 1.189 . . . . 0.0 110.676 -174.872 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 89.4 mttt -135.52 114.84 12.46 Favored 'General case' 0 N--CA 1.495 1.775 0 O-C-N 121.754 -0.591 . . . . 0.0 109.927 176.31 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 29.9 m120 -140.05 174.54 10.41 Favored 'General case' 0 N--CA 1.496 1.828 0 O-C-N 121.603 -0.686 . . . . 0.0 110.353 -178.064 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 75.0 mm-40 -104.42 175.8 5.37 Favored 'General case' 0 N--CA 1.495 1.811 0 O-C-N 121.688 -0.632 . . . . 0.0 110.087 179.348 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 7.0 tp -119.35 142.72 33.31 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.944 0 O-C-N 121.74 -0.6 . . . . 0.0 110.171 -179.297 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 64' ' ' MET . . . . . . . . . . . . . 4.8 ttt 52.37 86.93 0.15 Allowed Pre-proline 0 N--CA 1.505 2.29 0 O-C-N 121.637 -0.665 . . . . 0.0 111.041 -179.683 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 27.7 Cg_endo -66.88 141.93 60.73 Favored 'Trans proline' 0 N--CA 1.488 1.172 0 O-C-N 123.533 1.281 . . . . 0.0 110.368 179.444 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 77.8 mttt -65.5 -36.58 84.27 Favored 'General case' 0 N--CA 1.501 2.11 0 O-C-N 121.719 -0.613 . . . . 0.0 110.391 -179.59 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 1.3 p-10 -128.93 30.41 5.07 Favored 'General case' 0 N--CA 1.498 1.934 0 O-C-N 121.64 -0.663 . . . . 0.0 110.601 -179.513 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 80.0 -178.83 53.63 Favored Glycine 0 N--CA 1.494 2.543 0 N-CA-C 109.523 -1.431 . . . . 0.0 109.523 179.797 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 24.7 m -68.06 -40.55 82.73 Favored 'General case' 0 N--CA 1.498 1.973 0 O-C-N 121.748 -0.854 . . . . 0.0 110.225 179.422 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 39.9 tttp 62.23 -70.97 0.05 OUTLIER 'General case' 0 N--CA 1.507 2.398 0 O-C-N 122.01 -0.431 . . . . 0.0 111.092 -177.377 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 19.5 p -118.25 91.14 39.93 Favored Pre-proline 0 N--CA 1.495 1.816 0 O-C-N 121.308 -0.87 . . . . 0.0 110.232 -178.089 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 23.7 Cg_exo -60.53 -28.79 87.29 Favored 'Trans proline' 0 N--CA 1.491 1.374 0 O-C-N 123.547 1.288 . . . . 0.0 110.944 179.976 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 29.9 t -104.02 137.37 42.08 Favored 'General case' 0 N--CA 1.495 1.787 0 O-C-N 121.607 -0.683 . . . . 0.0 110.174 179.721 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 42.8 p -77.2 -31.39 55.29 Favored 'General case' 0 N--CA 1.499 2.013 0 O-C-N 121.691 -0.631 . . . . 0.0 110.395 -179.588 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 91.7 m-20 -99.18 120.72 39.98 Favored 'General case' 0 N--CA 1.496 1.841 0 O-C-N 121.593 -0.692 . . . . 0.0 110.276 -179.133 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 87.6 p -151.59 164.42 36.91 Favored 'General case' 0 N--CA 1.495 1.784 0 O-C-N 121.694 -0.629 . . . . 0.0 110.089 179.228 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 39.8 p -96.47 11.32 35.4 Favored 'General case' 0 N--CA 1.495 1.806 0 O-C-N 121.586 -0.696 . . . . 0.0 111.255 179.562 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 52.2 mtmt -67.83 -33.79 75.48 Favored 'General case' 0 N--CA 1.5 2.045 0 O-C-N 121.265 -0.897 . . . . 0.0 110.274 179.276 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 6.3 mp -92.2 148.04 22.46 Favored 'General case' 0 N--CA 1.496 1.862 0 O-C-N 121.643 -0.661 . . . . 0.0 110.245 -179.836 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 40.5 pttt -133.09 170.66 15.08 Favored 'General case' 0 N--CA 1.496 1.869 0 O-C-N 121.639 -0.663 . . . . 0.0 110.337 179.976 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 31.3 t -102.23 142.91 32.71 Favored 'General case' 0 N--CA 1.495 1.791 0 O-C-N 121.712 -0.617 . . . . 0.0 110.153 -179.715 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -72.76 139.44 47.11 Favored 'General case' 0 N--CA 1.498 1.957 0 O-C-N 121.716 -0.615 . . . . 0.0 110.164 -179.332 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 54.7 mt-10 -118.87 153.94 33.73 Favored 'General case' 0 N--CA 1.496 1.848 0 O-C-N 121.758 -0.589 . . . . 0.0 110.078 179.506 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 46.3 p -126.13 24.62 6.87 Favored 'General case' 0 N--CA 1.498 1.926 0 O-C-N 121.609 -0.682 . . . . 0.0 110.815 -179.864 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 85.8 m-85 -77.25 -34.12 55.86 Favored 'General case' 0 N--CA 1.499 2.009 0 O-C-N 121.461 -0.774 . . . . 0.0 110.158 178.644 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 87.4 p -148.28 169.53 19.91 Favored 'General case' 0 N--CA 1.494 1.775 0 O-C-N 121.718 -0.614 . . . . 0.0 110.238 179.905 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 49.3 m -114.2 148.15 37.78 Favored 'General case' 0 N--CA 1.494 1.76 0 O-C-N 121.715 -0.615 . . . . 0.0 110.173 -179.996 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 86.0 mttt -66.98 -39.54 87.21 Favored 'General case' 0 N--CA 1.5 2.036 0 O-C-N 121.598 -0.689 . . . . 0.0 110.369 179.974 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 30.0 m120 -76.54 -39.1 53.85 Favored 'General case' 0 N--CA 1.499 1.999 0 O-C-N 121.683 -0.636 . . . . 0.0 110.482 -178.016 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 94.3 mttt -107.4 136.52 47.06 Favored 'General case' 0 N--CA 1.496 1.861 0 O-C-N 121.729 -0.607 . . . . 0.0 110.427 -177.633 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 91' ' ' TRP . . . . . . . . . . . . . 98.7 m95 -105.01 145.4 30.49 Favored 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.65 -0.656 . . . . 0.0 110.266 179.557 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 23.6 m -64.29 -35.17 79.98 Favored 'General case' 0 N--CA 1.502 2.146 0 O-C-N 121.701 -0.624 . . . . 0.0 110.318 -179.604 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 93' ' ' MET . . . . . . . . . . . . . 49.4 ttm -120.3 141.38 50.07 Favored 'General case' 0 N--CA 1.494 1.732 0 O-C-N 121.706 -0.621 . . . . 0.0 110.182 179.74 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 20.0 t0 . . . . . 0 N--CA 1.494 1.767 0 CA-C-O 118.008 -0.996 . . . . 0.0 110.22 -179.934 . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' B' B ' 240' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.315 0 N-CA-C 109.536 -1.426 . . . . 0.0 109.536 . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' B' B ' 241' ' ' ALA . . . . . . . . . . . . . . . -143.37 154.65 43.94 Favored 'General case' 0 N--CA 1.494 1.753 0 O-C-N 121.658 -0.907 . . . . 0.0 110.268 179.895 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 242' ' ' THR . . . . . . . . . . . . . 42.6 p -69.23 -34.1 74.31 Favored 'General case' 0 N--CA 1.498 1.971 0 O-C-N 121.649 -0.657 . . . . 0.0 110.161 -179.758 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 243' ' ' THR . . . . . . . . . . . . . 39.3 p -126.52 154.49 43.73 Favored 'General case' 0 N--CA 1.495 1.798 0 O-C-N 121.587 -0.696 . . . . 0.0 110.168 179.706 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 244' ' ' LYS . . . . . . . . . . . . . 40.6 tttp -66.31 -34.96 79.17 Favored 'General case' 0 N--CA 1.5 2.046 0 O-C-N 121.671 -0.643 . . . . 0.0 110.352 179.5 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 245' ' ' GLU . . . . . . . . . . . . . 55.0 mt-10 -95.25 148.06 22.81 Favored 'General case' 0 N--CA 1.494 1.768 0 O-C-N 121.67 -0.644 . . . . 0.0 110.304 -179.097 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 246' ' ' LYS . . . . . . . . . . . . . 17.2 tptm -157.02 34.06 0.29 Allowed 'General case' 0 N--CA 1.495 1.807 0 O-C-N 121.734 -0.604 . . . . 0.0 110.133 179.986 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 247' ' ' ASN . . . . . . . . . . . . . 90.9 m-20 -109.14 123.22 48.86 Favored 'General case' 0 N--CA 1.495 1.787 0 O-C-N 121.528 -0.733 . . . . 0.0 110.311 -179.289 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 248' ' ' ILE . . . . . . . . . . . . . 81.0 mt 52.68 94.2 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.508 2.427 0 O-C-N 121.649 -0.657 . . . . 0.0 110.692 179.526 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 249' ' ' SER . . . . . . . . . . . . . 95.8 p -112.01 146.67 37.48 Favored 'General case' 0 N--CA 1.494 1.774 0 O-C-N 121.652 -0.655 . . . . 0.0 110.218 179.496 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 250' ' ' VAL . . . . . . . . . . . . . 82.3 t -148.88 140.07 17.24 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.975 0 O-C-N 121.66 -0.65 . . . . 0.0 109.395 -179.769 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 251' ' ' ASP . . . . . . . . . . . . . 5.8 p-10 -161.65 88.07 0.7 Allowed 'General case' 0 N--CA 1.497 1.907 0 O-C-N 121.714 -0.616 . . . . 0.0 110.414 -179.962 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 252' ' ' VAL . . . . . . . . . . . . . 58.8 t 52.61 81.8 0.05 OUTLIER 'Isoleucine or valine' 0 N--CA 1.506 2.342 0 O-C-N 121.432 -0.793 . . . . 0.0 110.668 179.431 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 253' ' ' ASP . . . . . . . . . . . . . 74.6 m-20 51.66 90.42 0.02 OUTLIER 'General case' 0 N--CA 1.506 2.346 0 O-C-N 121.597 -0.689 . . . . 0.0 111.226 178.994 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 254' ' ' ALA . . . . . . . . . . . . . . . -66.99 -31.7 72.44 Favored 'General case' 0 N--CA 1.5 2.045 0 O-C-N 121.632 -0.667 . . . . 0.0 110.32 178.2 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 255' ' ' ASP . . . . . . . . . . . . . 17.5 t0 -72.81 -26.25 61.44 Favored 'General case' 0 N--CA 1.499 1.984 0 O-C-N 121.676 -0.64 . . . . 0.0 110.662 179.89 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 256' ' ' ALA . . . . . . . . . . . . . . . -62.21 -31.72 72.29 Favored 'General case' 0 N--CA 1.501 2.122 0 O-C-N 121.445 -0.785 . . . . 0.0 110.421 -179.694 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 257' ' ' SER . . . . . . . . . . . . . 50.0 m -55.26 -34.91 64.44 Favored 'General case' 0 N--CA 1.503 2.224 0 O-C-N 121.595 -0.69 . . . . 0.0 110.518 176.808 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 258' ' ' SER . . . . . . . . . . . . . 23.4 t -68.23 -33.04 73.66 Favored 'General case' 0 N--CA 1.499 2.0 0 C-N-CA 120.463 -0.495 . . . . 0.0 110.242 -179.814 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 259' ' ' GLN . . . . . . . . . . . . . 78.3 mt-30 -64.65 -34.91 79.4 Favored 'General case' 0 N--CA 1.5 2.031 0 O-C-N 121.665 -0.647 . . . . 0.0 110.37 179.717 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 260' ' ' LEU . . . . . . . . . . . . . 85.7 mt -65.66 -42.6 91.17 Favored 'General case' 0 N--CA 1.501 2.082 0 O-C-N 121.728 -0.608 . . . . 0.0 110.259 179.288 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 261' ' ' LEU . . . . . . . . . . . . . 22.5 tp -69.79 -36.91 76.1 Favored 'General case' 0 N--CA 1.498 1.943 0 C-N-CA 120.175 -0.61 . . . . 0.0 109.73 176.391 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 262' ' ' SER . . . . . . . . . . . . . 22.8 t -62.33 -36.4 82.08 Favored 'General case' 0 N--CA 1.5 2.07 0 O-C-N 121.756 -0.59 . . . . 0.0 110.516 177.198 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 263' ' ' LEU . . . . . . . . . . . . . 18.2 mt -64.79 -44.48 89.83 Favored 'General case' 0 N--CA 1.501 2.076 0 O-C-N 121.654 -0.654 . . . . 0.0 110.154 179.764 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 264' ' ' LEU . . . . . . . . . . . . . 84.9 mt -62.92 -35.25 79.46 Favored 'General case' 0 N--CA 1.502 2.13 0 O-C-N 121.734 -0.604 . . . . 0.0 110.678 178.918 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 265' ' ' LYS . . . . . . . . . . . . . 30.1 ttpt -76.04 -44.99 36.62 Favored 'General case' 0 N--CA 1.497 1.911 0 O-C-N 121.697 -0.627 . . . . 0.0 110.265 -177.344 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 266' ' ' SER . . . . . . . . . . . . . 39.2 t 50.58 -170.87 0.02 OUTLIER 'General case' 0 N--CA 1.506 2.367 0 O-C-N 121.635 -0.665 . . . . 0.0 111.111 -178.254 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 267' ' ' SER . . . . . . . . . . . . . 97.1 p -108.66 133.37 52.85 Favored 'General case' 0 N--CA 1.496 1.84 0 O-C-N 121.686 -0.634 . . . . 0.0 110.157 179.21 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 268' ' ' THR . . . . . . . . . . . . . 39.5 p -135.72 161.38 35.71 Favored 'General case' 0 N--CA 1.495 1.82 0 O-C-N 121.726 -0.609 . . . . 0.0 110.262 -179.917 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 269' ' ' ALA . . . . . . . . . . . . . . . 48.2 88.71 0.1 Allowed Pre-proline 0 N--CA 1.506 2.352 0 O-C-N 121.759 -0.588 . . . . 0.0 111.382 -179.873 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 270' ' ' PRO . . . . . . . . . . . . . 27.1 Cg_endo -66.92 145.18 73.37 Favored 'Trans proline' 0 N--CA 1.488 1.183 0 O-C-N 123.519 1.273 . . . . 0.0 110.323 178.748 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 271' ' ' SER . . . . . . . . . . . . . 48.8 m -118.88 145.85 45.38 Favored 'General case' 0 N--CA 1.495 1.81 0 O-C-N 121.682 -0.636 . . . . 0.0 110.208 -179.749 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 272' ' ' ASP . . . . . . . . . . . . . 74.6 m-20 -127.97 -44.88 1.44 Allowed 'General case' 0 N--CA 1.497 1.914 0 O-C-N 121.703 -0.623 . . . . 0.0 110.219 179.762 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 273' ' ' LEU . . . . . . . . . . . . . 21.0 tp -161.77 145.06 12.22 Favored 'General case' 0 N--CA 1.495 1.783 0 O-C-N 121.604 -0.685 . . . . 0.0 110.169 -179.801 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 274' ' ' ALA . . . . . . . . . . . . . . . 50.45 -169.06 0.03 OUTLIER 'General case' 0 N--CA 1.506 2.359 0 O-C-N 121.647 -0.658 . . . . 0.0 111.174 -179.145 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 275' ' ' THR . . . . . . . . . . . . . 22.7 p -96.86 163.2 20.68 Favored Pre-proline 0 N--CA 1.495 1.784 0 O-C-N 121.73 -0.606 . . . . 0.0 110.258 -179.362 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 276' ' ' PRO . . . . . . . . . . . . . 21.9 Cg_exo -61.56 -31.0 86.98 Favored 'Trans proline' 0 N--CA 1.491 1.354 0 O-C-N 123.68 1.358 . . . . 0.0 110.803 -179.566 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 277' ' ' GLN . . . . . . . . . . . . . 35.5 mt-30 -109.75 157.24 38.14 Favored Pre-proline 0 N--CA 1.495 1.806 0 O-C-N 121.596 -0.69 . . . . 0.0 110.258 -179.749 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 278' ' ' PRO . . . . . . . . . . . . . 17.1 Cg_exo -63.05 141.91 85.42 Favored 'Trans proline' 0 N--CA 1.491 1.349 0 O-C-N 123.643 1.338 . . . . 0.0 110.618 179.327 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 279' ' ' SER . . . . . . . . . . . . . 26.7 t -160.64 -67.68 0.07 Allowed 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.644 -0.66 . . . . 0.0 110.171 178.332 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 280' ' ' THR . . . . . . . . . . . . . 24.7 m -70.4 -35.27 73.36 Favored 'General case' 0 N--CA 1.498 1.949 0 O-C-N 121.615 -0.678 . . . . 0.0 110.167 179.069 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 281' ' ' PHE . . . . . . . . . . . . . 42.7 m-85 -112.37 167.71 8.75 Favored Pre-proline 0 N--CA 1.495 1.782 0 O-C-N 121.76 -0.587 . . . . 0.0 110.334 -178.581 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 282' ' ' PRO . . . . . . . . . . . . . 17.3 Cg_exo -63.26 -177.48 0.37 Allowed 'Trans proline' 0 N--CA 1.489 1.25 0 O-C-N 123.683 1.36 . . . . 0.0 110.631 179.895 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 283' ' ' GLN . . . . . . . . . . . . . 39.1 mt-30 -81.94 166.08 39.44 Favored Pre-proline 0 N--CA 1.497 1.914 0 O-C-N 121.756 -0.59 . . . . 0.0 110.095 -179.666 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 284' ' ' PRO . . . . . . . . . . . . . 24.7 Cg_exo -56.71 -51.81 8.26 Favored 'Trans proline' 0 N--CA 1.492 1.384 0 O-C-N 123.57 1.3 . . . . 0.0 111.905 -177.59 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 285' ' ' PRO . . . . . . . . . . . . . 36.3 Cg_endo -72.17 159.25 50.28 Favored 'Trans proline' 0 N--CA 1.486 1.053 0 O-C-N 123.226 1.119 . . . . 0.0 110.275 -175.59 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 286' ' ' VAL . . . . . . . . . . . . . 54.6 t -99.63 133.48 42.31 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.823 0 O-C-N 121.629 -0.67 . . . . 0.0 109.704 -178.869 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 287' ' ' GLU . . . . . . . . . . . . . 74.3 mm-40 -66.91 -36.39 82.17 Favored 'General case' 0 N--CA 1.499 2.006 0 O-C-N 121.697 -0.627 . . . . 0.0 110.52 -177.627 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 288' ' ' SER . . . . . . . . . . . . . 50.3 m -112.08 146.36 38.11 Favored 'General case' 0 N--CA 1.496 1.872 0 O-C-N 121.687 -0.633 . . . . 0.0 110.314 -179.811 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 289' ' ' HIS . . . . . . . . . . . . . 83.2 t60 -66.72 -38.79 87.4 Favored 'General case' 0 N--CA 1.5 2.036 0 O-C-N 121.674 -0.641 . . . . 0.0 110.332 179.559 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 290' ' ' SER . . . . . . . . . . . . . 92.1 p -116.12 153.83 31.06 Favored 'General case' 0 N--CA 1.496 1.831 0 O-C-N 121.718 -0.614 . . . . 0.0 110.269 -179.26 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 291' ' ' SER . . . . . . . . . . . . . 89.0 p . . . . . 0 N--CA 1.496 1.844 0 CA-C-O 118.064 -0.969 . . . . 0.0 110.195 -179.603 . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' -1' ' ' MET . . . . . . . . . . . . . 85.1 mtp . . . . . 0 N--CA 1.493 1.709 0 CA-C-O 121.0 0.428 . . . . 0.0 110.221 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 0' ' ' GLY . . . . . . . . . . . . . . . -84.03 -174.66 50.49 Favored Glycine 0 N--CA 1.494 2.528 0 N-CA-C 109.481 -1.448 . . . . 0.0 109.481 179.757 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 65.6 mtt -94.49 129.53 41.23 Favored 'General case' 0 N--CA 1.496 1.833 0 O-C-N 121.631 -0.923 . . . . 0.0 110.156 -179.973 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 70.3 m -101.17 167.83 9.96 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.682 -0.636 . . . . 0.0 110.124 -179.898 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 65.7 t -66.33 -27.81 41.64 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.131 0 O-C-N 121.792 -0.568 . . . . 0.0 110.249 -179.771 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -55.14 -30.94 60.85 Favored 'General case' 0 N--CA 1.505 2.292 0 O-C-N 121.462 -0.774 . . . . 0.0 110.449 -178.671 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 9.7 m-20 -68.66 -30.87 69.66 Favored 'General case' 0 N--CA 1.499 2.024 0 O-C-N 121.88 -0.513 . . . . 0.0 110.24 174.789 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 96.5 m-85 -95.84 10.1 38.28 Favored 'General case' 0 N--CA 1.497 1.921 0 O-C-N 121.679 -0.638 . . . . 0.0 111.449 -178.398 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 3.7 m-30 -67.16 141.81 57.24 Favored 'General case' 0 N--CA 1.501 2.105 0 O-C-N 121.147 -0.971 . . . . 0.0 110.112 174.966 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 82.95 -1.39 88.66 Favored Glycine 0 N--CA 1.498 2.776 0 N-CA-C 110.745 -0.942 . . . . 0.0 110.745 -177.056 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 88.5 p -77.34 141.01 40.09 Favored 'General case' 0 N--CA 1.498 1.972 0 O-C-N 121.125 -1.221 . . . . 0.0 110.509 -179.454 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 2.5 m120 -85.16 118.53 24.78 Favored 'General case' 0 N--CA 1.498 1.943 0 O-C-N 121.669 -0.644 . . . . 0.0 109.646 174.323 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 35.8 m -143.12 160.94 17.6 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.796 0 O-C-N 121.732 -0.605 . . . . 0.0 109.76 -178.746 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . 0.421 ' HA ' ' HA ' ' A' ' 22' ' ' ARG . 44.6 tt0 -109.43 125.36 52.34 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.575 -0.703 . . . . 0.0 110.16 178.142 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 59.6 t -106.87 123.17 61.74 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.839 0 O-C-N 121.565 -0.709 . . . . 0.0 109.946 -177.629 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 27.6 tp -96.2 128.95 43.58 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.726 -0.609 . . . . 0.0 109.636 175.222 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 82.8 mt -99.04 167.16 10.9 Favored 'General case' 0 N--CA 1.497 1.922 0 O-C-N 121.609 -0.682 . . . . 0.0 110.97 -171.799 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 9.5 p30 -57.77 -22.11 45.23 Favored 'General case' 0 N--CA 1.505 2.294 0 O-C-N 121.76 -0.587 . . . . 0.0 111.39 -179.961 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 24.6 p30 -90.03 21.3 3.75 Favored 'General case' 0 N--CA 1.5 2.063 0 O-C-N 121.59 -0.694 . . . . 0.0 111.163 -177.721 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 74.4 m-20 59.87 28.8 18.35 Favored 'General case' 0 N--CA 1.506 2.36 0 O-C-N 121.339 -0.851 . . . . 0.0 110.813 172.675 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 18.0 m -111.66 133.94 53.57 Favored 'General case' 0 N--CA 1.494 1.769 0 O-C-N 121.494 -0.754 . . . . 0.0 109.573 170.617 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 5.3 ttpm? -109.84 142.15 41.52 Favored 'General case' 0 N--CA 1.494 1.731 0 O-C-N 121.647 -0.658 . . . . 0.0 110.523 -177.114 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -152.99 160.27 43.0 Favored 'General case' 0 N--CA 1.496 1.828 0 O-C-N 121.773 -0.579 . . . . 0.0 110.09 179.562 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . 0.421 ' HA ' ' HA ' ' A' ' 12' ' ' GLU . 30.9 ptt180 -140.28 148.57 41.63 Favored 'General case' 0 N--CA 1.497 1.916 0 O-C-N 121.622 -0.674 . . . . 0.0 110.8 -178.844 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -171.71 171.44 44.08 Favored Glycine 0 N--CA 1.495 2.617 0 N-CA-C 108.701 -1.759 . . . . 0.0 108.701 -176.332 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 39.0 t -94.6 118.84 41.6 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.925 0 O-C-N 121.462 -1.022 . . . . 0.0 109.314 -175.913 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 95.3 mt -63.95 143.41 15.7 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.142 0 O-C-N 121.665 -0.647 . . . . 0.0 110.333 -172.073 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 7.5 p -121.25 -27.01 4.95 Favored 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.721 -0.612 . . . . 0.0 111.336 -179.887 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 27.2 t30 -162.03 160.67 27.84 Favored 'General case' 0 N--CA 1.499 1.991 0 C-N-CA 119.002 -1.079 . . . . 0.0 111.814 -179.109 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 83.3 t80 -150.19 126.73 10.86 Favored 'General case' 0 N--CA 1.497 1.901 0 N-CA-C 108.964 -0.754 . . . . 0.0 108.964 170.599 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 21.3 t70 -99.73 130.51 45.95 Favored 'General case' 0 N--CA 1.491 1.597 0 N-CA-C 108.955 -0.757 . . . . 0.0 108.955 -177.431 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 20.1 m -70.31 -51.68 28.4 Favored 'General case' 0 N--CA 1.498 1.946 0 C-N-CA 119.999 -0.681 . . . . 0.0 110.394 -176.9 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 23.1 m -60.07 -41.25 92.02 Favored 'General case' 0 N--CA 1.502 2.17 0 O-C-N 121.619 -0.676 . . . . 0.0 110.829 -174.967 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 29.8 m120 -103.91 -10.14 18.4 Favored 'General case' 0 N--CA 1.496 1.87 0 O-C-N 121.624 -0.673 . . . . 0.0 111.613 -177.662 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 1.8 m 49.91 67.34 0.92 Allowed 'General case' 0 N--CA 1.509 2.51 0 O-C-N 121.098 -1.001 . . . . 0.0 111.07 -175.776 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 47.4 mm -126.69 127.03 69.76 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.167 0 O-C-N 121.597 -0.689 . . . . 0.0 109.479 -176.066 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 11.7 tp -115.88 121.61 42.87 Favored 'General case' 0 N--CA 1.494 1.765 0 O-C-N 121.708 -0.62 . . . . 0.0 110.521 -170.432 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 79.5 mt-30 -91.61 134.19 34.9 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.829 -0.544 . . . . 0.0 109.539 173.83 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 13.9 mt -117.82 123.81 46.83 Favored 'General case' 0 N--CA 1.493 1.725 0 O-C-N 121.798 -0.564 . . . . 0.0 109.989 174.52 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 56.6 ttt85 -98.42 107.69 20.2 Favored 'General case' 0 N--CA 1.497 1.878 0 O-C-N 121.63 -0.669 . . . . 0.0 109.756 175.986 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 18.9 tp -85.1 150.75 24.63 Favored 'General case' 0 N--CA 1.495 1.797 0 O-C-N 121.697 -0.627 . . . . 0.0 110.993 -173.933 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -63.15 -9.17 9.83 Favored 'General case' 0 N--CA 1.503 2.184 0 O-C-N 121.922 -0.486 . . . . 0.0 111.962 -173.223 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 37.7 t30 -85.01 29.08 0.66 Allowed 'General case' 0 N--CA 1.499 2.018 0 O-C-N 121.146 -0.971 . . . . 0.0 110.952 174.202 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 74.4 m-20 59.67 31.81 21.1 Favored 'General case' 0 N--CA 1.504 2.27 0 O-C-N 121.257 -0.902 . . . . 0.0 110.428 174.176 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 48.9 m -123.92 137.78 54.58 Favored 'General case' 0 N--CA 1.496 1.859 0 O-C-N 121.394 -0.816 . . . . 0.0 110.374 178.836 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 9.0 t -97.55 150.21 21.35 Favored 'General case' 0 N--CA 1.497 1.906 0 O-C-N 121.735 -0.603 . . . . 0.0 110.212 176.244 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 42.1 tttp -149.81 119.16 6.85 Favored 'General case' 0 N--CA 1.496 1.861 0 O-C-N 121.662 -0.649 . . . . 0.0 110.255 178.466 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 90.3 p -96.07 122.63 39.12 Favored 'General case' 0 N--CA 1.495 1.807 0 O-C-N 121.676 -0.64 . . . . 0.0 110.21 178.431 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 82.5 mt -129.27 135.68 61.24 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.845 0 O-C-N 121.565 -0.709 . . . . 0.0 109.328 179.835 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 58.7 t -81.95 127.57 39.5 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.902 0 O-C-N 121.531 -0.731 . . . . 0.0 109.232 179.56 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 37.4 p -59.41 -24.81 63.78 Favored 'General case' 0 N--CA 1.504 2.273 0 O-C-N 121.659 -0.651 . . . . 0.0 112.055 -170.101 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 73.5 tttt -56.23 -22.78 31.62 Favored 'General case' 0 N--CA 1.503 2.183 0 O-C-N 121.401 -0.812 . . . . 0.0 111.1 -177.161 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 51.4 p30 -83.8 0.92 45.42 Favored 'General case' 0 N--CA 1.499 1.985 0 O-C-N 121.443 -0.786 . . . . 0.0 111.358 176.369 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 96.3 mt -75.99 127.76 37.36 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.089 0 O-C-N 121.162 -0.961 . . . . 0.0 110.084 178.72 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 75.0 tttt -91.76 -32.39 15.41 Favored 'General case' 0 N--CA 1.493 1.711 0 N-CA-C 109.443 -0.577 . . . . 0.0 109.443 169.901 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -161.47 157.29 24.79 Favored 'General case' 0 N--CA 1.497 1.898 0 O-C-N 121.723 -0.611 . . . . 0.0 109.815 -177.037 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 85.2 mt -132.92 148.55 52.28 Favored 'General case' 0 N--CA 1.497 1.904 0 O-C-N 121.65 -0.656 . . . . 0.0 110.462 -179.851 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 6.5 ptm180 -150.76 139.6 20.85 Favored 'General case' 0 N--CA 1.495 1.782 0 O-C-N 121.765 -0.584 . . . . 0.0 109.94 176.335 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 67.7 mt -84.98 133.26 29.73 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.872 0 O-C-N 121.522 -0.736 . . . . 0.0 109.671 174.079 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 45.1 mt -83.69 155.61 65.22 Favored Pre-proline 0 N--CA 1.498 1.952 0 O-C-N 121.566 -0.709 . . . . 0.0 110.255 -178.462 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 17.9 Cg_exo -62.56 157.94 44.01 Favored 'Trans proline' 0 N--CA 1.49 1.295 0 O-C-N 123.573 1.301 . . . . 0.0 110.627 178.618 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 65.6 tttt -79.83 139.03 37.34 Favored 'General case' 0 N--CA 1.497 1.917 0 O-C-N 121.758 -0.589 . . . . 0.0 110.036 179.483 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 24.2 p30 -129.08 172.8 11.04 Favored 'General case' 0 N--CA 1.497 1.912 0 O-C-N 121.714 -0.616 . . . . 0.0 110.283 179.977 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 46.7 mt-10 -120.7 99.4 6.51 Favored 'General case' 0 N--CA 1.496 1.871 0 O-C-N 121.707 -0.621 . . . . 0.0 110.27 -179.432 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 46.9 mm 58.14 164.98 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.509 2.495 0 CA-C-O 121.404 0.621 . . . . 0.0 110.783 179.272 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 64' ' ' MET . . . . . . . . . . . . . 45.7 mtm 52.19 60.4 13.43 Favored Pre-proline 0 N--CA 1.505 2.287 0 O-C-N 121.403 -0.811 . . . . 0.0 111.093 178.781 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 28.7 Cg_endo -67.6 -38.93 13.08 Favored 'Trans proline' 0 N--CA 1.488 1.167 0 O-C-N 123.502 1.264 . . . . 0.0 110.351 178.727 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 24.9 pttm -139.6 164.95 28.54 Favored 'General case' 0 N--CA 1.496 1.828 0 O-C-N 121.674 -0.641 . . . . 0.0 110.365 179.583 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 43.2 t-20 -64.17 -38.48 91.23 Favored 'General case' 0 N--CA 1.501 2.094 0 O-C-N 121.645 -0.66 . . . . 0.0 110.41 179.586 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 71.93 -75.63 0.74 Allowed Glycine 0 N--CA 1.493 2.477 0 N-CA-C 109.708 -1.357 . . . . 0.0 109.708 179.21 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 24.0 m -65.35 -35.47 81.08 Favored 'General case' 0 N--CA 1.5 2.042 0 O-C-N 121.697 -0.884 . . . . 0.0 110.458 -178.918 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 50.5 tttm 53.49 91.78 0.02 OUTLIER 'General case' 0 N--CA 1.505 2.315 0 O-C-N 121.632 -0.667 . . . . 0.0 110.847 -178.982 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 91.6 p -100.65 169.74 7.5 Favored Pre-proline 0 N--CA 1.495 1.782 0 O-C-N 121.655 -0.653 . . . . 0.0 110.288 -179.084 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 22.2 Cg_exo -61.27 153.59 64.25 Favored 'Trans proline' 0 N--CA 1.49 1.296 0 O-C-N 123.634 1.333 . . . . 0.0 110.743 -179.81 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 8.4 t 57.02 170.34 0.04 OUTLIER 'General case' 0 N--CA 1.506 2.328 0 O-C-N 121.658 -0.651 . . . . 0.0 111.056 -178.79 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 38.1 p -97.37 -30.81 12.72 Favored 'General case' 0 N--CA 1.495 1.796 0 O-C-N 121.614 -0.679 . . . . 0.0 110.531 -179.411 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 91.5 m-20 -101.17 123.13 44.83 Favored 'General case' 0 N--CA 1.495 1.801 0 O-C-N 121.598 -0.689 . . . . 0.0 110.357 -178.665 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 49.5 m -129.11 149.03 51.09 Favored 'General case' 0 N--CA 1.495 1.786 0 O-C-N 121.722 -0.611 . . . . 0.0 110.13 178.875 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 9.9 t -138.02 156.91 47.33 Favored 'General case' 0 N--CA 1.497 1.875 0 O-C-N 121.7 -0.625 . . . . 0.0 110.514 -179.767 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 56.3 mttm 53.44 37.03 24.65 Favored 'General case' 0 N--CA 1.505 2.304 0 O-C-N 121.562 -0.711 . . . . 0.0 110.997 178.406 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 83.9 mt -68.57 -43.55 76.33 Favored 'General case' 0 N--CA 1.499 1.995 0 O-C-N 121.54 -0.725 . . . . 0.0 110.238 179.145 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 75.0 mttt 52.31 32.29 10.73 Favored 'General case' 0 N--CA 1.506 2.354 0 O-C-N 121.62 -0.675 . . . . 0.0 111.0 179.712 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 90.2 p -68.17 -33.14 73.9 Favored 'General case' 0 N--CA 1.498 1.941 0 O-C-N 121.691 -0.63 . . . . 0.0 110.324 -179.226 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -112.28 146.4 38.27 Favored 'General case' 0 N--CA 1.494 1.749 0 O-C-N 121.619 -0.675 . . . . 0.0 110.271 -179.832 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 78.7 mt-10 -112.82 99.05 7.6 Favored 'General case' 0 N--CA 1.496 1.836 0 O-C-N 121.69 -0.631 . . . . 0.0 110.144 179.306 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 10.2 t -141.65 155.4 45.7 Favored 'General case' 0 N--CA 1.496 1.85 0 O-C-N 121.654 -0.654 . . . . 0.0 110.341 179.703 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 49.2 p90 -147.3 161.51 40.83 Favored 'General case' 0 N--CA 1.494 1.748 0 O-C-N 121.69 -0.631 . . . . 0.0 110.321 179.34 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 32.7 t -142.47 135.96 28.95 Favored 'General case' 0 N--CA 1.495 1.777 0 O-C-N 121.741 -0.6 . . . . 0.0 110.138 179.286 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 86.3 p -118.8 27.94 8.59 Favored 'General case' 0 N--CA 1.497 1.887 0 O-C-N 121.624 -0.673 . . . . 0.0 110.614 179.505 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 98.3 mttt -95.25 -68.89 0.78 Allowed 'General case' 0 N--CA 1.496 1.848 0 O-C-N 121.541 -0.724 . . . . 0.0 110.197 -179.727 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 91.6 m-20 -124.95 115.69 20.99 Favored 'General case' 0 N--CA 1.495 1.809 0 O-C-N 121.604 -0.685 . . . . 0.0 110.185 179.525 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 51.4 tttm -66.12 -41.64 90.25 Favored 'General case' 0 N--CA 1.5 2.032 0 O-C-N 121.62 -0.675 . . . . 0.0 110.285 179.615 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 91' ' ' TRP . . . . . . . . . . . . . 64.9 p-90 -145.16 158.73 43.74 Favored 'General case' 0 N--CA 1.497 1.88 0 O-C-N 121.689 -0.632 . . . . 0.0 110.301 -179.929 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 26.2 t -147.98 147.74 29.97 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.596 -0.69 . . . . 0.0 110.228 179.807 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 93' ' ' MET . . . . . . . . . . . . . 22.8 ptm -152.02 33.61 0.53 Allowed 'General case' 0 N--CA 1.496 1.828 0 O-C-N 121.657 -0.652 . . . . 0.0 110.357 179.559 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 . . . . . 0 N--CA 1.494 1.762 0 CA-C-O 117.988 -1.006 . . . . 0.0 110.202 179.979 . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' B' B ' 240' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.313 0 N-CA-C 109.531 -1.427 . . . . 0.0 109.531 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' B' B ' 241' ' ' ALA . . . . . . . . . . . . . . . -67.14 -33.19 74.9 Favored 'General case' 0 N--CA 1.499 2.015 0 O-C-N 121.607 -0.937 . . . . 0.0 110.35 179.969 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 242' ' ' THR . . . . . . . . . . . . . 9.7 t -133.08 161.3 34.76 Favored 'General case' 0 N--CA 1.497 1.884 0 O-C-N 121.673 -0.642 . . . . 0.0 110.349 -179.932 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 243' ' ' THR . . . . . . . . . . . . . 21.7 m -93.29 135.38 34.56 Favored 'General case' 0 N--CA 1.495 1.779 0 O-C-N 121.626 -0.671 . . . . 0.0 110.18 -179.832 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 244' ' ' LYS . . . . . . . . . . . . . 35.8 tttp -101.26 33.14 2.99 Favored 'General case' 0 N--CA 1.494 1.763 0 O-C-N 121.66 -0.65 . . . . 0.0 110.26 -179.043 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 245' ' ' GLU . . . . . . . . . . . . . 78.4 mt-10 53.37 100.01 0.01 OUTLIER 'General case' 0 N--CA 1.507 2.393 0 O-C-N 121.688 -0.632 . . . . 0.0 111.16 -179.224 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 246' ' ' LYS . . . . . . . . . . . . . 40.6 tttp -60.19 -32.86 71.48 Favored 'General case' 0 N--CA 1.502 2.157 0 O-C-N 121.56 -0.713 . . . . 0.0 110.496 -179.171 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 247' ' ' ASN . . . . . . . . . . . . . 91.1 m-20 -96.33 137.01 36.03 Favored 'General case' 0 N--CA 1.495 1.81 0 O-C-N 121.708 -0.62 . . . . 0.0 110.06 178.659 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 248' ' ' ILE . . . . . . . . . . . . . 74.2 mt 57.84 164.09 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.509 2.505 0 O-C-N 121.715 -0.616 . . . . 0.0 110.617 -178.349 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 249' ' ' SER . . . . . . . . . . . . . 87.9 p -116.01 157.02 25.28 Favored 'General case' 0 N--CA 1.495 1.819 0 O-C-N 121.426 -0.796 . . . . 0.0 110.335 -179.793 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 250' ' ' VAL . . . . . . . . . . . . . 59.2 t -89.26 137.94 20.26 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.948 0 O-C-N 121.728 -0.607 . . . . 0.0 109.647 179.857 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 251' ' ' ASP . . . . . . . . . . . . . 16.6 t70 -161.81 166.76 25.96 Favored 'General case' 0 N--CA 1.495 1.793 0 O-C-N 121.746 -0.597 . . . . 0.0 110.216 -179.393 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 252' ' ' VAL . . . . . . . . . . . . . 11.9 p -162.1 -40.35 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.498 1.964 0 O-C-N 121.769 -0.582 . . . . 0.0 110.426 -179.897 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 253' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 52.5 95.78 0.02 OUTLIER 'General case' 0 N--CA 1.505 2.324 0 O-C-N 121.507 -0.745 . . . . 0.0 111.194 179.304 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 254' ' ' ALA . . . . . . . . . . . . . . . -65.95 -31.05 71.74 Favored 'General case' 0 N--CA 1.5 2.07 0 O-C-N 121.686 -0.634 . . . . 0.0 110.403 179.469 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 255' ' ' ASP . . . . . . . . . . . . . 74.4 m-20 -72.55 -29.74 63.83 Favored 'General case' 0 N--CA 1.499 1.989 0 O-C-N 121.653 -0.654 . . . . 0.0 110.254 178.453 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 256' ' ' ALA . . . . . . . . . . . . . . . -63.13 -31.02 72.06 Favored 'General case' 0 N--CA 1.5 2.049 0 O-C-N 121.462 -0.774 . . . . 0.0 110.333 177.935 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 257' ' ' SER . . . . . . . . . . . . . 6.6 t -54.91 -34.93 63.61 Favored 'General case' 0 N--CA 1.503 2.198 0 O-C-N 121.558 -0.714 . . . . 0.0 110.421 176.884 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 258' ' ' SER . . . . . . . . . . . . . 24.8 m -68.09 -32.53 72.91 Favored 'General case' 0 N--CA 1.497 1.908 0 O-C-N 121.864 -0.522 . . . . 0.0 110.239 179.983 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 259' ' ' GLN . . . . . . . . . . . . . 78.1 mt-30 -64.64 -35.03 79.71 Favored 'General case' 0 N--CA 1.5 2.028 0 O-C-N 121.593 -0.692 . . . . 0.0 110.367 179.782 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 260' ' ' LEU . . . . . . . . . . . . . 51.4 mt -65.52 -43.4 90.17 Favored 'General case' 0 N--CA 1.501 2.082 0 O-C-N 121.67 -0.644 . . . . 0.0 110.281 179.045 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 261' ' ' LEU . . . . . . . . . . . . . 21.5 tp -71.05 -36.94 72.5 Favored 'General case' 0 N--CA 1.498 1.932 0 C-N-CA 120.088 -0.645 . . . . 0.0 109.586 174.97 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 262' ' ' SER . . . . . . . . . . . . . 22.6 t -62.25 -35.69 79.73 Favored 'General case' 0 N--CA 1.501 2.09 0 O-C-N 121.714 -0.616 . . . . 0.0 110.438 175.893 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 263' ' ' LEU . . . . . . . . . . . . . 16.2 mt -64.43 -41.46 96.58 Favored 'General case' 0 N--CA 1.5 2.068 0 O-C-N 121.683 -0.635 . . . . 0.0 110.242 179.433 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 264' ' ' LEU . . . . . . . . . . . . . 87.9 mt -62.14 -35.63 79.35 Favored 'General case' 0 N--CA 1.502 2.171 0 O-C-N 121.695 -0.628 . . . . 0.0 110.291 176.563 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 265' ' ' LYS . . . . . . . . . . . . . 57.4 tttm -75.21 -32.23 61.12 Favored 'General case' 0 N--CA 1.498 1.967 0 O-C-N 121.818 -0.551 . . . . 0.0 110.085 178.009 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 266' ' ' SER . . . . . . . . . . . . . 29.1 t -162.62 118.56 1.89 Allowed 'General case' 0 N--CA 1.496 1.843 0 O-C-N 121.679 -0.638 . . . . 0.0 109.956 178.993 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 267' ' ' SER . . . . . . . . . . . . . 24.2 m -67.07 -33.9 76.5 Favored 'General case' 0 N--CA 1.5 2.03 0 O-C-N 121.719 -0.613 . . . . 0.0 110.514 -178.286 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 268' ' ' THR . . . . . . . . . . . . . 21.8 m -65.18 -51.59 60.12 Favored 'General case' 0 N--CA 1.5 2.069 0 O-C-N 121.636 -0.665 . . . . 0.0 110.464 -177.231 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 269' ' ' ALA . . . . . . . . . . . . . . . 46.32 55.75 15.88 Favored Pre-proline 0 N--CA 1.506 2.339 0 O-C-N 121.749 -0.594 . . . . 0.0 111.325 -178.072 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 270' ' ' PRO . . . . . . . . . . . . . 28.0 Cg_endo -67.12 -45.21 4.12 Favored 'Trans proline' 0 N--CA 1.489 1.207 0 O-C-N 123.479 1.252 . . . . 0.0 110.533 -177.758 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 271' ' ' SER . . . . . . . . . . . . . 87.4 p -154.77 174.57 14.86 Favored 'General case' 0 N--CA 1.494 1.772 0 O-C-N 121.687 -0.633 . . . . 0.0 110.325 -178.975 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 272' ' ' ASP . . . . . . . . . . . . . 20.6 t70 -78.05 129.24 35.0 Favored 'General case' 0 N--CA 1.498 1.949 0 O-C-N 121.738 -0.601 . . . . 0.0 109.962 179.678 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 273' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER 52.63 80.64 0.09 Allowed 'General case' 0 N--CA 1.506 2.369 0 O-C-N 121.631 -0.668 . . . . 0.0 110.865 -178.654 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 274' ' ' ALA . . . . . . . . . . . . . . . -166.4 154.0 9.9 Favored 'General case' 0 N--CA 1.497 1.909 0 O-C-N 121.528 -0.733 . . . . 0.0 110.011 179.76 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 275' ' ' THR . . . . . . . . . . . . . 7.7 t -68.29 149.12 98.19 Favored Pre-proline 0 N--CA 1.5 2.067 0 C-N-CA 120.251 -0.58 . . . . 0.0 110.232 -179.863 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 276' ' ' PRO . . . . . . . . . . . . . 29.3 Cg_endo -67.51 145.15 69.7 Favored 'Trans proline' 0 N--CA 1.489 1.243 0 O-C-N 123.495 1.26 . . . . 0.0 110.358 179.239 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 277' ' ' GLN . . . . . . . . . . . . . 39.9 mt-30 -127.55 66.1 68.71 Favored Pre-proline 0 N--CA 1.495 1.791 0 O-C-N 121.646 -0.659 . . . . 0.0 110.177 -179.848 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 278' ' ' PRO . . . . . . . . . . . . . 29.9 Cg_endo -67.77 -31.08 32.95 Favored 'Trans proline' 0 N--CA 1.489 1.208 0 O-C-N 123.414 1.218 . . . . 0.0 110.611 179.211 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 279' ' ' SER . . . . . . . . . . . . . 22.8 t -63.56 -35.02 79.1 Favored 'General case' 0 N--CA 1.502 2.135 0 O-C-N 121.598 -0.689 . . . . 0.0 110.631 -178.431 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 280' ' ' THR . . . . . . . . . . . . . 37.8 p -105.17 29.07 6.69 Favored 'General case' 0 N--CA 1.497 1.886 0 O-C-N 121.685 -0.634 . . . . 0.0 110.608 -179.623 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 281' ' ' PHE . . . . . . . . . . . . . 85.1 t80 -131.96 73.11 78.78 Favored Pre-proline 0 N--CA 1.494 1.74 0 O-C-N 121.511 -0.743 . . . . 0.0 110.113 179.485 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 282' ' ' PRO . . . . . . . . . . . . . 29.6 Cg_endo -67.8 124.26 11.68 Favored 'Trans proline' 0 N--CA 1.488 1.168 0 O-C-N 123.49 1.258 . . . . 0.0 110.354 -179.819 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 283' ' ' GLN . . . . . . . . . . . . . 7.9 mt-30 -76.42 -56.27 1.53 Allowed Pre-proline 0 N--CA 1.498 1.927 0 O-C-N 121.661 -0.65 . . . . 0.0 110.634 179.532 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 284' ' ' PRO . . . . . . . . . . . . . 41.4 Cg_endo -73.2 154.8 51.96 Favored 'Trans proline' 0 N--CA 1.487 1.115 0 O-C-N 123.338 1.178 . . . . 0.0 110.401 -178.541 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 285' ' ' PRO . . . . . . . . . . . . . 29.7 Cg_endo -67.97 154.33 73.03 Favored 'Trans proline' 0 N--CA 1.488 1.183 0 O-C-N 123.7 1.368 . . . . 0.0 110.356 179.314 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 286' ' ' VAL . . . . . . . . . . . . . 26.8 m -126.64 157.14 37.7 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.981 0 O-C-N 121.648 -0.658 . . . . 0.0 110.212 179.657 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 287' ' ' GLU . . . . . . . . . . . . . 46.0 tt0 -99.95 137.45 38.39 Favored 'General case' 0 N--CA 1.495 1.808 0 O-C-N 121.68 -0.637 . . . . 0.0 110.171 -179.438 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 288' ' ' SER . . . . . . . . . . . . . 28.6 t -127.33 144.71 51.0 Favored 'General case' 0 N--CA 1.495 1.81 0 O-C-N 121.672 -0.643 . . . . 0.0 110.166 179.701 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 289' ' ' HIS . . . . . . . . . . . . . 83.7 t60 -117.2 129.15 55.75 Favored 'General case' 0 N--CA 1.496 1.845 0 O-C-N 121.637 -0.664 . . . . 0.0 110.153 -179.99 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 290' ' ' SER . . . . . . . . . . . . . 29.8 t -122.6 143.25 49.87 Favored 'General case' 0 N--CA 1.495 1.793 0 O-C-N 121.617 -0.677 . . . . 0.0 110.213 -179.93 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 291' ' ' SER . . . . . . . . . . . . . 10.3 t . . . . . 0 N--CA 1.494 1.767 0 CA-C-O 117.995 -1.002 . . . . 0.0 110.223 179.977 . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' -1' ' ' MET . . . . . . . . . . . . . 23.1 ptt? . . . . . 0 N--CA 1.496 1.84 0 CA-C-O 121.029 0.442 . . . . 0.0 110.232 . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 0' ' ' GLY . . . . . . . . . . . . . . . 170.15 -175.46 44.14 Favored Glycine 0 N--CA 1.494 2.538 0 N-CA-C 109.472 -1.451 . . . . 0.0 109.472 179.955 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 74.9 mtm -124.66 156.61 37.25 Favored 'General case' 0 N--CA 1.495 1.788 0 O-C-N 121.701 -0.882 . . . . 0.0 110.227 179.708 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 66.2 m -100.99 172.33 7.09 Favored 'General case' 0 N--CA 1.495 1.786 0 O-C-N 121.771 -0.581 . . . . 0.0 110.181 -179.812 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 69.5 t -66.46 -27.82 41.51 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.048 0 O-C-N 121.652 -0.655 . . . . 0.0 110.254 -179.265 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -55.17 -31.27 61.23 Favored 'General case' 0 N--CA 1.504 2.273 0 O-C-N 121.499 -0.751 . . . . 0.0 110.42 -178.891 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 74.5 m-20 -68.63 -31.33 70.4 Favored 'General case' 0 N--CA 1.499 1.99 0 O-C-N 121.883 -0.511 . . . . 0.0 110.131 174.714 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 87.4 m-85 -95.59 10.05 38.07 Favored 'General case' 0 N--CA 1.497 1.887 0 O-C-N 121.641 -0.662 . . . . 0.0 111.398 -179.573 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 3.1 m-30 -67.24 144.05 56.16 Favored 'General case' 0 N--CA 1.502 2.128 0 O-C-N 121.154 -0.966 . . . . 0.0 110.042 175.52 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 82.06 0.71 89.88 Favored Glycine 0 N--CA 1.497 2.717 0 N-CA-C 110.483 -1.047 . . . . 0.0 110.483 -175.766 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 89.2 p -77.75 141.04 39.52 Favored 'General case' 0 N--CA 1.497 1.889 0 O-C-N 121.079 -1.248 . . . . 0.0 110.514 -178.851 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 2.6 m120 -85.08 120.2 26.32 Favored 'General case' 0 N--CA 1.497 1.92 0 O-C-N 121.665 -0.647 . . . . 0.0 109.495 173.532 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 35.5 m -143.5 162.93 16.21 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.78 0 O-C-N 121.715 -0.616 . . . . 0.0 109.566 -178.838 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 33.3 tt0 -109.4 127.87 54.7 Favored 'General case' 0 N--CA 1.494 1.729 0 C-N-CA 119.896 -0.722 . . . . 0.0 109.952 177.539 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 60.5 t -106.92 124.1 62.4 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.863 0 O-C-N 121.673 -0.642 . . . . 0.0 109.808 -179.67 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 15.4 tp -96.03 125.96 40.94 Favored 'General case' 0 N--CA 1.494 1.749 0 O-C-N 121.761 -0.587 . . . . 0.0 109.47 175.144 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 83.1 mt -97.44 163.17 12.99 Favored 'General case' 0 N--CA 1.498 1.937 0 O-C-N 121.553 -0.717 . . . . 0.0 111.054 -172.594 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 24.9 p30 -59.21 -21.64 59.81 Favored 'General case' 0 N--CA 1.505 2.294 0 O-C-N 121.722 -0.611 . . . . 0.0 111.489 -177.961 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 25.5 p30 -92.19 23.52 3.79 Favored 'General case' 0 N--CA 1.498 1.959 0 O-C-N 121.532 -0.73 . . . . 0.0 110.977 -176.571 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 74.4 m-20 60.18 28.63 18.22 Favored 'General case' 0 N--CA 1.504 2.265 0 O-C-N 121.414 -0.804 . . . . 0.0 110.836 173.07 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 43.2 m -107.99 134.94 50.18 Favored 'General case' 0 N--CA 1.495 1.793 0 O-C-N 121.491 -0.755 . . . . 0.0 109.567 170.395 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 37.4 ttmt -109.64 137.73 47.04 Favored 'General case' 0 N--CA 1.494 1.761 0 O-C-N 121.756 -0.59 . . . . 0.0 110.345 -176.137 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -153.05 158.86 42.58 Favored 'General case' 0 N--CA 1.496 1.836 0 O-C-N 121.686 -0.634 . . . . 0.0 110.498 -179.782 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 42.9 ptt85 -144.02 150.88 38.92 Favored 'General case' 0 N--CA 1.496 1.836 0 O-C-N 121.683 -0.635 . . . . 0.0 110.5 178.838 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -171.64 171.42 44.06 Favored Glycine 0 N--CA 1.494 2.535 0 N-CA-C 108.872 -1.691 . . . . 0.0 108.872 -174.493 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 38.5 t -94.49 117.17 37.58 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.933 0 O-C-N 121.522 -0.987 . . . . 0.0 109.402 -176.519 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 92.0 mt -63.93 143.16 15.94 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.154 0 O-C-N 121.642 -0.661 . . . . 0.0 110.397 -172.157 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 7.8 p -121.21 -26.76 5.01 Favored 'General case' 0 N--CA 1.495 1.785 0 O-C-N 121.685 -0.634 . . . . 0.0 111.245 -179.669 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 7.6 t30 -161.94 156.9 23.01 Favored 'General case' 0 N--CA 1.5 2.051 0 C-N-CA 118.88 -1.128 . . . . 0.0 111.726 -178.17 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 28' ' ' PHE . . . . . 0.4 ' HA ' ' O ' ' A' ' 34' ' ' ILE . 62.8 t80 -150.07 123.56 9.07 Favored 'General case' 0 N--CA 1.498 1.949 0 N-CA-C 109.373 -0.602 . . . . 0.0 109.373 170.433 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 17.8 t70 -99.3 127.06 45.26 Favored 'General case' 0 N--CA 1.492 1.638 0 N-CA-C 109.162 -0.681 . . . . 0.0 109.162 -178.541 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 22.6 t -64.68 -43.53 93.23 Favored 'General case' 0 N--CA 1.5 2.044 0 O-C-N 121.72 -0.612 . . . . 0.0 110.907 -174.709 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 21.1 m -59.7 -48.09 83.06 Favored 'General case' 0 N--CA 1.502 2.166 0 O-C-N 121.539 -0.726 . . . . 0.0 110.984 -173.444 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 91.5 m-20 -106.99 -0.31 23.15 Favored 'General case' 0 N--CA 1.498 1.966 0 O-C-N 121.613 -0.679 . . . . 0.0 111.675 -179.364 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 45.2 p 45.26 67.02 0.78 Allowed 'General case' 0 N--CA 1.507 2.391 0 O-C-N 121.494 -0.754 . . . . 0.0 111.212 -174.986 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 34' ' ' ILE . . . . . 0.4 ' O ' ' HA ' ' A' ' 28' ' ' PHE . 41.3 mm -114.48 125.86 71.88 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.963 0 O-C-N 121.629 -0.669 . . . . 0.0 109.213 -176.047 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 10.2 tp -115.75 118.84 34.16 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.604 -0.685 . . . . 0.0 110.416 -169.554 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 99.3 mt-30 -91.38 133.13 35.72 Favored 'General case' 0 N--CA 1.49 1.528 0 N-CA-C 109.381 -0.6 . . . . 0.0 109.381 173.731 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 14.6 mt -117.88 123.8 46.76 Favored 'General case' 0 N--CA 1.494 1.753 0 O-C-N 121.837 -0.539 . . . . 0.0 109.945 175.107 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 72.5 ttt180 -97.36 105.01 17.08 Favored 'General case' 0 N--CA 1.495 1.813 0 O-C-N 121.672 -0.643 . . . . 0.0 109.783 176.001 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 22.0 tp -85.16 154.3 22.1 Favored 'General case' 0 N--CA 1.494 1.765 0 O-C-N 121.716 -0.615 . . . . 0.0 111.075 -173.624 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -65.54 -6.48 10.94 Favored 'General case' 0 N--CA 1.503 2.179 0 O-C-N 121.955 -0.466 . . . . 0.0 112.149 -169.961 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 49.4 p-10 -86.17 29.15 0.76 Allowed 'General case' 0 N--CA 1.5 2.064 0 O-C-N 121.12 -0.987 . . . . 0.0 110.873 174.199 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 74.3 m-20 57.65 29.68 17.66 Favored 'General case' 0 N--CA 1.504 2.24 0 O-C-N 121.252 -0.905 . . . . 0.0 110.36 177.126 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 37.8 m -120.62 137.87 54.2 Favored 'General case' 0 N--CA 1.496 1.852 0 O-C-N 121.458 -0.776 . . . . 0.0 110.397 178.996 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 9.7 t -97.47 150.99 20.45 Favored 'General case' 0 N--CA 1.497 1.878 0 O-C-N 121.76 -0.588 . . . . 0.0 110.222 176.46 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 40.9 tttp -148.61 119.14 7.42 Favored 'General case' 0 N--CA 1.497 1.886 0 O-C-N 121.591 -0.693 . . . . 0.0 110.269 178.05 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 91.0 p -96.59 122.12 39.16 Favored 'General case' 0 N--CA 1.494 1.736 0 O-C-N 121.635 -0.666 . . . . 0.0 110.284 179.027 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 82.8 mt -129.32 133.94 64.65 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.909 0 O-C-N 121.628 -0.67 . . . . 0.0 109.422 178.974 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 60.3 t -82.0 127.9 39.2 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.959 0 C-N-CA 120.103 -0.639 . . . . 0.0 109.404 179.41 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 37.5 p -57.86 -24.83 59.35 Favored 'General case' 0 N--CA 1.505 2.3 0 O-C-N 121.734 -0.604 . . . . 0.0 112.281 -165.869 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 16.6 pttp -56.14 -22.47 28.74 Favored 'General case' 0 N--CA 1.506 2.337 0 O-C-N 121.515 -0.741 . . . . 0.0 111.238 -176.016 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 10.3 p30 -82.01 -1.06 47.0 Favored 'General case' 0 N--CA 1.5 2.046 0 C-N-CA 119.889 -0.724 . . . . 0.0 111.194 176.398 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 89.6 mt -77.37 130.24 36.48 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.082 0 O-C-N 121.223 -0.923 . . . . 0.0 110.129 177.812 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 40.4 tttp -91.53 -31.73 15.83 Favored 'General case' 0 N--CA 1.494 1.766 0 O-C-N 121.772 -0.58 . . . . 0.0 109.496 168.778 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 5.3 m-20 -164.27 159.64 20.19 Favored 'General case' 0 N--CA 1.5 2.052 0 O-C-N 121.832 -0.542 . . . . 0.0 110.063 -177.869 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 83.1 mt -132.99 150.21 52.18 Favored 'General case' 0 N--CA 1.495 1.802 0 O-C-N 121.752 -0.592 . . . . 0.0 110.395 -179.44 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 19.9 ptp180 -150.39 141.39 22.96 Favored 'General case' 0 N--CA 1.495 1.803 0 O-C-N 121.7 -0.625 . . . . 0.0 109.998 175.336 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 67.0 mt -85.15 133.21 29.89 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.822 0 O-C-N 121.541 -0.724 . . . . 0.0 109.884 173.702 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 25.2 mt -82.11 159.44 65.27 Favored Pre-proline 0 N--CA 1.497 1.901 0 O-C-N 121.652 -0.655 . . . . 0.0 110.095 -179.337 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 22.1 Cg_endo -65.33 149.33 88.44 Favored 'Trans proline' 0 N--CA 1.49 1.286 0 O-C-N 123.736 1.387 . . . . 0.0 110.583 -177.685 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 39.1 tttp -126.4 138.46 53.55 Favored 'General case' 0 N--CA 1.496 1.853 0 O-C-N 121.729 -0.607 . . . . 0.0 110.089 179.724 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 30.4 m120 53.38 -179.22 0.02 OUTLIER 'General case' 0 N--CA 1.506 2.326 0 O-C-N 121.607 -0.683 . . . . 0.0 111.099 -179.85 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 27.8 tp10 -126.78 142.44 51.54 Favored 'General case' 0 N--CA 1.495 1.797 0 O-C-N 121.607 -0.683 . . . . 0.0 110.22 -179.748 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 50.8 mm -68.89 -38.71 79.0 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.055 0 O-C-N 121.626 -0.671 . . . . 0.0 109.816 -179.569 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 64' ' ' MET . . . . . . . . . . . . . 41.3 mtm 55.52 173.01 0.04 OUTLIER Pre-proline 0 N--CA 1.507 2.422 0 O-C-N 121.704 -0.623 . . . . 0.0 111.203 -179.67 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 17.5 Cg_exo -63.72 156.37 57.95 Favored 'Trans proline' 0 N--CA 1.491 1.339 0 O-C-N 123.474 1.249 . . . . 0.0 110.485 179.234 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 74.4 mttt -88.53 134.03 33.98 Favored 'General case' 0 N--CA 1.497 1.918 0 O-C-N 121.721 -0.612 . . . . 0.0 110.08 -179.904 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 91.7 m-20 -132.95 161.19 34.95 Favored 'General case' 0 N--CA 1.496 1.831 0 O-C-N 121.713 -0.617 . . . . 0.0 110.184 -179.742 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . -96.05 53.11 1.63 Allowed Glycine 0 N--CA 1.495 2.598 0 N-CA-C 109.493 -1.443 . . . . 0.0 109.493 179.588 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 5.3 t -115.06 84.66 2.12 Favored 'General case' 0 N--CA 1.499 2.024 0 O-C-N 121.684 -0.892 . . . . 0.0 110.345 -179.364 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 55.0 mttm -93.53 154.57 17.81 Favored 'General case' 0 N--CA 1.496 1.86 0 O-C-N 121.63 -0.669 . . . . 0.0 110.17 -179.983 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 4.1 m -68.81 166.49 26.8 Favored Pre-proline 0 N--CA 1.498 1.958 0 O-C-N 121.665 -0.647 . . . . 0.0 110.23 -179.851 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 23.4 Cg_exo -60.63 -31.37 92.09 Favored 'Trans proline' 0 N--CA 1.491 1.364 0 O-C-N 123.662 1.348 . . . . 0.0 110.729 -179.386 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 29.8 t -123.42 134.15 53.99 Favored 'General case' 0 N--CA 1.494 1.74 0 O-C-N 121.64 -0.663 . . . . 0.0 110.204 179.133 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 40.0 p -129.75 162.73 27.75 Favored 'General case' 0 N--CA 1.495 1.8 0 O-C-N 121.693 -0.63 . . . . 0.0 110.179 179.941 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 15.9 t-20 -64.55 -35.54 81.31 Favored 'General case' 0 N--CA 1.5 2.03 0 O-C-N 121.66 -0.65 . . . . 0.0 110.316 179.303 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 30.4 t -118.69 143.57 46.77 Favored 'General case' 0 N--CA 1.494 1.768 0 O-C-N 121.723 -0.611 . . . . 0.0 110.195 179.753 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 40.2 p -121.58 165.35 15.82 Favored 'General case' 0 N--CA 1.496 1.845 0 O-C-N 121.625 -0.672 . . . . 0.0 110.152 -179.915 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 51.2 mttp -63.47 -37.82 88.75 Favored 'General case' 0 N--CA 1.501 2.081 0 O-C-N 121.575 -0.703 . . . . 0.0 110.406 -179.757 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 7.8 tt -110.22 124.48 51.67 Favored 'General case' 0 N--CA 1.494 1.77 0 O-C-N 121.716 -0.615 . . . . 0.0 110.092 178.901 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 56.2 tttm -137.96 133.73 34.07 Favored 'General case' 0 N--CA 1.495 1.783 0 O-C-N 121.652 -0.655 . . . . 0.0 110.179 -179.778 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 98.5 p -121.56 151.47 40.3 Favored 'General case' 0 N--CA 1.496 1.829 0 O-C-N 121.72 -0.612 . . . . 0.0 110.204 179.229 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -151.04 155.78 39.73 Favored 'General case' 0 N--CA 1.494 1.769 0 O-C-N 121.68 -0.637 . . . . 0.0 110.286 -179.823 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 42.8 tt0 -103.63 145.06 30.6 Favored 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.763 -0.586 . . . . 0.0 110.057 179.561 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 23.7 m -107.15 141.79 37.87 Favored 'General case' 0 N--CA 1.495 1.803 0 O-C-N 121.665 -0.647 . . . . 0.0 110.295 -178.807 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 96.9 m-85 -117.14 154.73 30.55 Favored 'General case' 0 N--CA 1.496 1.85 0 O-C-N 121.677 -0.639 . . . . 0.0 110.128 179.876 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 49.6 m -112.19 143.02 43.94 Favored 'General case' 0 N--CA 1.495 1.799 0 O-C-N 121.693 -0.629 . . . . 0.0 110.081 179.469 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 81.6 p -103.89 -56.49 2.19 Favored 'General case' 0 N--CA 1.495 1.775 0 O-C-N 121.678 -0.639 . . . . 0.0 110.425 -178.761 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 73.1 mttt -114.67 135.39 54.2 Favored 'General case' 0 N--CA 1.496 1.838 0 O-C-N 121.642 -0.661 . . . . 0.0 110.331 -178.631 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 91.8 m-20 -135.44 31.06 3.17 Favored 'General case' 0 N--CA 1.496 1.866 0 O-C-N 121.667 -0.646 . . . . 0.0 110.327 178.595 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -110.24 32.38 5.19 Favored 'General case' 0 N--CA 1.495 1.821 0 O-C-N 121.613 -0.679 . . . . 0.0 110.286 -178.975 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 91' ' ' TRP . . . . . . . . . . . . . 97.1 m95 -87.98 -54.07 4.42 Favored 'General case' 0 N--CA 1.498 1.953 0 O-C-N 121.61 -0.681 . . . . 0.0 110.178 -179.701 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 28.7 t -135.42 142.11 45.57 Favored 'General case' 0 N--CA 1.495 1.789 0 O-C-N 121.611 -0.68 . . . . 0.0 110.246 -179.965 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 93' ' ' MET . . . . . . . . . . . . . 65.5 mtt -65.95 -34.86 79.07 Favored 'General case' 0 N--CA 1.5 2.057 0 O-C-N 121.628 -0.67 . . . . 0.0 110.289 179.558 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 17.2 t70 . . . . . 0 N--CA 1.495 1.782 0 CA-C-O 118.021 -0.99 . . . . 0.0 110.138 -179.976 . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' B' B ' 240' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.217 0 N-CA-C 109.585 -1.406 . . . . 0.0 109.585 . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' B' B ' 241' ' ' ALA . . . . . . . . . . . . . . . -67.49 -34.06 76.38 Favored 'General case' 0 N--CA 1.499 1.975 0 O-C-N 121.687 -0.89 . . . . 0.0 110.222 -179.874 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 242' ' ' THR . . . . . . . . . . . . . 24.5 m -66.6 -39.19 88.28 Favored 'General case' 0 N--CA 1.499 2.022 0 O-C-N 121.627 -0.671 . . . . 0.0 110.211 179.941 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 243' ' ' THR . . . . . . . . . . . . . 15.6 m 51.9 83.61 0.05 Allowed 'General case' 0 N--CA 1.506 2.326 0 O-C-N 121.63 -0.669 . . . . 0.0 111.027 -179.513 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 244' ' ' LYS . . . . . . . . . . . . . 67.9 tttt -66.31 -44.25 83.97 Favored 'General case' 0 N--CA 1.501 2.079 0 O-C-N 121.611 -0.681 . . . . 0.0 110.306 -179.976 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 245' ' ' GLU . . . . . . . . . . . . . 46.3 mt-10 -136.4 143.32 43.92 Favored 'General case' 0 N--CA 1.494 1.762 0 O-C-N 121.65 -0.656 . . . . 0.0 110.197 179.646 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 246' ' ' LYS . . . . . . . . . . . . . 33.6 tttp -107.67 30.14 6.57 Favored 'General case' 0 N--CA 1.497 1.884 0 O-C-N 121.744 -0.598 . . . . 0.0 110.322 179.203 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 247' ' ' ASN . . . . . . . . . . . . . 41.9 t-20 -131.83 126.62 34.76 Favored 'General case' 0 N--CA 1.495 1.822 0 O-C-N 121.635 -0.665 . . . . 0.0 110.161 -179.676 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 248' ' ' ILE . . . . . . . . . . . . . 10.4 tt -162.75 49.15 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.497 1.894 0 O-C-N 121.648 -0.658 . . . . 0.0 110.041 179.908 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 249' ' ' SER . . . . . . . . . . . . . 60.0 p -153.17 -61.02 0.14 Allowed 'General case' 0 N--CA 1.495 1.8 0 O-C-N 121.594 -0.691 . . . . 0.0 110.278 179.833 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 250' ' ' VAL . . . . . . . . . . . . . 61.9 t -90.17 133.67 31.4 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.946 0 O-C-N 121.595 -0.69 . . . . 0.0 109.824 -179.471 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 251' ' ' ASP . . . . . . . . . . . . . 74.4 m-20 -79.99 -32.23 39.78 Favored 'General case' 0 N--CA 1.499 2.024 0 O-C-N 121.716 -0.615 . . . . 0.0 110.305 179.467 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 252' ' ' VAL . . . . . . . . . . . . . 35.3 m -78.86 -165.88 0.07 OUTLIER 'Isoleucine or valine' 0 N--CA 1.501 2.107 0 O-C-N 121.67 -0.644 . . . . 0.0 110.091 179.948 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 253' ' ' ASP . . . . . . . . . . . . . 9.8 p-10 -160.54 75.14 0.55 Allowed 'General case' 0 N--CA 1.496 1.848 0 O-C-N 121.561 -0.712 . . . . 0.0 110.275 -179.704 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 254' ' ' ALA . . . . . . . . . . . . . . . -66.89 -24.61 66.13 Favored 'General case' 0 N--CA 1.501 2.118 0 O-C-N 121.626 -0.672 . . . . 0.0 110.774 179.465 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 255' ' ' ASP . . . . . . . . . . . . . 74.4 m-20 -70.94 -32.45 69.35 Favored 'General case' 0 N--CA 1.499 2.003 0 O-C-N 121.468 -0.77 . . . . 0.0 110.147 -177.975 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 256' ' ' ALA . . . . . . . . . . . . . . . -65.27 -49.96 67.57 Favored 'General case' 0 N--CA 1.501 2.089 0 O-C-N 121.649 -0.657 . . . . 0.0 110.173 177.58 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 257' ' ' SER . . . . . . . . . . . . . 44.9 t -57.18 -40.62 77.69 Favored 'General case' 0 N--CA 1.502 2.16 0 O-C-N 121.636 -0.665 . . . . 0.0 110.563 178.702 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 258' ' ' SER . . . . . . . . . . . . . 83.9 p -69.54 -30.76 68.66 Favored 'General case' 0 N--CA 1.498 1.945 0 C-N-CA 120.359 -0.536 . . . . 0.0 110.295 -178.724 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 259' ' ' GLN . . . . . . . . . . . . . 46.4 tt0 -63.25 -37.81 88.7 Favored 'General case' 0 N--CA 1.501 2.091 0 O-C-N 121.614 -0.679 . . . . 0.0 110.378 179.373 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 260' ' ' LEU . . . . . . . . . . . . . 83.3 mt -66.09 -42.45 89.28 Favored 'General case' 0 N--CA 1.5 2.041 0 O-C-N 121.67 -0.644 . . . . 0.0 110.249 179.627 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 261' ' ' LEU . . . . . . . . . . . . . 22.5 tp -70.32 -38.14 74.84 Favored 'General case' 0 N--CA 1.497 1.921 0 O-C-N 121.679 -0.638 . . . . 0.0 109.772 176.292 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 262' ' ' SER . . . . . . . . . . . . . 69.7 m -62.51 -35.87 80.75 Favored 'General case' 0 N--CA 1.501 2.097 0 O-C-N 121.767 -0.583 . . . . 0.0 110.533 176.916 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 263' ' ' LEU . . . . . . . . . . . . . 21.4 mt -64.59 -42.77 95.36 Favored 'General case' 0 N--CA 1.501 2.116 0 O-C-N 121.602 -0.686 . . . . 0.0 110.235 -179.822 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 264' ' ' LEU . . . . . . . . . . . . . 86.5 mt -62.48 -36.34 82.18 Favored 'General case' 0 N--CA 1.502 2.129 0 O-C-N 121.702 -0.623 . . . . 0.0 110.435 177.938 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 265' ' ' LYS . . . . . . . . . . . . . 28.1 mtpt -76.51 -26.68 55.52 Favored 'General case' 0 N--CA 1.498 1.937 0 O-C-N 121.799 -0.563 . . . . 0.0 110.539 179.068 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 266' ' ' SER . . . . . . . . . . . . . 32.6 m 52.32 32.46 11.05 Favored 'General case' 0 N--CA 1.506 2.333 0 O-C-N 121.485 -0.759 . . . . 0.0 110.986 -179.367 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 267' ' ' SER . . . . . . . . . . . . . 92.1 p -128.22 159.6 34.71 Favored 'General case' 0 N--CA 1.495 1.796 0 O-C-N 121.676 -0.64 . . . . 0.0 110.066 178.882 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 268' ' ' THR . . . . . . . . . . . . . 3.1 m 56.96 172.7 0.04 OUTLIER 'General case' 0 N--CA 1.508 2.464 0 O-C-N 121.557 -0.714 . . . . 0.0 110.645 -179.0 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 269' ' ' ALA . . . . . 0.419 ' CB ' ' CD ' ' B' ' 270' ' ' PRO . . . -170.18 -60.82 0.0 OUTLIER Pre-proline 0 N--CA 1.499 1.998 0 O-C-N 121.48 -0.762 . . . . 0.0 110.423 179.723 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 270' ' ' PRO . . . . . 0.419 ' CD ' ' CB ' ' B' ' 269' ' ' ALA . 29.9 Cg_endo -68.09 125.58 13.24 Favored 'Trans proline' 0 N--CA 1.488 1.194 0 O-C-N 123.151 1.08 . . . . 0.0 110.327 179.676 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 271' ' ' SER . . . . . . . . . . . . . 89.1 p -68.49 -32.25 72.1 Favored 'General case' 0 N--CA 1.5 2.026 0 O-C-N 121.736 -0.602 . . . . 0.0 110.351 179.928 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 272' ' ' ASP . . . . . . . . . . . . . 20.0 t70 -95.95 143.39 27.18 Favored 'General case' 0 N--CA 1.495 1.805 0 O-C-N 121.652 -0.655 . . . . 0.0 110.176 -179.687 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 273' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER 53.52 95.93 0.02 OUTLIER 'General case' 0 N--CA 1.506 2.345 0 O-C-N 121.67 -0.644 . . . . 0.0 111.008 179.953 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 274' ' ' ALA . . . . . . . . . . . . . . . -166.0 119.24 1.12 Allowed 'General case' 0 N--CA 1.496 1.838 0 O-C-N 121.588 -0.695 . . . . 0.0 110.071 179.669 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 275' ' ' THR . . . . . . . . . . . . . 35.6 p -127.39 92.19 44.12 Favored Pre-proline 0 N--CA 1.495 1.814 0 O-C-N 121.783 -0.573 . . . . 0.0 110.198 -179.578 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 276' ' ' PRO . . . . . . . . . . . . . 22.5 Cg_endo -66.1 -25.39 51.12 Favored 'Trans proline' 0 N--CA 1.489 1.225 0 O-C-N 123.542 1.285 . . . . 0.0 111.168 -179.18 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 277' ' ' GLN . . . . . . . . . . . . . 3.9 mp0 -62.81 -58.74 15.08 Favored Pre-proline 0 N--CA 1.502 2.128 0 O-C-N 121.258 -0.901 . . . . 0.0 110.811 -177.243 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 278' ' ' PRO . . . . . . . . . . . . . 30.8 Cg_endo -68.16 -31.29 29.89 Favored 'Trans proline' 0 N--CA 1.488 1.189 0 O-C-N 123.148 1.078 . . . . 0.0 110.535 179.296 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 279' ' ' SER . . . . . . . . . . . . . 49.0 m -68.01 160.19 29.23 Favored 'General case' 0 N--CA 1.499 1.995 0 O-C-N 121.594 -0.691 . . . . 0.0 110.283 -179.851 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 280' ' ' THR . . . . . . . . . . . . . 9.9 t -130.62 164.85 24.06 Favored 'General case' 0 N--CA 1.498 1.935 0 O-C-N 121.666 -0.646 . . . . 0.0 110.302 -179.492 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 281' ' ' PHE . . . . . 0.418 ' CB ' ' CD ' ' B' ' 282' ' ' PRO . 2.9 m-85 -166.92 -61.62 0.01 OUTLIER Pre-proline 0 N--CA 1.498 1.959 0 O-C-N 121.677 -0.64 . . . . 0.0 110.543 -178.11 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 282' ' ' PRO . . . . . 0.418 ' CD ' ' CB ' ' B' ' 281' ' ' PHE . 28.2 Cg_endo -66.95 -30.27 39.82 Favored 'Trans proline' 0 N--CA 1.49 1.315 0 O-C-N 123.145 1.076 . . . . 0.0 110.829 -179.328 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 283' ' ' GLN . . . . . . . . . . . . . 28.2 mt-30 -65.8 -57.95 12.63 Favored Pre-proline 0 N--CA 1.5 2.033 0 O-C-N 121.483 -0.76 . . . . 0.0 110.679 -177.831 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 284' ' ' PRO . . . . . . . . . . . . . 32.4 Cg_endo -68.91 162.66 40.61 Favored 'Trans proline' 0 N--CA 1.488 1.151 0 O-C-N 123.183 1.096 . . . . 0.0 110.251 178.838 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 285' ' ' PRO . . . . . . . . . . . . . 21.4 Cg_exo -61.7 139.98 83.74 Favored 'Trans proline' 0 N--CA 1.49 1.288 0 O-C-N 123.573 1.302 . . . . 0.0 110.64 -179.83 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 286' ' ' VAL . . . . . . . . . . . . . 12.6 p -134.42 144.19 35.82 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.882 0 O-C-N 121.783 -0.573 . . . . 0.0 110.198 179.989 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 287' ' ' GLU . . . . . . . . . . . . . 54.5 mt-10 -102.16 147.08 27.06 Favored 'General case' 0 N--CA 1.495 1.776 0 O-C-N 121.712 -0.618 . . . . 0.0 110.244 179.69 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 288' ' ' SER . . . . . . . . . . . . . 30.2 t -125.62 143.94 50.8 Favored 'General case' 0 N--CA 1.497 1.89 0 O-C-N 121.78 -0.575 . . . . 0.0 110.206 -179.807 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 289' ' ' HIS . . . . . . . . . . . . . 48.5 p-80 -125.33 145.9 49.82 Favored 'General case' 0 N--CA 1.497 1.891 0 O-C-N 121.658 -0.651 . . . . 0.0 110.256 179.762 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 290' ' ' SER . . . . . . . . . . . . . 49.5 m -120.05 148.0 44.12 Favored 'General case' 0 N--CA 1.495 1.808 0 O-C-N 121.685 -0.634 . . . . 0.0 110.227 -179.839 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 291' ' ' SER . . . . . . . . . . . . . 9.0 t . . . . . 0 N--CA 1.494 1.764 0 CA-C-O 118.038 -0.982 . . . . 0.0 110.203 -179.982 . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' -1' ' ' MET . . . . . . . . . . . . . 85.4 mtp . . . . . 0 N--CA 1.494 1.757 0 CA-C-O 120.991 0.424 . . . . 0.0 110.145 . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 0' ' ' GLY . . . . . . . . . . . . . . . -143.32 -126.33 2.01 Favored Glycine 0 N--CA 1.494 2.558 0 N-CA-C 109.509 -1.436 . . . . 0.0 109.509 -179.962 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 65.3 mtt -105.92 147.86 28.29 Favored 'General case' 0 N--CA 1.495 1.782 0 O-C-N 121.674 -0.898 . . . . 0.0 110.275 179.938 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 68.4 m -100.98 172.46 7.01 Favored 'General case' 0 N--CA 1.495 1.782 0 O-C-N 121.774 -0.579 . . . . 0.0 110.256 -179.651 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 67.3 t -66.45 -27.78 41.4 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.085 0 O-C-N 121.676 -0.64 . . . . 0.0 110.379 -178.98 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -54.91 -30.67 58.9 Favored 'General case' 0 N--CA 1.505 2.296 0 O-C-N 121.451 -0.781 . . . . 0.0 110.538 -177.906 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 74.5 m-20 -69.01 -30.55 68.95 Favored 'General case' 0 N--CA 1.499 1.982 0 O-C-N 121.827 -0.546 . . . . 0.0 110.321 175.018 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 97.2 m-85 -95.49 10.12 37.64 Favored 'General case' 0 N--CA 1.497 1.898 0 O-C-N 121.628 -0.67 . . . . 0.0 111.512 -178.208 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 3.8 m-30 -67.18 140.25 57.46 Favored 'General case' 0 N--CA 1.502 2.156 0 O-C-N 121.158 -0.964 . . . . 0.0 110.134 174.735 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 83.15 -2.04 87.66 Favored Glycine 0 N--CA 1.498 2.79 0 N-CA-C 110.67 -0.972 . . . . 0.0 110.67 -176.118 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 67.1 m -75.31 140.95 43.43 Favored 'General case' 0 N--CA 1.497 1.902 0 O-C-N 121.11 -1.229 . . . . 0.0 110.554 -179.536 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 4.3 m-80 -85.63 117.82 24.76 Favored 'General case' 0 N--CA 1.497 1.893 0 N-CA-C 109.492 -0.558 . . . . 0.0 109.492 173.525 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 35.3 m -142.55 162.32 18.52 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.889 0 O-C-N 121.675 -0.641 . . . . 0.0 109.746 179.591 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . 0.408 ' HA ' ' HA ' ' A' ' 22' ' ' ARG . 45.3 tt0 -109.41 129.98 55.52 Favored 'General case' 0 N--CA 1.492 1.65 0 C-N-CA 119.851 -0.74 . . . . 0.0 109.887 176.069 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 60.3 t -106.74 125.58 62.67 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.714 0 O-C-N 121.725 -0.61 . . . . 0.0 109.831 179.731 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 28.6 tp -95.82 126.28 40.97 Favored 'General case' 0 N--CA 1.493 1.707 0 N-CA-C 109.128 -0.693 . . . . 0.0 109.128 175.225 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 87.1 mt -95.85 168.05 10.88 Favored 'General case' 0 N--CA 1.496 1.839 0 O-C-N 121.689 -0.632 . . . . 0.0 111.087 -172.989 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 24.3 p30 -58.15 -21.86 48.77 Favored 'General case' 0 N--CA 1.507 2.39 0 O-C-N 121.835 -0.54 . . . . 0.0 111.583 -176.896 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 44.0 p-10 -92.2 22.79 4.19 Favored 'General case' 0 N--CA 1.498 1.973 0 O-C-N 121.561 -0.712 . . . . 0.0 110.968 -176.636 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 74.3 m-20 58.75 27.52 16.08 Favored 'General case' 0 N--CA 1.505 2.298 0 O-C-N 121.364 -0.835 . . . . 0.0 110.662 175.77 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 51.1 m -106.86 142.01 37.17 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.473 -0.767 . . . . 0.0 109.568 172.645 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 94.6 mttt -109.62 146.42 34.78 Favored 'General case' 0 N--CA 1.496 1.83 0 O-C-N 121.611 -0.681 . . . . 0.0 110.646 -176.183 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -153.11 151.16 29.86 Favored 'General case' 0 N--CA 1.497 1.877 0 O-C-N 121.825 -0.547 . . . . 0.0 109.991 175.277 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . 0.408 ' HA ' ' HA ' ' A' ' 12' ' ' GLU . 31.0 ptt180 -140.02 146.17 38.69 Favored 'General case' 0 N--CA 1.499 2.001 0 O-C-N 121.568 -0.707 . . . . 0.0 110.654 -179.853 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -171.77 171.49 44.13 Favored Glycine 0 N--CA 1.495 2.609 0 N-CA-C 108.768 -1.733 . . . . 0.0 108.768 -174.378 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 25.2 t -94.55 120.1 43.48 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.907 0 O-C-N 121.49 -1.006 . . . . 0.0 109.34 -176.119 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 87.2 mt -63.45 143.33 15.72 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.24 0 O-C-N 121.479 -0.763 . . . . 0.0 110.462 -172.729 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 6.7 p -121.15 -28.73 4.67 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.671 -0.643 . . . . 0.0 111.329 179.079 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 26.9 t30 -161.97 158.78 25.67 Favored 'General case' 0 N--CA 1.499 2.004 0 O-C-N 120.985 -1.072 . . . . 0.0 111.661 -177.095 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 84.3 t80 -150.08 126.86 11.03 Favored 'General case' 0 N--CA 1.497 1.882 0 N-CA-C 109.132 -0.692 . . . . 0.0 109.132 170.78 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 21.3 t70 -100.53 130.92 46.67 Favored 'General case' 0 N--CA 1.491 1.581 0 N-CA-C 109.04 -0.726 . . . . 0.0 109.04 -176.772 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 20.9 m -69.29 -49.99 50.87 Favored 'General case' 0 N--CA 1.498 1.946 0 C-N-CA 120.062 -0.655 . . . . 0.0 110.504 -176.679 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 22.6 m -59.76 -42.72 93.88 Favored 'General case' 0 N--CA 1.502 2.135 0 O-C-N 121.648 -0.658 . . . . 0.0 110.84 -174.478 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 29.6 m120 -103.71 -10.1 18.61 Favored 'General case' 0 N--CA 1.496 1.873 0 O-C-N 121.667 -0.646 . . . . 0.0 111.553 -178.069 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 1.8 m 49.88 67.38 0.91 Allowed 'General case' 0 N--CA 1.507 2.424 0 O-C-N 121.103 -0.998 . . . . 0.0 110.87 -174.795 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 47.4 mm -125.43 126.86 71.25 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.006 0 O-C-N 121.557 -0.715 . . . . 0.0 109.469 -176.061 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 6.7 tp -115.85 120.03 37.93 Favored 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.678 -0.639 . . . . 0.0 110.335 -169.237 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 99.5 mt-30 -90.98 134.68 34.29 Favored 'General case' 0 N--CA 1.492 1.63 0 C-N-CA 120.268 -0.573 . . . . 0.0 109.477 175.386 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 17.2 mt -117.82 123.87 46.98 Favored 'General case' 0 N--CA 1.495 1.781 0 O-C-N 121.854 -0.529 . . . . 0.0 110.023 174.818 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 74.9 ttt-85 -97.26 108.5 21.25 Favored 'General case' 0 N--CA 1.497 1.88 0 O-C-N 121.756 -0.59 . . . . 0.0 109.778 175.215 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 17.8 tp -85.28 151.67 23.88 Favored 'General case' 0 N--CA 1.495 1.797 0 O-C-N 121.703 -0.623 . . . . 0.0 110.981 -174.206 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -62.99 -9.25 9.31 Favored 'General case' 0 N--CA 1.503 2.193 0 O-C-N 121.965 -0.459 . . . . 0.0 111.895 -172.668 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 30.1 m120 -85.38 29.05 0.69 Allowed 'General case' 0 N--CA 1.499 1.981 0 O-C-N 121.086 -1.009 . . . . 0.0 110.95 174.33 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 74.4 m-20 59.33 31.15 20.92 Favored 'General case' 0 N--CA 1.505 2.302 0 O-C-N 121.136 -0.978 . . . . 0.0 110.366 174.378 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 48.7 m -122.81 137.93 54.79 Favored 'General case' 0 N--CA 1.495 1.795 0 O-C-N 121.42 -0.8 . . . . 0.0 110.395 179.121 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 9.0 t -97.19 149.41 22.04 Favored 'General case' 0 N--CA 1.498 1.949 0 O-C-N 121.814 -0.554 . . . . 0.0 110.233 176.77 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 74.7 tttt -149.89 119.2 6.83 Favored 'General case' 0 N--CA 1.494 1.755 0 O-C-N 121.602 -0.687 . . . . 0.0 110.255 178.515 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 88.7 p -95.0 123.97 38.78 Favored 'General case' 0 N--CA 1.496 1.828 0 O-C-N 121.694 -0.629 . . . . 0.0 110.175 179.214 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 82.4 mt -129.32 134.47 63.71 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.9 0 N-CA-C 109.246 -0.649 . . . . 0.0 109.246 -179.967 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 63.1 t -82.11 127.59 39.49 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.891 0 O-C-N 121.574 -0.704 . . . . 0.0 109.268 179.668 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 38.6 p -59.97 -24.93 64.82 Favored 'General case' 0 N--CA 1.503 2.216 0 O-C-N 121.592 -0.692 . . . . 0.0 112.065 -171.141 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 80.8 mttt -56.82 -25.29 55.65 Favored 'General case' 0 N--CA 1.502 2.174 0 O-C-N 121.445 -0.784 . . . . 0.0 111.03 -176.405 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 6.3 p30 -84.62 5.2 28.91 Favored 'General case' 0 N--CA 1.498 1.947 0 C-N-CA 119.726 -0.79 . . . . 0.0 111.441 176.318 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 98.6 mt -75.56 127.94 37.12 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.146 0 O-C-N 121.136 -0.977 . . . . 0.0 109.92 175.972 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 40.0 tttp -91.92 -32.76 15.15 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.782 -0.573 . . . . 0.0 109.528 168.942 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -161.46 156.82 24.12 Favored 'General case' 0 N--CA 1.499 1.977 0 O-C-N 121.76 -0.587 . . . . 0.0 109.958 -176.936 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 86.2 mt -133.05 150.09 52.14 Favored 'General case' 0 N--CA 1.497 1.922 0 O-C-N 121.639 -0.663 . . . . 0.0 110.517 -179.425 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 20.1 ptp180 -151.86 142.85 23.09 Favored 'General case' 0 N--CA 1.495 1.81 0 O-C-N 121.741 -0.599 . . . . 0.0 110.065 175.518 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 66.5 mt -86.49 133.19 30.41 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.912 0 O-C-N 121.558 -0.714 . . . . 0.0 109.835 173.428 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 50.8 mt -85.19 123.18 73.64 Favored Pre-proline 0 N--CA 1.497 1.924 0 O-C-N 121.583 -0.698 . . . . 0.0 110.091 179.41 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 29.4 Cg_endo -67.95 150.82 78.25 Favored 'Trans proline' 0 N--CA 1.487 1.13 0 O-C-N 123.233 1.122 . . . . 0.0 110.19 176.744 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 60.0 mttm -88.18 139.06 30.89 Favored 'General case' 0 N--CA 1.497 1.877 0 O-C-N 121.657 -0.652 . . . . 0.0 110.147 -179.676 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 90.8 m-20 -65.25 -38.39 90.19 Favored 'General case' 0 N--CA 1.5 2.028 0 O-C-N 121.737 -0.602 . . . . 0.0 110.415 -179.095 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 78.3 mt-10 52.01 -166.43 0.05 Allowed 'General case' 0 N--CA 1.507 2.404 0 O-C-N 121.647 -0.658 . . . . 0.0 110.828 179.983 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 33.5 pt -105.67 147.66 11.07 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.969 0 O-C-N 121.521 -0.737 . . . . 0.0 110.096 178.113 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 64' ' ' MET . . . . . . . . . . . . . 36.6 ttm 51.65 56.68 16.38 Favored Pre-proline 0 N--CA 1.506 2.326 0 O-C-N 121.596 -0.69 . . . . 0.0 110.663 -176.517 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 29.3 Cg_endo -67.39 155.29 71.01 Favored 'Trans proline' 0 N--CA 1.488 1.193 0 O-C-N 123.543 1.286 . . . . 0.0 110.537 -177.986 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 18.6 tptm 54.02 57.19 6.19 Favored 'General case' 0 N--CA 1.506 2.343 0 O-C-N 121.621 -0.674 . . . . 0.0 110.856 179.072 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 16.4 t-20 -63.28 -40.2 96.71 Favored 'General case' 0 N--CA 1.501 2.122 0 O-C-N 121.434 -0.791 . . . . 0.0 110.268 179.171 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . -95.98 179.45 35.32 Favored Glycine 0 N--CA 1.495 2.568 0 N-CA-C 109.284 -1.527 . . . . 0.0 109.284 177.888 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 9.8 t -138.38 147.49 43.46 Favored 'General case' 0 N--CA 1.496 1.867 0 O-C-N 121.659 -0.906 . . . . 0.0 110.421 179.444 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 60.1 tttt -107.51 -44.97 4.16 Favored 'General case' 0 N--CA 1.495 1.781 0 O-C-N 121.75 -0.593 . . . . 0.0 110.089 178.713 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 20.9 m 53.1 65.14 6.17 Favored Pre-proline 0 N--CA 1.504 2.256 0 O-C-N 121.61 -0.681 . . . . 0.0 110.902 179.625 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 27.9 Cg_endo -67.08 145.45 73.4 Favored 'Trans proline' 0 N--CA 1.489 1.212 0 O-C-N 123.416 1.219 . . . . 0.0 110.297 178.486 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 26.1 t -110.75 28.99 8.15 Favored 'General case' 0 N--CA 1.497 1.885 0 O-C-N 121.698 -0.626 . . . . 0.0 110.615 -179.17 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 24.4 m -68.81 -42.96 76.56 Favored 'General case' 0 N--CA 1.499 2.023 0 O-C-N 121.514 -0.741 . . . . 0.0 110.071 179.029 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 91.6 m-20 -131.84 143.9 50.51 Favored 'General case' 0 N--CA 1.495 1.815 0 O-C-N 121.735 -0.603 . . . . 0.0 110.136 179.193 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 50.6 m -121.84 146.17 47.35 Favored 'General case' 0 N--CA 1.495 1.813 0 O-C-N 121.716 -0.615 . . . . 0.0 110.201 -179.716 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 40.0 p -124.45 155.51 38.76 Favored 'General case' 0 N--CA 1.496 1.828 0 O-C-N 121.71 -0.619 . . . . 0.0 110.213 179.319 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 72.1 mttt -97.91 -40.05 8.68 Favored 'General case' 0 N--CA 1.495 1.797 0 O-C-N 121.71 -0.619 . . . . 0.0 110.284 179.993 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 15.1 tp -106.59 137.45 44.57 Favored 'General case' 0 N--CA 1.494 1.775 0 O-C-N 121.707 -0.62 . . . . 0.0 110.246 -179.014 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 96.4 mttt -82.51 155.04 24.76 Favored 'General case' 0 N--CA 1.497 1.881 0 O-C-N 121.59 -0.694 . . . . 0.0 110.01 178.747 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 48.7 m -114.08 140.11 48.74 Favored 'General case' 0 N--CA 1.495 1.81 0 O-C-N 121.629 -0.67 . . . . 0.0 110.309 -178.612 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -163.17 -63.17 0.04 OUTLIER 'General case' 0 N--CA 1.495 1.807 0 O-C-N 121.72 -0.612 . . . . 0.0 109.944 178.749 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 35.6 tt0 -127.54 141.4 51.66 Favored 'General case' 0 N--CA 1.495 1.781 0 O-C-N 121.723 -0.611 . . . . 0.0 109.977 178.025 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 36.9 p -103.46 30.05 5.24 Favored 'General case' 0 N--CA 1.496 1.85 0 O-C-N 121.629 -0.669 . . . . 0.0 110.586 -177.665 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 57.5 t80 -142.04 128.65 20.29 Favored 'General case' 0 N--CA 1.493 1.711 0 O-C-N 121.507 -0.745 . . . . 0.0 110.304 179.822 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 50.2 m -130.87 146.78 52.4 Favored 'General case' 0 N--CA 1.495 1.816 0 O-C-N 121.689 -0.632 . . . . 0.0 110.195 179.057 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 2.9 m -154.98 -67.45 0.13 Allowed 'General case' 0 N--CA 1.495 1.786 0 O-C-N 121.664 -0.648 . . . . 0.0 110.256 179.339 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 56.6 tttt -162.17 34.17 0.12 Allowed 'General case' 0 N--CA 1.494 1.753 0 O-C-N 121.58 -0.7 . . . . 0.0 110.135 179.884 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 89.2 m-20 53.21 40.32 31.08 Favored 'General case' 0 N--CA 1.505 2.319 0 O-C-N 121.477 -0.764 . . . . 0.0 110.87 179.905 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 52.1 mtmt -65.45 -34.98 79.56 Favored 'General case' 0 N--CA 1.499 2.019 0 O-C-N 121.59 -0.694 . . . . 0.0 110.443 -179.143 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 91' ' ' TRP . . . . . . . . . . . . . 12.7 m-90 -84.27 -53.38 5.53 Favored 'General case' 0 N--CA 1.497 1.919 0 O-C-N 121.701 -0.624 . . . . 0.0 110.321 -178.814 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 29.4 t -125.83 132.75 52.17 Favored 'General case' 0 N--CA 1.496 1.837 0 O-C-N 121.598 -0.689 . . . . 0.0 110.241 179.935 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 93' ' ' MET . . . . . . . . . . . . . 65.4 mtt -67.13 -35.66 80.21 Favored 'General case' 0 N--CA 1.499 2.018 0 O-C-N 121.624 -0.672 . . . . 0.0 110.296 179.954 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 3.8 p30 . . . . . 0 N--CA 1.496 1.872 0 CA-C-O 117.954 -1.022 . . . . 0.0 110.28 -179.637 . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' B' B ' 240' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.325 0 N-CA-C 109.517 -1.433 . . . . 0.0 109.517 . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' B' B ' 241' ' ' ALA . . . . . . . . . . . . . . . -69.64 145.75 52.2 Favored 'General case' 0 N--CA 1.498 1.956 0 O-C-N 121.714 -0.874 . . . . 0.0 110.118 179.969 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 242' ' ' THR . . . . . . . . . . . . . 38.1 p -107.33 29.88 6.74 Favored 'General case' 0 N--CA 1.495 1.82 0 O-C-N 121.696 -0.627 . . . . 0.0 110.495 -179.741 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 243' ' ' THR . . . . . . . . . . . . . 9.8 t -136.14 152.6 50.99 Favored 'General case' 0 N--CA 1.496 1.847 0 O-C-N 121.567 -0.708 . . . . 0.0 110.336 179.855 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 244' ' ' LYS . . . . . . . . . . . . . 33.7 pttt -139.49 146.83 40.47 Favored 'General case' 0 N--CA 1.495 1.821 0 O-C-N 121.727 -0.608 . . . . 0.0 110.434 179.946 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 245' ' ' GLU . . . . . . . . . . . . . 12.3 pt-20 -136.61 142.47 43.3 Favored 'General case' 0 N--CA 1.497 1.884 0 O-C-N 121.682 -0.636 . . . . 0.0 110.285 179.159 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 246' ' ' LYS . . . . . . . . . . . . . 24.2 mmmt -107.43 120.23 41.61 Favored 'General case' 0 N--CA 1.495 1.79 0 O-C-N 121.657 -0.652 . . . . 0.0 110.254 -179.679 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 247' ' ' ASN . . . . . . . . . . . . . 15.0 t-20 52.78 38.2 25.88 Favored 'General case' 0 N--CA 1.506 2.341 0 O-C-N 121.621 -0.674 . . . . 0.0 110.988 179.17 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 248' ' ' ILE . . . . . . . . . . . . . 68.6 mt 52.29 59.77 0.29 Allowed 'Isoleucine or valine' 0 N--CA 1.507 2.392 0 O-C-N 121.522 -0.736 . . . . 0.0 110.421 -179.143 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 249' ' ' SER . . . . . . . . . . . . . 50.3 m -118.14 152.09 36.31 Favored 'General case' 0 N--CA 1.495 1.8 0 O-C-N 121.554 -0.716 . . . . 0.0 110.246 -179.133 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 250' ' ' VAL . . . . . . . . . . . . . 29.3 m -150.16 81.81 0.08 OUTLIER 'Isoleucine or valine' 0 N--CA 1.498 1.929 0 CA-C-O 121.387 0.613 . . . . 0.0 110.11 -179.57 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 251' ' ' ASP . . . . . . . . . . . . . 74.5 m-20 -81.64 133.77 35.4 Favored 'General case' 0 N--CA 1.497 1.911 0 O-C-N 121.513 -0.742 . . . . 0.0 110.169 179.775 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 252' ' ' VAL . . . . . . . . . . . . . 94.7 t 56.2 -86.6 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.508 2.435 0 O-C-N 121.829 -0.544 . . . . 0.0 110.735 -179.33 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 253' ' ' ASP . . . . . . . . . . . . . 74.7 m-20 51.89 52.2 14.97 Favored 'General case' 0 N--CA 1.506 2.351 0 O-C-N 121.006 -1.058 . . . . 0.0 110.969 -178.435 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 254' ' ' ALA . . . . . . . . . . . . . . . -66.02 -31.77 72.86 Favored 'General case' 0 N--CA 1.501 2.094 0 O-C-N 121.524 -0.735 . . . . 0.0 110.393 -179.128 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 255' ' ' ASP . . . . . . . . . . . . . 11.6 p-10 -72.01 -35.42 69.43 Favored 'General case' 0 N--CA 1.499 1.993 0 O-C-N 121.58 -0.7 . . . . 0.0 110.198 179.415 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 256' ' ' ALA . . . . . . . . . . . . . . . -65.02 -42.78 94.11 Favored 'General case' 0 N--CA 1.501 2.079 0 O-C-N 121.651 -0.655 . . . . 0.0 110.186 178.325 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 257' ' ' SER . . . . . . . . . . . . . 43.2 t -55.19 -35.39 64.78 Favored 'General case' 0 N--CA 1.503 2.195 0 O-C-N 121.66 -0.65 . . . . 0.0 110.499 177.998 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 258' ' ' SER . . . . . . . . . . . . . 25.2 m -68.89 -30.87 69.45 Favored 'General case' 0 N--CA 1.498 1.968 0 C-N-CA 120.436 -0.506 . . . . 0.0 110.389 -179.769 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 259' ' ' GLN . . . . . . . . . . . . . 48.9 tt0 -63.56 -39.98 95.81 Favored 'General case' 0 N--CA 1.501 2.108 0 O-C-N 121.589 -0.694 . . . . 0.0 110.43 -179.903 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 260' ' ' LEU . . . . . . . . . . . . . 83.7 mt -67.37 -43.53 81.18 Favored 'General case' 0 N--CA 1.5 2.055 0 O-C-N 121.609 -0.682 . . . . 0.0 110.247 -179.661 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 261' ' ' LEU . . . . . . . . . . . . . 17.1 tp -70.38 -36.77 74.33 Favored 'General case' 0 N--CA 1.498 1.962 0 O-C-N 121.634 -0.666 . . . . 0.0 109.629 177.078 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 262' ' ' SER . . . . . . . . . . . . . 22.8 t -62.79 -35.84 81.2 Favored 'General case' 0 N--CA 1.501 2.076 0 O-C-N 121.776 -0.578 . . . . 0.0 110.565 176.671 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 263' ' ' LEU . . . . . . . . . . . . . 19.9 mt -64.55 -44.6 90.28 Favored 'General case' 0 N--CA 1.501 2.078 0 O-C-N 121.598 -0.689 . . . . 0.0 110.247 -179.331 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 264' ' ' LEU . . . . . . . . . . . . . 86.3 mt -62.42 -34.72 77.31 Favored 'General case' 0 N--CA 1.502 2.158 0 O-C-N 121.762 -0.586 . . . . 0.0 110.566 177.872 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 265' ' ' LYS . . . . . . . . . . . . . 81.3 tttt -75.66 -40.71 55.64 Favored 'General case' 0 N--CA 1.498 1.945 0 O-C-N 121.7 -0.625 . . . . 0.0 110.115 -179.048 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 266' ' ' SER . . . . . . . . . . . . . 85.9 p -163.11 165.84 24.17 Favored 'General case' 0 N--CA 1.496 1.828 0 O-C-N 121.637 -0.665 . . . . 0.0 110.2 -179.696 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 267' ' ' SER . . . . . . . . . . . . . 91.1 p -143.36 163.49 32.9 Favored 'General case' 0 N--CA 1.495 1.8 0 O-C-N 121.73 -0.607 . . . . 0.0 110.269 179.73 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 268' ' ' THR . . . . . . . . . . . . . 23.8 m -95.82 137.69 34.53 Favored 'General case' 0 N--CA 1.494 1.772 0 O-C-N 121.668 -0.645 . . . . 0.0 110.159 179.881 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 269' ' ' ALA . . . . . . . . . . . . . . . 48.72 65.88 6.48 Favored Pre-proline 0 N--CA 1.506 2.358 0 O-C-N 121.693 -0.629 . . . . 0.0 111.139 -178.177 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 270' ' ' PRO . . . . . . . . . . . . . 27.0 Cg_endo -66.78 135.6 38.95 Favored 'Trans proline' 0 N--CA 1.488 1.161 0 O-C-N 123.525 1.276 . . . . 0.0 110.476 -178.963 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 271' ' ' SER . . . . . . . . . . . . . 29.4 t -148.2 139.89 23.76 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.674 -0.642 . . . . 0.0 110.142 179.061 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 272' ' ' ASP . . . . . . . . . . . . . 2.6 p30 -161.04 32.57 0.14 Allowed 'General case' 0 N--CA 1.496 1.861 0 O-C-N 121.696 -0.627 . . . . 0.0 110.489 179.859 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 273' ' ' LEU . . . . . . . . . . . . . 21.3 tp -83.18 126.32 32.5 Favored 'General case' 0 N--CA 1.497 1.876 0 O-C-N 121.631 -0.668 . . . . 0.0 110.097 179.848 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 274' ' ' ALA . . . . . . . . . . . . . . . 49.68 92.72 0.02 OUTLIER 'General case' 0 N--CA 1.506 2.357 0 O-C-N 121.741 -0.6 . . . . 0.0 111.304 -178.862 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 275' ' ' THR . . . . . . . . . . . . . 8.2 t -125.27 149.64 64.72 Favored Pre-proline 0 N--CA 1.498 1.927 0 O-C-N 121.57 -0.706 . . . . 0.0 110.161 -179.837 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 276' ' ' PRO . . . . . . . . . . . . . 28.7 Cg_endo -67.34 148.14 79.27 Favored 'Trans proline' 0 N--CA 1.489 1.235 0 O-C-N 123.52 1.274 . . . . 0.0 110.413 179.567 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 277' ' ' GLN . . . . . . . . . . . . . 24.2 tt0 -123.72 88.17 52.17 Favored Pre-proline 0 N--CA 1.495 1.782 0 O-C-N 121.696 -0.628 . . . . 0.0 110.168 179.692 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 278' ' ' PRO . . . . . . . . . . . . . 21.2 Cg_exo -61.97 144.9 96.89 Favored 'Trans proline' 0 N--CA 1.49 1.318 0 O-C-N 123.49 1.258 . . . . 0.0 110.693 -179.6 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 279' ' ' SER . . . . . . . . . . . . . 35.1 t -142.1 -59.59 0.46 Allowed 'General case' 0 N--CA 1.495 1.818 0 O-C-N 121.719 -0.613 . . . . 0.0 110.225 179.96 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 280' ' ' THR . . . . . . . . . . . . . 45.5 p -127.09 32.04 5.15 Favored 'General case' 0 N--CA 1.495 1.813 0 O-C-N 121.64 -0.663 . . . . 0.0 110.358 -179.84 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 281' ' ' PHE . . . . . . . . . . . . . 2.6 m-85 -66.36 -57.1 13.45 Favored Pre-proline 0 N--CA 1.498 1.936 0 O-C-N 121.6 -0.687 . . . . 0.0 110.7 -179.549 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 282' ' ' PRO . . . . . . . . . . . . . 29.1 Cg_endo -68.36 -32.68 25.39 Favored 'Trans proline' 0 N--CA 1.487 1.138 0 O-C-N 123.277 1.146 . . . . 0.0 110.57 -177.44 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 283' ' ' GLN . . . . . . . . . . . . . 71.6 mt-30 -144.67 153.23 54.4 Favored Pre-proline 0 N--CA 1.494 1.735 0 O-C-N 121.615 -0.678 . . . . 0.0 110.33 179.448 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 284' ' ' PRO . . . . . . . . . . . . . 38.0 Cg_endo -71.82 156.91 56.21 Favored 'Trans proline' 0 N--CA 1.486 1.064 0 O-C-N 123.684 1.36 . . . . 0.0 110.309 179.428 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 285' ' ' PRO . . . . . . . . . . . . . 29.2 Cg_endo -67.66 144.32 65.58 Favored 'Trans proline' 0 N--CA 1.488 1.193 0 O-C-N 123.679 1.357 . . . . 0.0 110.315 178.894 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 286' ' ' VAL . . . . . . . . . . . . . 61.2 t -117.54 131.32 70.61 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.919 0 O-C-N 121.648 -0.658 . . . . 0.0 109.724 -179.776 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 287' ' ' GLU . . . . . . . . . . . . . 41.8 tt0 -120.88 134.93 55.29 Favored 'General case' 0 N--CA 1.495 1.796 0 O-C-N 121.654 -0.653 . . . . 0.0 110.047 179.256 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 288' ' ' SER . . . . . . . . . . . . . 32.3 t -143.16 140.03 30.61 Favored 'General case' 0 N--CA 1.494 1.736 0 O-C-N 121.691 -0.63 . . . . 0.0 110.288 179.637 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 289' ' ' HIS . . . . . . . . . . . . . 99.3 m-70 -95.3 -62.3 1.33 Allowed 'General case' 0 N--CA 1.495 1.808 0 O-C-N 121.702 -0.624 . . . . 0.0 110.191 179.499 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 290' ' ' SER . . . . . . . . . . . . . 31.1 m -66.06 -34.49 78.18 Favored 'General case' 0 N--CA 1.5 2.06 0 O-C-N 121.68 -0.637 . . . . 0.0 110.32 179.547 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 291' ' ' SER . . . . . . . . . . . . . 10.9 m . . . . . 0 N--CA 1.505 2.282 0 CA-C-O 117.997 -1.002 . . . . 0.0 111.074 -179.901 . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' -1' ' ' MET . . . . . . . . . . . . . 13.0 tpt . . . . . 0 N--CA 1.492 1.627 0 CA-C-O 121.118 0.485 . . . . 0.0 110.153 . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 0' ' ' GLY . . . . . . . . . . . . . . . -75.55 142.97 29.74 Favored Glycine 0 N--CA 1.495 2.625 0 N-CA-C 109.39 -1.484 . . . . 0.0 109.39 179.215 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 90.0 mtp -123.76 141.13 52.31 Favored 'General case' 0 N--CA 1.496 1.845 0 O-C-N 121.71 -0.876 . . . . 0.0 110.28 -179.59 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 65.5 m -101.01 163.42 12.29 Favored 'General case' 0 N--CA 1.494 1.77 0 O-C-N 121.678 -0.639 . . . . 0.0 109.976 178.433 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 69.3 t -66.81 -27.82 41.09 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.082 0 O-C-N 121.596 -0.69 . . . . 0.0 110.097 179.823 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -55.21 -30.62 60.33 Favored 'General case' 0 N--CA 1.504 2.25 0 O-C-N 121.401 -0.812 . . . . 0.0 110.313 179.711 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -68.17 -31.48 71.06 Favored 'General case' 0 N--CA 1.498 1.948 0 O-C-N 121.847 -0.533 . . . . 0.0 110.151 174.533 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 88.2 m-85 -95.73 9.53 40.08 Favored 'General case' 0 N--CA 1.497 1.888 0 O-C-N 121.711 -0.618 . . . . 0.0 111.342 179.869 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 3.5 m-30 -67.3 142.15 56.94 Favored 'General case' 0 N--CA 1.501 2.123 0 O-C-N 121.181 -0.949 . . . . 0.0 110.113 174.324 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 82.45 -0.2 89.32 Favored Glycine 0 N--CA 1.498 2.769 0 N-CA-C 110.648 -0.981 . . . . 0.0 110.648 -176.746 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 84.5 p -77.4 137.37 38.68 Favored 'General case' 0 N--CA 1.497 1.909 0 O-C-N 121.081 -1.247 . . . . 0.0 110.478 179.32 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 12.1 t-20 -84.05 119.09 24.54 Favored 'General case' 0 N--CA 1.497 1.923 0 O-C-N 121.644 -0.66 . . . . 0.0 109.45 172.944 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 35.6 m -142.64 164.0 17.39 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.63 0 O-C-N 121.829 -0.545 . . . . 0.0 109.541 -179.166 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 35.6 tt0 -109.32 129.13 55.53 Favored 'General case' 0 N--CA 1.493 1.687 0 C-N-CA 119.929 -0.708 . . . . 0.0 109.916 177.183 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 61.4 t -106.69 127.92 61.78 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.713 0 O-C-N 121.581 -0.7 . . . . 0.0 109.818 179.763 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 29.9 tp -95.94 128.33 42.74 Favored 'General case' 0 N--CA 1.493 1.718 0 N-CA-C 109.26 -0.644 . . . . 0.0 109.26 176.511 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 86.1 mt -95.02 160.94 14.34 Favored 'General case' 0 N--CA 1.495 1.813 0 O-C-N 121.615 -0.678 . . . . 0.0 111.015 -173.687 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 24.3 p30 -58.05 -21.87 47.56 Favored 'General case' 0 N--CA 1.506 2.343 0 O-C-N 121.819 -0.55 . . . . 0.0 111.571 -178.166 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 38.3 p-10 -93.28 24.02 4.1 Favored 'General case' 0 N--CA 1.497 1.923 0 O-C-N 121.507 -0.745 . . . . 0.0 110.782 -177.378 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 74.2 m-20 59.24 27.88 17.04 Favored 'General case' 0 N--CA 1.505 2.311 0 O-C-N 121.437 -0.789 . . . . 0.0 110.661 175.812 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 50.8 m -103.65 142.3 34.55 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.551 -0.718 . . . . 0.0 109.517 172.182 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 96.5 mttt -109.6 142.75 40.28 Favored 'General case' 0 N--CA 1.494 1.77 0 O-C-N 121.633 -0.667 . . . . 0.0 110.581 -175.806 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -153.07 152.82 31.77 Favored 'General case' 0 N--CA 1.497 1.897 0 O-C-N 121.725 -0.609 . . . . 0.0 110.304 176.376 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 32.9 ptt180 -144.08 149.13 36.11 Favored 'General case' 0 N--CA 1.498 1.951 0 O-C-N 121.691 -0.631 . . . . 0.0 110.519 177.574 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -171.77 171.46 44.11 Favored Glycine 0 N--CA 1.496 2.656 0 N-CA-C 108.954 -1.658 . . . . 0.0 108.954 -176.365 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 46.7 t -94.62 119.32 42.44 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.909 0 O-C-N 121.444 -1.033 . . . . 0.0 109.298 -177.27 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 95.8 mt -64.39 143.59 15.56 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.179 0 O-C-N 121.69 -0.631 . . . . 0.0 110.601 -171.312 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 7.9 p -121.17 -26.91 5.0 Favored 'General case' 0 N--CA 1.494 1.758 0 O-C-N 121.779 -0.575 . . . . 0.0 111.258 178.988 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 6.4 t30 -161.9 159.25 26.5 Favored 'General case' 0 N--CA 1.499 2.02 0 C-N-CA 118.969 -1.092 . . . . 0.0 111.671 -179.08 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 75.6 t80 -150.13 125.93 10.42 Favored 'General case' 0 N--CA 1.497 1.876 0 N-CA-C 109.089 -0.708 . . . . 0.0 109.089 170.478 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 17.9 t70 -99.64 130.61 45.88 Favored 'General case' 0 N--CA 1.491 1.605 0 N-CA-C 108.981 -0.748 . . . . 0.0 108.981 -177.395 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 34.7 m -69.64 -50.94 39.46 Favored 'General case' 0 N--CA 1.498 1.944 0 C-N-CA 120.01 -0.676 . . . . 0.0 110.534 -176.349 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 5.4 t -59.58 -42.74 93.21 Favored 'General case' 0 N--CA 1.502 2.138 0 O-C-N 121.477 -0.764 . . . . 0.0 110.791 -174.818 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 28.6 m120 -103.27 -10.06 19.03 Favored 'General case' 0 N--CA 1.497 1.893 0 O-C-N 121.573 -0.705 . . . . 0.0 111.446 -177.416 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 1.8 m 49.72 67.29 0.92 Allowed 'General case' 0 N--CA 1.507 2.407 0 O-C-N 121.054 -1.029 . . . . 0.0 111.08 -175.202 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 47.6 mm -124.91 126.19 70.9 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.092 0 O-C-N 121.595 -0.691 . . . . 0.0 109.438 -175.899 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 11.5 tp -115.86 121.07 41.28 Favored 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.596 -0.69 . . . . 0.0 110.622 -169.897 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 58.1 mt-30 -91.78 133.83 35.28 Favored 'General case' 0 N--CA 1.491 1.618 0 N-CA-C 109.435 -0.58 . . . . 0.0 109.435 173.49 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 90.5 mt -117.96 123.8 46.66 Favored 'General case' 0 N--CA 1.497 1.884 0 O-C-N 121.801 -0.562 . . . . 0.0 109.921 174.963 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 64.9 ttt180 -96.07 105.06 17.05 Favored 'General case' 0 N--CA 1.497 1.877 0 O-C-N 121.682 -0.636 . . . . 0.0 109.777 175.99 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 20.1 tp -85.0 155.31 21.62 Favored 'General case' 0 N--CA 1.495 1.791 0 O-C-N 121.701 -0.624 . . . . 0.0 110.951 -173.692 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -68.63 -2.99 10.31 Favored 'General case' 0 N--CA 1.503 2.178 0 O-C-N 121.943 -0.473 . . . . 0.0 112.203 -169.494 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 43.3 p-10 -86.91 25.78 1.25 Allowed 'General case' 0 N--CA 1.499 1.994 0 O-C-N 121.004 -1.06 . . . . 0.0 110.853 173.637 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 7.8 t70 61.74 28.07 17.25 Favored 'General case' 0 N--CA 1.504 2.267 0 O-C-N 121.115 -0.991 . . . . 0.0 110.484 178.717 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 36.7 m -120.54 137.93 54.13 Favored 'General case' 0 N--CA 1.496 1.87 0 O-C-N 121.396 -0.815 . . . . 0.0 110.431 -179.893 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 8.7 t -97.86 151.01 20.67 Favored 'General case' 0 N--CA 1.496 1.864 0 O-C-N 121.719 -0.613 . . . . 0.0 110.172 175.98 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 70.3 tttt -149.44 119.13 7.0 Favored 'General case' 0 N--CA 1.496 1.847 0 O-C-N 121.612 -0.68 . . . . 0.0 110.27 178.762 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 88.4 p -95.71 122.8 38.88 Favored 'General case' 0 N--CA 1.495 1.801 0 O-C-N 121.713 -0.617 . . . . 0.0 110.208 179.057 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 81.7 mt -129.39 136.48 59.27 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.813 0 O-C-N 121.584 -0.697 . . . . 0.0 109.385 179.64 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 57.8 t -81.8 127.53 39.52 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.896 0 N-CA-C 109.1 -0.704 . . . . 0.0 109.1 178.276 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 42.2 p -59.49 -25.74 64.7 Favored 'General case' 0 N--CA 1.504 2.229 0 O-C-N 121.558 -0.714 . . . . 0.0 112.071 -169.029 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 19.2 tptm -57.93 -23.39 53.3 Favored 'General case' 0 N--CA 1.502 2.154 0 O-C-N 121.512 -0.742 . . . . 0.0 111.346 -174.95 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 9.8 p30 -80.95 -4.32 54.61 Favored 'General case' 0 N--CA 1.499 2.02 0 C-N-CA 119.734 -0.786 . . . . 0.0 110.993 176.135 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 85.5 mt -80.57 135.58 24.98 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.056 0 O-C-N 121.209 -0.932 . . . . 0.0 110.127 178.329 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 62.0 tttt -91.32 -30.66 16.45 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.84 -0.537 . . . . 0.0 109.62 169.567 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -165.31 159.97 17.78 Favored 'General case' 0 N--CA 1.502 2.156 0 O-C-N 121.833 -0.542 . . . . 0.0 110.505 -176.53 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 4.4 mp -132.96 157.37 45.34 Favored 'General case' 0 N--CA 1.496 1.845 0 O-C-N 121.726 -0.609 . . . . 0.0 110.227 177.179 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 7.9 ptm180 -150.61 146.58 26.61 Favored 'General case' 0 N--CA 1.495 1.813 0 O-C-N 121.634 -0.666 . . . . 0.0 109.672 174.538 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 55.9 mt -86.04 133.31 29.96 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.876 0 O-C-N 121.508 -0.745 . . . . 0.0 109.952 175.49 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 79.2 mt -83.63 151.93 62.54 Favored Pre-proline 0 N--CA 1.498 1.942 0 O-C-N 121.589 -0.695 . . . . 0.0 110.076 -178.932 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 33.2 Cg_endo -69.26 113.23 3.22 Favored 'Trans proline' 0 N--CA 1.487 1.134 0 O-C-N 123.523 1.275 . . . . 0.0 110.384 -178.531 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 48.6 tttm -161.93 89.24 0.71 Allowed 'General case' 0 N--CA 1.495 1.811 0 O-C-N 121.655 -0.653 . . . . 0.0 110.072 178.006 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 24.3 p30 -161.37 36.35 0.14 Allowed 'General case' 0 N--CA 1.497 1.902 0 O-C-N 121.606 -0.684 . . . . 0.0 110.313 -179.706 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 79.2 mt-10 -90.47 136.03 33.32 Favored 'General case' 0 N--CA 1.496 1.871 0 O-C-N 121.689 -0.632 . . . . 0.0 110.161 -179.332 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 82.1 mt -119.75 131.28 72.67 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.996 0 O-C-N 121.719 -0.613 . . . . 0.0 109.635 179.799 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 64' ' ' MET . . . . . . . . . . . . . 35.1 mtt 52.0 58.53 15.5 Favored Pre-proline 0 N--CA 1.505 2.316 0 O-C-N 121.581 -0.699 . . . . 0.0 111.014 179.842 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 28.1 Cg_endo -67.79 -54.89 0.3 Allowed 'Trans proline' 0 N--CA 1.488 1.154 0 O-C-N 123.51 1.268 . . . . 0.0 110.39 179.845 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 62.4 mttm -100.07 -36.73 9.25 Favored 'General case' 0 N--CA 1.494 1.772 0 O-C-N 121.607 -0.683 . . . . 0.0 110.255 179.567 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 91.6 m-20 -107.47 138.81 43.0 Favored 'General case' 0 N--CA 1.496 1.839 0 O-C-N 121.751 -0.593 . . . . 0.0 110.142 -179.673 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . -179.09 -113.41 0.38 Allowed Glycine 0 N--CA 1.494 2.511 0 N-CA-C 109.525 -1.43 . . . . 0.0 109.525 179.992 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 24.5 m -68.64 -38.01 80.13 Favored 'General case' 0 N--CA 1.498 1.954 0 O-C-N 121.717 -0.872 . . . . 0.0 110.145 178.886 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 45.0 mmtm -66.02 -41.39 91.03 Favored 'General case' 0 N--CA 1.5 2.061 0 O-C-N 121.74 -0.6 . . . . 0.0 110.545 -178.786 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 4.7 m -145.31 159.32 49.17 Favored Pre-proline 0 N--CA 1.495 1.824 0 O-C-N 121.679 -0.638 . . . . 0.0 110.244 -179.215 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 22.2 Cg_exo -61.05 140.39 89.5 Favored 'Trans proline' 0 N--CA 1.49 1.323 0 O-C-N 123.611 1.322 . . . . 0.0 110.743 -179.701 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 17.4 t -89.3 -31.44 17.84 Favored 'General case' 0 N--CA 1.497 1.88 0 O-C-N 121.718 -0.614 . . . . 0.0 110.379 179.645 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 9.8 t -129.09 161.75 29.3 Favored 'General case' 0 N--CA 1.497 1.893 0 O-C-N 121.656 -0.653 . . . . 0.0 110.321 -179.816 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 91.3 m-20 -92.28 145.21 24.66 Favored 'General case' 0 N--CA 1.496 1.873 0 O-C-N 121.711 -0.618 . . . . 0.0 110.17 -179.502 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 50.9 m -116.34 153.09 32.62 Favored 'General case' 0 N--CA 1.495 1.798 0 O-C-N 121.641 -0.662 . . . . 0.0 110.119 -179.662 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 24.0 m -64.14 -38.19 90.17 Favored 'General case' 0 N--CA 1.501 2.105 0 O-C-N 121.654 -0.654 . . . . 0.0 110.389 -179.357 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 71.7 tttt -65.01 -42.36 94.53 Favored 'General case' 0 N--CA 1.5 2.067 0 O-C-N 121.653 -0.654 . . . . 0.0 110.294 179.709 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER 52.37 94.24 0.02 OUTLIER 'General case' 0 N--CA 1.505 2.305 0 O-C-N 121.629 -0.67 . . . . 0.0 111.174 179.561 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 98.6 mttt -89.74 104.44 17.0 Favored 'General case' 0 N--CA 1.497 1.906 0 O-C-N 121.716 -0.615 . . . . 0.0 110.112 179.702 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 86.4 p -160.24 174.51 14.11 Favored 'General case' 0 N--CA 1.494 1.76 0 O-C-N 121.692 -0.63 . . . . 0.0 110.205 -179.848 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -94.67 143.28 26.56 Favored 'General case' 0 N--CA 1.495 1.798 0 O-C-N 121.734 -0.604 . . . . 0.0 110.1 179.198 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 54.6 mt-10 -101.36 141.67 33.89 Favored 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.676 -0.64 . . . . 0.0 110.309 -179.044 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 24.6 m -127.94 142.25 51.3 Favored 'General case' 0 N--CA 1.495 1.793 0 O-C-N 121.729 -0.607 . . . . 0.0 110.103 179.48 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 70.4 t80 -103.66 130.93 51.2 Favored 'General case' 0 N--CA 1.494 1.771 0 O-C-N 121.645 -0.659 . . . . 0.0 110.203 179.735 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 30.6 t -124.01 146.97 48.18 Favored 'General case' 0 N--CA 1.495 1.814 0 O-C-N 121.693 -0.629 . . . . 0.0 110.189 -179.803 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 87.3 p -92.95 156.8 16.69 Favored 'General case' 0 N--CA 1.496 1.831 0 O-C-N 121.684 -0.635 . . . . 0.0 110.199 179.954 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 49.8 mttm -96.06 136.25 36.77 Favored 'General case' 0 N--CA 1.496 1.852 0 O-C-N 121.672 -0.643 . . . . 0.0 110.152 -179.827 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 17.3 t-20 -107.22 104.37 13.98 Favored 'General case' 0 N--CA 1.495 1.782 0 O-C-N 121.729 -0.607 . . . . 0.0 110.136 179.82 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 35.2 ttmt -95.21 -61.7 1.43 Allowed 'General case' 0 N--CA 1.494 1.761 0 O-C-N 121.659 -0.65 . . . . 0.0 110.259 179.652 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 91' ' ' TRP . . . . . . . . . . . . . 98.0 m95 -114.16 141.93 46.89 Favored 'General case' 0 N--CA 1.495 1.783 0 O-C-N 121.634 -0.666 . . . . 0.0 110.175 -179.919 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 8.0 t -133.34 33.61 3.57 Favored 'General case' 0 N--CA 1.494 1.77 0 O-C-N 121.737 -0.602 . . . . 0.0 110.274 179.81 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 93' ' ' MET . . . . . . . . . . . . . 90.2 mtp -65.03 -35.71 82.05 Favored 'General case' 0 N--CA 1.5 2.044 0 O-C-N 121.555 -0.716 . . . . 0.0 110.406 -179.683 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 18.6 t70 . . . . . 0 N--CA 1.505 2.294 0 CA-C-O 118.048 -0.977 . . . . 0.0 110.944 -179.901 . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' B' B ' 240' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.292 0 N-CA-C 109.566 -1.413 . . . . 0.0 109.566 . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' B' B ' 241' ' ' ALA . . . . . . . . . . . . . . . -104.68 145.49 30.27 Favored 'General case' 0 N--CA 1.494 1.768 0 O-C-N 121.594 -0.945 . . . . 0.0 110.186 179.972 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 242' ' ' THR . . . . . . . . . . . . . 40.4 p -121.75 159.56 26.4 Favored 'General case' 0 N--CA 1.496 1.829 0 O-C-N 121.689 -0.632 . . . . 0.0 110.238 179.711 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 243' ' ' THR . . . . . . . . . . . . . 24.8 m -124.43 137.42 54.45 Favored 'General case' 0 N--CA 1.495 1.812 0 O-C-N 121.643 -0.661 . . . . 0.0 110.19 -179.542 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 244' ' ' LYS . . . . . . . . . . . . . 54.8 mttm -103.85 146.23 28.95 Favored 'General case' 0 N--CA 1.495 1.787 0 O-C-N 121.654 -0.654 . . . . 0.0 110.083 179.233 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 245' ' ' GLU . . . . . . . . . . . . . 25.7 tp10 59.63 156.8 0.03 OUTLIER 'General case' 0 N--CA 1.508 2.444 0 O-C-N 121.672 -0.643 . . . . 0.0 110.762 -177.905 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 246' ' ' LYS . . . . . . . . . . . . . 48.4 mttp -88.57 124.69 34.29 Favored 'General case' 0 N--CA 1.497 1.907 0 O-C-N 121.525 -0.734 . . . . 0.0 110.188 179.98 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 247' ' ' ASN . . . . . . . . . . . . . 63.2 t30 -82.71 -34.15 27.37 Favored 'General case' 0 N--CA 1.497 1.919 0 O-C-N 121.679 -0.638 . . . . 0.0 110.196 179.585 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 248' ' ' ILE . . . . . . . . . . . . . 82.7 mt 53.4 76.77 0.08 OUTLIER 'Isoleucine or valine' 0 N--CA 1.506 2.364 0 O-C-N 121.485 -0.76 . . . . 0.0 110.411 -179.519 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 249' ' ' SER . . . . . . . . . . . . . 88.3 p -67.38 -30.24 69.97 Favored 'General case' 0 N--CA 1.501 2.083 0 O-C-N 121.602 -0.686 . . . . 0.0 110.416 179.409 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 250' ' ' VAL . . . . . . . . . . . . . 60.6 t -88.58 147.91 4.9 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.992 0 O-C-N 121.615 -0.678 . . . . 0.0 109.643 179.861 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 251' ' ' ASP . . . . . . . . . . . . . 6.8 t0 66.27 -65.03 0.2 Allowed 'General case' 0 N--CA 1.509 2.484 0 O-C-N 121.987 -0.445 . . . . 0.0 110.899 -177.22 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 252' ' ' VAL . . . . . . . . . . . . . 38.3 t 60.28 117.37 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.509 2.509 0 O-C-N 121.626 -0.671 . . . . 0.0 110.648 -179.384 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 253' ' ' ASP . . . . . . . . . . . . . 74.3 m-20 52.77 47.32 24.93 Favored 'General case' 0 N--CA 1.506 2.344 0 O-C-N 121.559 -0.713 . . . . 0.0 110.766 -178.848 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 254' ' ' ALA . . . . . . . . . . . . . . . -68.09 -31.31 70.85 Favored 'General case' 0 N--CA 1.498 1.972 0 O-C-N 121.681 -0.637 . . . . 0.0 110.474 179.435 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 255' ' ' ASP . . . . . . . . . . . . . 74.3 m-20 -72.52 -32.18 65.93 Favored 'General case' 0 N--CA 1.499 1.995 0 O-C-N 121.663 -0.648 . . . . 0.0 110.443 -177.544 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 256' ' ' ALA . . . . . . . . . . . . . . . -63.52 -50.09 70.93 Favored 'General case' 0 N--CA 1.502 2.157 0 O-C-N 121.439 -0.788 . . . . 0.0 110.393 -178.264 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 257' ' ' SER . . . . . . . . . . . . . 24.2 m -56.34 -36.11 68.38 Favored 'General case' 0 N--CA 1.503 2.204 0 O-C-N 121.691 -0.631 . . . . 0.0 110.521 177.44 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 258' ' ' SER . . . . . . . . . . . . . 22.7 t -69.46 -38.25 77.66 Favored 'General case' 0 N--CA 1.498 1.925 0 C-N-CA 120.481 -0.487 . . . . 0.0 110.317 -179.04 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 259' ' ' GLN . . . . . . . . . . . . . 88.7 mm-40 -64.73 -35.44 81.07 Favored 'General case' 0 N--CA 1.501 2.087 0 O-C-N 121.6 -0.687 . . . . 0.0 110.407 -179.748 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 260' ' ' LEU . . . . . . . . . . . . . 83.6 mt -67.56 -38.62 84.38 Favored 'General case' 0 N--CA 1.498 1.971 0 O-C-N 121.639 -0.663 . . . . 0.0 110.27 179.269 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 261' ' ' LEU . . . . . . . . . . . . . 47.9 tp -67.99 -39.89 83.19 Favored 'General case' 0 N--CA 1.498 1.957 0 O-C-N 121.57 -0.706 . . . . 0.0 109.994 178.668 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 262' ' ' SER . . . . . . . . . . . . . 21.0 m -63.18 -40.65 98.14 Favored 'General case' 0 N--CA 1.5 2.072 0 O-C-N 121.695 -0.628 . . . . 0.0 110.488 177.323 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 263' ' ' LEU . . . . . . . . . . . . . 51.5 mt -65.51 -42.63 91.88 Favored 'General case' 0 N--CA 1.501 2.083 0 O-C-N 121.715 -0.615 . . . . 0.0 110.23 179.327 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 264' ' ' LEU . . . . . . . . . . . . . 60.8 mt -62.41 -34.95 77.75 Favored 'General case' 0 N--CA 1.501 2.092 0 O-C-N 121.708 -0.62 . . . . 0.0 110.454 178.053 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 265' ' ' LYS . . . . . . . . . . . . . 51.2 tttm -76.11 -41.15 51.13 Favored 'General case' 0 N--CA 1.498 1.936 0 O-C-N 121.688 -0.632 . . . . 0.0 109.953 179.255 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 266' ' ' SER . . . . . . . . . . . . . 58.3 m 51.5 -174.35 0.02 OUTLIER 'General case' 0 N--CA 1.506 2.347 0 O-C-N 121.775 -0.578 . . . . 0.0 111.326 179.75 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 267' ' ' SER . . . . . . . . . . . . . 95.2 p -136.83 162.84 32.11 Favored 'General case' 0 N--CA 1.495 1.79 0 O-C-N 121.694 -0.629 . . . . 0.0 110.086 179.323 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 268' ' ' THR . . . . . . . . . . . . . 39.3 p -75.33 135.88 40.86 Favored 'General case' 0 N--CA 1.498 1.932 0 O-C-N 121.656 -0.652 . . . . 0.0 110.059 -179.437 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 269' ' ' ALA . . . . . . . . . . . . . . . -170.02 162.2 6.64 Favored Pre-proline 0 N--CA 1.498 1.935 0 O-C-N 121.571 -0.705 . . . . 0.0 109.962 179.761 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 270' ' ' PRO . . . . . . . . . . . . . 17.2 Cg_exo -63.31 126.05 16.97 Favored 'Trans proline' 0 N--CA 1.49 1.284 0 O-C-N 123.603 1.317 . . . . 0.0 110.573 179.473 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 271' ' ' SER . . . . . . . . . . . . . 3.1 m -95.99 -33.36 12.17 Favored 'General case' 0 N--CA 1.496 1.852 0 O-C-N 121.632 -0.667 . . . . 0.0 110.289 179.112 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 272' ' ' ASP . . . . . . . . . . . . . 11.4 p-10 -128.55 -163.75 1.31 Allowed 'General case' 0 N--CA 1.496 1.871 0 O-C-N 121.601 -0.687 . . . . 0.0 110.15 -179.136 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 273' ' ' LEU . . . . . . . . . . . . . 44.4 mt 54.5 101.79 0.01 OUTLIER 'General case' 0 N--CA 1.507 2.392 0 O-C-N 121.71 -0.619 . . . . 0.0 111.297 179.894 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 274' ' ' ALA . . . . . . . . . . . . . . . 55.66 99.46 0.02 OUTLIER 'General case' 0 N--CA 1.505 2.286 0 O-C-N 121.607 -0.683 . . . . 0.0 111.045 179.889 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 275' ' ' THR . . . . . . . . . . . . . 22.5 m -119.88 91.16 44.97 Favored Pre-proline 0 N--CA 1.496 1.825 0 O-C-N 121.814 -0.554 . . . . 0.0 110.001 178.431 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 276' ' ' PRO . . . . . . . . . . . . . 18.5 Cg_endo -64.01 -30.8 66.54 Favored 'Trans proline' 0 N--CA 1.491 1.335 0 O-C-N 123.457 1.24 . . . . 0.0 110.736 -177.589 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 277' ' ' GLN . . . . . . . . . . . . . 50.0 mm-40 -81.56 152.26 69.6 Favored Pre-proline 0 N--CA 1.497 1.884 0 O-C-N 121.624 -0.673 . . . . 0.0 110.088 179.559 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 278' ' ' PRO . . . . . . . . . . . . . 28.4 Cg_endo -67.3 136.17 39.34 Favored 'Trans proline' 0 N--CA 1.487 1.133 0 O-C-N 123.599 1.315 . . . . 0.0 110.365 -179.845 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 279' ' ' SER . . . . . . . . . . . . . 88.6 p -149.47 162.35 40.31 Favored 'General case' 0 N--CA 1.495 1.802 0 O-C-N 121.763 -0.586 . . . . 0.0 110.289 -179.628 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 280' ' ' THR . . . . . . . . . . . . . 9.7 t -134.68 158.19 44.73 Favored 'General case' 0 N--CA 1.497 1.877 0 O-C-N 121.711 -0.618 . . . . 0.0 110.3 179.08 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 281' ' ' PHE . . . . . . . . . . . . . 24.3 p90 -76.92 147.7 77.76 Favored Pre-proline 0 N--CA 1.499 1.991 0 O-C-N 121.624 -0.672 . . . . 0.0 110.109 -179.225 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 282' ' ' PRO . . . . . . . . . . . . . 37.5 Cg_endo -70.62 152.25 64.71 Favored 'Trans proline' 0 N--CA 1.487 1.114 0 O-C-N 123.515 1.271 . . . . 0.0 110.198 179.644 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 283' ' ' GLN . . . . . . . . . . . . . 7.9 mt-30 -89.52 -52.37 0.34 Allowed Pre-proline 0 N--CA 1.499 1.986 0 O-C-N 121.635 -0.666 . . . . 0.0 111.326 -176.312 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 284' ' ' PRO . . . . . 0.417 ' N ' ' CD ' ' B' ' 285' ' ' PRO . 26.9 Cg_exo -54.32 -48.1 23.32 Favored 'Trans proline' 0 N--CA 1.493 1.472 0 O-C-N 123.053 1.028 . . . . 0.0 112.055 -174.439 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 285' ' ' PRO . . . . . 0.417 ' CD ' ' N ' ' B' ' 284' ' ' PRO . 19.8 Cg_exo -62.21 100.62 0.22 Allowed 'Trans proline' 0 N--CA 1.493 1.451 0 O-C-N 123.091 1.048 . . . . 0.0 110.785 -177.65 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 286' ' ' VAL . . . . . . . . . . . . . 57.6 t -70.34 -34.94 60.33 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.099 0 O-C-N 121.717 -0.614 . . . . 0.0 109.647 178.273 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 287' ' ' GLU . . . . . . . . . . . . . 77.6 mt-10 54.06 177.31 0.02 OUTLIER 'General case' 0 N--CA 1.506 2.368 0 O-C-N 121.686 -0.634 . . . . 0.0 111.222 -179.48 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 288' ' ' SER . . . . . . . . . . . . . 3.5 m -99.49 -36.16 9.65 Favored 'General case' 0 N--CA 1.494 1.773 0 O-C-N 121.571 -0.706 . . . . 0.0 110.409 -178.889 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 289' ' ' HIS . . . . . . . . . . . . . 76.9 m80 -115.76 139.02 50.56 Favored 'General case' 0 N--CA 1.496 1.84 0 O-C-N 121.672 -0.643 . . . . 0.0 110.277 -178.165 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 290' ' ' SER . . . . . . . . . . . . . 33.2 t -130.83 142.6 50.4 Favored 'General case' 0 N--CA 1.496 1.844 0 O-C-N 121.765 -0.585 . . . . 0.0 110.123 179.033 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 291' ' ' SER . . . . . . . . . . . . . 3.5 t . . . . . 0 N--CA 1.495 1.814 0 CA-C-O 118.037 -0.983 . . . . 0.0 110.166 -179.925 . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' -1' ' ' MET . . . . . . . . . . . . . 22.9 ttt . . . . . 0 N--CA 1.492 1.649 0 CA-C-O 121.065 0.459 . . . . 0.0 110.257 . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 0' ' ' GLY . . . . . . . . . . . . . . . 91.26 168.03 41.35 Favored Glycine 0 N--CA 1.493 2.478 0 N-CA-C 109.535 -1.426 . . . . 0.0 109.535 -179.875 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 65.6 mtt -136.36 158.67 43.86 Favored 'General case' 0 N--CA 1.495 1.791 0 O-C-N 121.637 -0.919 . . . . 0.0 110.275 179.989 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 70.5 m -101.04 170.58 8.18 Favored 'General case' 0 N--CA 1.494 1.768 0 O-C-N 121.658 -0.651 . . . . 0.0 110.067 178.809 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 51.0 t -64.7 -28.33 44.56 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.207 0 O-C-N 121.625 -0.672 . . . . 0.0 110.245 -179.283 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -56.09 -32.55 64.26 Favored 'General case' 0 N--CA 1.503 2.215 0 O-C-N 121.479 -0.763 . . . . 0.0 110.35 179.609 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 9.7 m-20 -68.8 -35.63 77.25 Favored 'General case' 0 N--CA 1.498 1.958 0 O-C-N 121.862 -0.524 . . . . 0.0 109.932 175.725 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 97.0 m-85 -97.94 10.08 41.17 Favored 'General case' 0 N--CA 1.497 1.891 0 O-C-N 121.723 -0.611 . . . . 0.0 111.24 178.904 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -67.51 128.2 35.56 Favored 'General case' 0 N--CA 1.5 2.047 0 O-C-N 121.294 -0.879 . . . . 0.0 109.927 179.134 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 82.27 -0.33 88.99 Favored Glycine 0 N--CA 1.496 2.694 0 N-CA-C 110.616 -0.994 . . . . 0.0 110.616 -174.976 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 32.0 t -77.17 137.69 39.03 Favored 'General case' 0 N--CA 1.498 1.93 0 O-C-N 121.144 -1.21 . . . . 0.0 110.432 177.599 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 14.6 t-20 -83.96 119.23 24.65 Favored 'General case' 0 N--CA 1.498 1.953 0 O-C-N 121.671 -0.643 . . . . 0.0 109.782 174.642 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 34.6 m -143.01 161.83 17.54 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.811 0 N-CA-C 109.567 -0.531 . . . . 0.0 109.567 -179.854 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . 0.416 ' HA ' ' HA ' ' A' ' 22' ' ' ARG . 35.4 tt0 -109.41 129.59 55.54 Favored 'General case' 0 N--CA 1.493 1.685 0 C-N-CA 119.87 -0.732 . . . . 0.0 110.126 178.448 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 58.9 t -106.74 127.65 62.08 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.772 0 O-C-N 121.68 -0.638 . . . . 0.0 109.827 -179.402 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 28.5 tp -95.86 126.05 40.85 Favored 'General case' 0 N--CA 1.494 1.746 0 N-CA-C 109.077 -0.712 . . . . 0.0 109.077 174.485 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 86.7 mt -96.01 166.93 11.53 Favored 'General case' 0 N--CA 1.495 1.794 0 C-N-CA 120.087 -0.645 . . . . 0.0 111.166 -172.496 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 24.1 p30 -58.4 -21.82 51.82 Favored 'General case' 0 N--CA 1.505 2.323 0 O-C-N 121.82 -0.55 . . . . 0.0 111.668 -177.029 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 42.5 p-10 -92.73 23.45 4.11 Favored 'General case' 0 N--CA 1.498 1.966 0 O-C-N 121.576 -0.703 . . . . 0.0 110.811 -176.041 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 74.4 m-20 58.85 27.29 15.93 Favored 'General case' 0 N--CA 1.507 2.379 0 O-C-N 121.558 -0.714 . . . . 0.0 110.608 175.805 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 50.5 m -106.96 145.44 32.25 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.526 -0.734 . . . . 0.0 109.575 172.831 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 98.1 mttt -109.61 147.72 32.55 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.59 -0.694 . . . . 0.0 110.571 -176.345 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -153.08 153.97 33.91 Favored 'General case' 0 N--CA 1.497 1.911 0 O-C-N 121.796 -0.565 . . . . 0.0 110.254 176.204 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . 0.416 ' HA ' ' HA ' ' A' ' 12' ' ' GLU . 33.0 ptt180 -142.69 150.35 40.04 Favored 'General case' 0 N--CA 1.496 1.842 0 O-C-N 121.648 -0.658 . . . . 0.0 110.308 178.364 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -171.9 171.17 43.98 Favored Glycine 0 N--CA 1.492 2.429 0 N-CA-C 109.167 -1.573 . . . . 0.0 109.167 -179.871 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 45.2 t -94.61 126.65 46.99 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.88 0 O-C-N 121.7 -0.882 . . . . 0.0 109.237 176.363 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 47.7 mt -61.73 138.0 22.94 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.249 0 O-C-N 121.57 -0.706 . . . . 0.0 110.854 -170.373 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 13.2 p -121.24 -19.65 7.0 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.9 -0.5 . . . . 0.0 111.515 -179.937 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 33.0 t30 -165.98 158.18 14.47 Favored 'General case' 0 N--CA 1.504 2.25 0 O-C-N 120.826 -1.172 . . . . 0.0 111.922 176.221 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 65.0 t80 -150.3 120.7 7.37 Favored 'General case' 0 N--CA 1.495 1.818 0 N-CA-C 109.166 -0.679 . . . . 0.0 109.166 173.431 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 17.9 t70 -97.81 127.42 43.75 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.593 -0.692 . . . . 0.0 109.212 -177.713 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 22.1 m -66.41 -46.53 76.24 Favored 'General case' 0 N--CA 1.499 2.0 0 O-C-N 121.524 -0.735 . . . . 0.0 110.772 -175.174 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 21.1 m -58.92 -47.36 85.3 Favored 'General case' 0 N--CA 1.502 2.174 0 O-C-N 121.602 -0.686 . . . . 0.0 110.957 -173.796 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 92.4 m-20 -106.29 -3.22 21.45 Favored 'General case' 0 N--CA 1.497 1.889 0 O-C-N 121.536 -0.727 . . . . 0.0 111.711 -178.188 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 15.3 m 49.14 67.15 0.92 Allowed 'General case' 0 N--CA 1.507 2.419 0 O-C-N 121.049 -1.032 . . . . 0.0 110.907 -174.314 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 43.7 mm -114.64 125.78 72.04 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.936 0 O-C-N 121.545 -0.722 . . . . 0.0 109.21 -175.55 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 14.5 tp -115.98 119.03 34.6 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.609 -0.682 . . . . 0.0 110.47 -169.858 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 55.4 mt-30 -91.04 131.94 36.32 Favored 'General case' 0 N--CA 1.491 1.593 0 N-CA-C 109.182 -0.673 . . . . 0.0 109.182 170.838 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 49.4 mt -117.73 123.49 46.17 Favored 'General case' 0 N--CA 1.493 1.707 0 C-N-CA 120.177 -0.609 . . . . 0.0 110.041 175.926 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 57.2 ttt85 -105.0 104.95 14.78 Favored 'General case' 0 N--CA 1.495 1.782 0 O-C-N 121.77 -0.582 . . . . 0.0 110.076 173.877 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 65.3 tp -83.29 157.23 22.71 Favored 'General case' 0 N--CA 1.497 1.923 0 O-C-N 121.626 -0.671 . . . . 0.0 110.669 -176.344 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -67.89 -2.94 8.28 Favored 'General case' 0 N--CA 1.503 2.193 0 O-C-N 121.823 -0.548 . . . . 0.0 112.208 -170.819 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 29.9 m120 -86.63 29.21 0.8 Allowed 'General case' 0 N--CA 1.498 1.971 0 O-C-N 121.05 -1.031 . . . . 0.0 110.789 173.591 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 73.7 m-20 60.33 31.47 20.42 Favored 'General case' 0 N--CA 1.506 2.334 0 O-C-N 121.164 -0.96 . . . . 0.0 110.258 175.699 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 68.1 m -126.05 144.72 50.61 Favored 'General case' 0 N--CA 1.494 1.755 0 O-C-N 121.477 -0.765 . . . . 0.0 110.112 177.873 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 9.8 t -128.17 147.82 50.58 Favored 'General case' 0 N--CA 1.496 1.828 0 O-C-N 121.653 -0.654 . . . . 0.0 109.919 179.604 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 6.0 ttpm? -150.38 130.04 13.15 Favored 'General case' 0 N--CA 1.495 1.82 0 O-C-N 121.716 -0.615 . . . . 0.0 110.505 -177.369 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 88.5 p -95.89 123.47 39.49 Favored 'General case' 0 N--CA 1.494 1.77 0 O-C-N 121.683 -0.635 . . . . 0.0 110.396 179.748 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 80.6 mt -129.31 138.25 54.86 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.889 0 N-CA-C 109.19 -0.67 . . . . 0.0 109.19 177.647 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 67.9 t -82.05 127.65 39.43 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.876 0 O-C-N 121.6 -0.687 . . . . 0.0 109.183 177.766 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 47.3 p -58.13 -24.92 60.59 Favored 'General case' 0 N--CA 1.505 2.283 0 O-C-N 121.539 -0.726 . . . . 0.0 111.964 -169.142 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 31.5 tttp -56.92 -26.87 60.17 Favored 'General case' 0 N--CA 1.502 2.131 0 O-C-N 121.529 -0.732 . . . . 0.0 110.963 -177.08 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 4.7 p30 -85.21 7.37 22.23 Favored 'General case' 0 N--CA 1.499 1.99 0 C-N-CA 119.677 -0.809 . . . . 0.0 111.353 176.538 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 98.2 mt -75.04 125.59 34.78 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.111 0 O-C-N 121.119 -0.988 . . . . 0.0 109.878 175.186 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 50.4 tttm -92.16 -31.34 15.52 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.812 -0.555 . . . . 0.0 109.718 170.68 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -161.11 153.38 20.17 Favored 'General case' 0 N--CA 1.499 1.991 0 O-C-N 121.699 -0.626 . . . . 0.0 110.072 -176.418 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 85.2 mt -132.92 149.92 52.2 Favored 'General case' 0 N--CA 1.497 1.925 0 O-C-N 121.745 -0.597 . . . . 0.0 110.523 -179.311 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 4.9 ptm180 -152.27 140.86 20.79 Favored 'General case' 0 N--CA 1.496 1.869 0 O-C-N 121.783 -0.573 . . . . 0.0 109.856 175.118 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 59.3 mt -85.28 133.3 29.73 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.863 0 O-C-N 121.428 -0.795 . . . . 0.0 109.856 174.667 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 83.1 mt -82.87 159.92 62.07 Favored Pre-proline 0 N--CA 1.498 1.942 0 O-C-N 121.631 -0.668 . . . . 0.0 110.051 -179.09 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 19.6 Cg_endo -64.53 145.29 87.21 Favored 'Trans proline' 0 N--CA 1.489 1.233 0 O-C-N 123.64 1.337 . . . . 0.0 110.563 -178.699 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 18.9 tptm -125.55 148.55 48.87 Favored 'General case' 0 N--CA 1.496 1.855 0 O-C-N 121.72 -0.612 . . . . 0.0 110.164 -179.775 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 37.0 t30 -90.15 134.34 34.34 Favored 'General case' 0 N--CA 1.496 1.845 0 O-C-N 121.603 -0.686 . . . . 0.0 110.21 -179.306 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 75.0 mm-40 -97.66 177.88 5.34 Favored 'General case' 0 N--CA 1.496 1.835 0 O-C-N 121.656 -0.652 . . . . 0.0 110.166 -179.638 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 16.2 tt -138.94 64.26 0.21 Allowed 'Isoleucine or valine' 0 N--CA 1.497 1.916 0 O-C-N 121.719 -0.613 . . . . 0.0 110.211 -179.148 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 64' ' ' MET . . . . . . . . . . . . . 2.9 ptt? 37.25 54.1 3.12 Favored Pre-proline 0 N--CA 1.513 2.692 0 N-CA-C 112.709 0.633 . . . . 0.0 112.709 179.153 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 23.3 Cg_endo -65.47 -30.5 52.52 Favored 'Trans proline' 0 N--CA 1.49 1.265 0 O-C-N 123.393 1.207 . . . . 0.0 110.602 -179.761 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 27.0 mtpp -91.23 156.0 18.15 Favored 'General case' 0 N--CA 1.496 1.842 0 O-C-N 121.595 -0.691 . . . . 0.0 110.153 179.917 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 17.0 t-20 -94.61 130.48 41.04 Favored 'General case' 0 N--CA 1.496 1.836 0 O-C-N 121.691 -0.63 . . . . 0.0 110.261 -179.042 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 81.48 33.46 28.14 Favored Glycine 0 N--CA 1.495 2.598 0 N-CA-C 109.714 -1.354 . . . . 0.0 109.714 179.872 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 24.7 m -128.96 137.12 51.19 Favored 'General case' 0 N--CA 1.495 1.796 0 O-C-N 121.653 -0.91 . . . . 0.0 110.097 179.444 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 53.8 mttp -111.45 117.54 33.34 Favored 'General case' 0 N--CA 1.496 1.843 0 O-C-N 121.714 -0.616 . . . . 0.0 110.218 179.787 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -77.15 -56.43 1.24 Allowed Pre-proline 0 N--CA 1.496 1.867 0 O-C-N 121.696 -0.628 . . . . 0.0 110.626 179.265 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 38.0 Cg_endo -72.41 154.89 55.87 Favored 'Trans proline' 0 N--CA 1.486 1.062 0 O-C-N 123.337 1.177 . . . . 0.0 110.376 -177.756 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 23.0 t -64.34 -33.02 74.87 Favored 'General case' 0 N--CA 1.502 2.142 0 O-C-N 121.685 -0.634 . . . . 0.0 110.418 179.751 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 10.0 t -130.74 152.74 49.76 Favored 'General case' 0 N--CA 1.496 1.828 0 O-C-N 121.673 -0.642 . . . . 0.0 110.366 179.718 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 12.6 t-20 -117.66 115.66 25.52 Favored 'General case' 0 N--CA 1.495 1.819 0 O-C-N 121.739 -0.601 . . . . 0.0 110.104 -179.554 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 30.3 t -122.05 120.41 34.25 Favored 'General case' 0 N--CA 1.496 1.835 0 O-C-N 121.716 -0.615 . . . . 0.0 110.259 -179.928 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 69.6 p 44.25 30.26 0.44 Allowed 'General case' 0 N--CA 1.51 2.563 0 CA-C-O 120.972 0.415 . . . . 0.0 111.969 177.975 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 18.6 tptm -68.83 -44.81 72.67 Favored 'General case' 0 N--CA 1.498 1.97 0 O-C-N 121.531 -0.731 . . . . 0.0 110.117 -179.388 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 82.8 mt -110.21 134.56 52.1 Favored 'General case' 0 N--CA 1.496 1.853 0 O-C-N 121.651 -0.655 . . . . 0.0 110.254 -179.924 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 52.4 pttt -65.42 -32.12 73.58 Favored 'General case' 0 N--CA 1.498 1.971 0 O-C-N 121.599 -0.688 . . . . 0.0 110.653 179.631 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 23.4 t -63.86 -37.8 88.73 Favored 'General case' 0 N--CA 1.502 2.141 0 O-C-N 121.662 -0.649 . . . . 0.0 110.503 -178.838 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -113.14 29.98 7.56 Favored 'General case' 0 N--CA 1.496 1.849 0 O-C-N 121.659 -0.65 . . . . 0.0 110.484 179.931 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 41.1 tt0 -69.56 -38.08 77.27 Favored 'General case' 0 N--CA 1.499 2.001 0 O-C-N 121.583 -0.698 . . . . 0.0 110.167 -179.968 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 42.0 p -77.88 -35.57 50.71 Favored 'General case' 0 N--CA 1.498 1.966 0 O-C-N 121.677 -0.64 . . . . 0.0 110.351 -179.034 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 99.1 m-85 -121.64 132.46 54.67 Favored 'General case' 0 N--CA 1.496 1.847 0 O-C-N 121.696 -0.627 . . . . 0.0 110.314 -179.568 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 11.3 t -101.03 -51.88 3.42 Favored 'General case' 0 N--CA 1.494 1.768 0 O-C-N 121.737 -0.602 . . . . 0.0 110.233 178.906 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 50.4 m -129.4 147.6 51.23 Favored 'General case' 0 N--CA 1.496 1.865 0 O-C-N 121.718 -0.614 . . . . 0.0 110.185 179.562 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 25.3 mmmt -127.37 144.1 51.11 Favored 'General case' 0 N--CA 1.496 1.859 0 O-C-N 121.672 -0.643 . . . . 0.0 110.163 179.704 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 29.8 m120 -106.38 119.95 40.6 Favored 'General case' 0 N--CA 1.495 1.813 0 O-C-N 121.677 -0.639 . . . . 0.0 110.1 179.276 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 52.4 mttp -94.75 -68.97 0.77 Allowed 'General case' 0 N--CA 1.495 1.795 0 O-C-N 121.719 -0.613 . . . . 0.0 110.321 -179.263 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 91' ' ' TRP . . . . . . . . . . . . . 86.6 t90 -133.33 133.21 42.23 Favored 'General case' 0 N--CA 1.495 1.777 0 O-C-N 121.525 -0.734 . . . . 0.0 110.269 -179.185 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 3.7 m -151.24 -70.84 0.17 Allowed 'General case' 0 N--CA 1.495 1.786 0 O-C-N 121.729 -0.607 . . . . 0.0 110.119 178.355 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 93' ' ' MET . . . . . . . . . . . . . 89.1 mmm -70.98 -38.77 72.75 Favored 'General case' 0 N--CA 1.499 2.005 0 O-C-N 121.63 -0.669 . . . . 0.0 110.087 178.966 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 2.6 p30 . . . . . 0 N--CA 1.498 1.952 0 CA-C-O 118.078 -0.963 . . . . 0.0 110.219 -179.659 . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' B' B ' 240' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.267 0 N-CA-C 109.532 -1.427 . . . . 0.0 109.532 . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' B' B ' 241' ' ' ALA . . . . . . . . . . . . . . . -148.02 157.99 43.81 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.692 -0.887 . . . . 0.0 110.262 -179.995 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 242' ' ' THR . . . . . . . . . . . . . 51.5 p -127.11 158.02 38.13 Favored 'General case' 0 N--CA 1.496 1.871 0 O-C-N 121.613 -0.679 . . . . 0.0 110.181 -179.847 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 243' ' ' THR . . . . . . . . . . . . . 15.5 m 51.84 29.85 6.42 Favored 'General case' 0 N--CA 1.506 2.345 0 O-C-N 121.655 -0.653 . . . . 0.0 111.197 -179.518 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 244' ' ' LYS . . . . . . . . . . . . . 17.0 ttmm -112.27 -48.73 3.01 Favored 'General case' 0 N--CA 1.496 1.834 0 O-C-N 121.641 -0.662 . . . . 0.0 110.202 179.669 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 245' ' ' GLU . . . . . . . . . . . . . 45.7 tt0 -100.84 140.39 35.19 Favored 'General case' 0 N--CA 1.494 1.757 0 O-C-N 121.721 -0.612 . . . . 0.0 110.227 -179.446 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 246' ' ' LYS . . . . . . . . . . . . . 72.5 tttt -92.49 140.42 29.59 Favored 'General case' 0 N--CA 1.495 1.812 0 O-C-N 121.718 -0.614 . . . . 0.0 110.146 179.76 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 247' ' ' ASN . . . . . . . . . . . . . 17.4 t-20 -94.4 114.76 26.85 Favored 'General case' 0 N--CA 1.495 1.821 0 O-C-N 121.738 -0.601 . . . . 0.0 110.165 -179.801 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 248' ' ' ILE . . . . . . . . . . . . . 7.1 tp -163.48 -40.24 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.498 1.951 0 O-C-N 121.692 -0.63 . . . . 0.0 110.502 -179.585 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 249' ' ' SER . . . . . . . . . . . . . 87.0 p -69.18 170.71 9.59 Favored 'General case' 0 N--CA 1.498 1.964 0 O-C-N 121.516 -0.74 . . . . 0.0 110.245 -179.984 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 250' ' ' VAL . . . . . . . . . . . . . 28.6 m -149.02 161.23 5.26 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.98 0 O-C-N 121.658 -0.651 . . . . 0.0 109.989 -179.466 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 251' ' ' ASP . . . . . . . . . . . . . 74.5 m-20 52.3 -176.93 0.02 OUTLIER 'General case' 0 N--CA 1.506 2.366 0 O-C-N 121.614 -0.679 . . . . 0.0 111.195 -179.028 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 252' ' ' VAL . . . . . . . . . . . . . 42.3 t 57.54 165.46 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.51 2.569 0 O-C-N 121.767 -0.583 . . . . 0.0 110.718 -179.008 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 253' ' ' ASP . . . . . . . . . . . . . 11.4 p-10 -162.28 146.03 11.89 Favored 'General case' 0 N--CA 1.497 1.879 0 O-C-N 121.383 -0.823 . . . . 0.0 110.42 178.506 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 254' ' ' ALA . . . . . . . . . . . . . . . -67.49 -27.92 67.41 Favored 'General case' 0 N--CA 1.499 2.016 0 O-C-N 121.684 -0.635 . . . . 0.0 110.781 -179.398 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 255' ' ' ASP . . . . . . . . . . . . . 26.1 t0 -71.24 -32.33 68.64 Favored 'General case' 0 N--CA 1.498 1.972 0 O-C-N 121.542 -0.724 . . . . 0.0 110.306 -177.362 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 256' ' ' ALA . . . . . . . . . . . . . . . -64.26 -47.13 80.76 Favored 'General case' 0 N--CA 1.5 2.07 0 O-C-N 121.563 -0.711 . . . . 0.0 110.353 179.896 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 257' ' ' SER . . . . . . . . . . . . . 49.0 m -55.64 -35.76 66.29 Favored 'General case' 0 N--CA 1.503 2.21 0 O-C-N 121.678 -0.639 . . . . 0.0 110.482 178.181 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 258' ' ' SER . . . . . . . . . . . . . 25.1 m -69.29 -31.79 70.52 Favored 'General case' 0 N--CA 1.497 1.892 0 O-C-N 121.864 -0.523 . . . . 0.0 110.351 -179.937 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 259' ' ' GLN . . . . . . . . . . . . . 58.2 tp60 -62.65 -40.04 95.78 Favored 'General case' 0 N--CA 1.501 2.1 0 O-C-N 121.601 -0.687 . . . . 0.0 110.494 -178.665 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 260' ' ' LEU . . . . . . . . . . . . . 82.8 mt -68.83 -43.04 76.36 Favored 'General case' 0 N--CA 1.499 1.996 0 O-C-N 121.691 -0.631 . . . . 0.0 110.293 179.958 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 261' ' ' LEU . . . . . . . . . . . . . 17.6 tp -69.24 -36.22 76.94 Favored 'General case' 0 N--CA 1.498 1.941 0 O-C-N 121.586 -0.696 . . . . 0.0 109.768 177.87 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 262' ' ' SER . . . . . . . . . . . . . 22.7 t -62.33 -37.33 85.22 Favored 'General case' 0 N--CA 1.501 2.105 0 O-C-N 121.762 -0.586 . . . . 0.0 110.424 176.864 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 263' ' ' LEU . . . . . . . . . . . . . 33.0 mt -64.93 -41.72 95.3 Favored 'General case' 0 N--CA 1.5 2.068 0 O-C-N 121.726 -0.609 . . . . 0.0 110.31 179.552 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 264' ' ' LEU . . . . . . . . . . . . . 86.4 mt -62.05 -33.4 74.31 Favored 'General case' 0 N--CA 1.503 2.182 0 O-C-N 121.671 -0.643 . . . . 0.0 110.49 177.261 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 265' ' ' LYS . . . . . . . . . . . . . 79.5 mttt -75.17 -29.71 60.51 Favored 'General case' 0 N--CA 1.499 2.004 0 O-C-N 121.663 -0.648 . . . . 0.0 110.51 179.615 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 266' ' ' SER . . . . . . . . . . . . . 83.6 p -77.46 158.37 30.02 Favored 'General case' 0 N--CA 1.497 1.913 0 O-C-N 121.521 -0.737 . . . . 0.0 110.157 -179.824 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 267' ' ' SER . . . . . . . . . . . . . 10.5 t -92.69 -41.5 10.13 Favored 'General case' 0 N--CA 1.495 1.805 0 O-C-N 121.689 -0.632 . . . . 0.0 110.446 -178.155 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 268' ' ' THR . . . . . . . . . . . . . 39.9 p -126.82 151.17 48.66 Favored 'General case' 0 N--CA 1.496 1.835 0 O-C-N 121.636 -0.665 . . . . 0.0 110.323 -179.355 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 269' ' ' ALA . . . . . . . . . . . . . . . -72.89 159.75 84.56 Favored Pre-proline 0 N--CA 1.498 1.953 0 C-N-CA 120.351 -0.54 . . . . 0.0 110.095 178.762 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 270' ' ' PRO . . . . . . . . . . . . . 20.7 Cg_exo -61.73 -32.55 86.51 Favored 'Trans proline' 0 N--CA 1.492 1.387 0 O-C-N 123.627 1.33 . . . . 0.0 110.654 178.986 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 271' ' ' SER . . . . . . . . . . . . . 50.0 m -126.11 150.38 48.25 Favored 'General case' 0 N--CA 1.496 1.86 0 O-C-N 121.736 -0.603 . . . . 0.0 110.229 179.969 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 272' ' ' ASP . . . . . . . . . . . . . 74.4 m-20 -70.67 143.18 51.46 Favored 'General case' 0 N--CA 1.498 1.97 0 O-C-N 121.711 -0.618 . . . . 0.0 110.107 179.413 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 273' ' ' LEU . . . . . . . . . . . . . 83.1 mt 56.48 -82.74 0.01 OUTLIER 'General case' 0 N--CA 1.506 2.352 0 O-C-N 121.943 -0.473 . . . . 0.0 111.279 -178.574 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 274' ' ' ALA . . . . . . . . . . . . . . . 51.84 36.52 18.28 Favored 'General case' 0 N--CA 1.506 2.362 0 O-C-N 121.16 -0.963 . . . . 0.0 111.017 -178.755 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 275' ' ' THR . . . . . . . . . . . . . 22.6 p -125.01 78.51 66.18 Favored Pre-proline 0 N--CA 1.495 1.821 0 O-C-N 121.567 -0.708 . . . . 0.0 110.127 179.355 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 276' ' ' PRO . . . . . . . . . . . . . 29.4 Cg_endo -67.82 155.46 69.78 Favored 'Trans proline' 0 N--CA 1.487 1.113 0 O-C-N 123.486 1.256 . . . . 0.0 110.412 179.672 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 277' ' ' GLN . . . . . . . . . . . . . 34.1 mt-30 -86.9 162.44 44.22 Favored Pre-proline 0 N--CA 1.497 1.895 0 O-C-N 121.689 -0.632 . . . . 0.0 110.134 179.662 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 278' ' ' PRO . . . . . . . . . . . . . 25.2 Cg_endo -66.35 138.85 52.33 Favored 'Trans proline' 0 N--CA 1.488 1.173 0 O-C-N 123.622 1.327 . . . . 0.0 110.415 -179.339 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 279' ' ' SER . . . . . . . . . . . . . 24.7 m -66.4 -34.12 77.24 Favored 'General case' 0 N--CA 1.499 2.008 0 O-C-N 121.661 -0.65 . . . . 0.0 110.313 -179.957 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 280' ' ' THR . . . . . . . . . . . . . 9.7 t -135.39 161.87 34.21 Favored 'General case' 0 N--CA 1.496 1.866 0 O-C-N 121.67 -0.644 . . . . 0.0 110.419 -179.292 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 281' ' ' PHE . . . . . . . . . . . . . 17.1 p90 -68.41 154.9 93.68 Favored Pre-proline 0 N--CA 1.498 1.97 0 O-C-N 121.722 -0.611 . . . . 0.0 110.25 179.818 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 282' ' ' PRO . . . . . . . . . . . . . 28.7 Cg_endo -67.26 -43.82 5.66 Favored 'Trans proline' 0 N--CA 1.488 1.196 0 O-C-N 123.711 1.374 . . . . 0.0 110.477 -179.322 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 283' ' ' GLN . . . . . . . . . . . . . 15.6 mt-30 -141.58 160.14 57.71 Favored Pre-proline 0 N--CA 1.494 1.762 0 O-C-N 121.652 -0.655 . . . . 0.0 110.211 179.681 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 284' ' ' PRO . . . . . . . . . . . . . 15.9 Cg_exo -64.32 154.87 68.87 Favored 'Trans proline' 0 N--CA 1.488 1.201 0 O-C-N 123.591 1.311 . . . . 0.0 110.536 -179.807 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 285' ' ' PRO . . . . . . . . . . . . . 33.0 Cg_endo -69.22 173.9 9.81 Favored 'Trans proline' 0 N--CA 1.488 1.193 0 O-C-N 123.713 1.375 . . . . 0.0 110.243 178.8 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 286' ' ' VAL . . . . . . . . . . . . . 13.4 p -128.0 137.34 57.8 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.885 0 O-C-N 121.731 -0.606 . . . . 0.0 110.107 179.617 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 287' ' ' GLU . . . . . . . . . . . . . 46.3 mt-10 -71.95 -36.54 69.91 Favored 'General case' 0 N--CA 1.499 2.018 0 O-C-N 121.645 -0.66 . . . . 0.0 110.359 -178.594 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 288' ' ' SER . . . . . . . . . . . . . 30.8 t -110.91 143.72 41.1 Favored 'General case' 0 N--CA 1.495 1.823 0 O-C-N 121.61 -0.681 . . . . 0.0 110.297 -178.676 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 289' ' ' HIS . . . . . . . . . . . . . 30.5 p80 -125.12 152.21 44.71 Favored 'General case' 0 N--CA 1.495 1.814 0 O-C-N 121.744 -0.597 . . . . 0.0 110.228 179.757 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 290' ' ' SER . . . . . . . . . . . . . 38.7 t 52.22 30.38 7.75 Favored 'General case' 0 N--CA 1.505 2.325 0 O-C-N 121.599 -0.688 . . . . 0.0 111.088 -179.637 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 291' ' ' SER . . . . . . . . . . . . . 29.5 t . . . . . 0 N--CA 1.494 1.765 0 CA-C-O 117.957 -1.021 . . . . 0.0 110.231 -179.819 . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' -1' ' ' MET . . . . . . . . . . . . . 61.1 mtt . . . . . 0 N--CA 1.493 1.678 0 CA-C-O 121.02 0.438 . . . . 0.0 110.213 . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 0' ' ' GLY . . . . . . . . . . . . . . . -85.09 -176.88 50.83 Favored Glycine 0 N--CA 1.493 2.49 0 N-CA-C 109.612 -1.395 . . . . 0.0 109.612 -179.923 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 24.8 ptm -124.02 52.25 1.48 Allowed 'General case' 0 N--CA 1.498 1.965 0 O-C-N 121.643 -0.916 . . . . 0.0 110.2 179.86 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 73.1 m -97.39 175.83 6.11 Favored 'General case' 0 N--CA 1.494 1.751 0 O-C-N 121.611 -0.681 . . . . 0.0 110.285 -178.387 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 83.2 t -67.74 -27.64 38.78 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.095 0 O-C-N 121.754 -0.591 . . . . 0.0 110.251 -179.407 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -54.99 -30.33 59.12 Favored 'General case' 0 N--CA 1.505 2.281 0 O-C-N 121.446 -0.783 . . . . 0.0 110.533 -178.196 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 74.5 m-20 -68.74 -30.69 69.36 Favored 'General case' 0 N--CA 1.499 1.998 0 O-C-N 121.82 -0.55 . . . . 0.0 110.298 174.859 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 96.0 m-85 -95.59 10.03 38.14 Favored 'General case' 0 N--CA 1.497 1.903 0 O-C-N 121.538 -0.726 . . . . 0.0 111.485 -178.24 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 3.6 m-30 -67.3 138.6 56.95 Favored 'General case' 0 N--CA 1.501 2.095 0 O-C-N 121.154 -0.966 . . . . 0.0 110.166 174.27 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 83.3 -2.27 87.35 Favored Glycine 0 N--CA 1.498 2.8 0 N-CA-C 110.757 -0.937 . . . . 0.0 110.757 -177.289 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 27.7 t -76.24 138.2 40.44 Favored 'General case' 0 N--CA 1.497 1.878 0 O-C-N 121.117 -1.225 . . . . 0.0 110.446 179.581 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 2.5 m120 -83.4 118.37 23.67 Favored 'General case' 0 N--CA 1.498 1.937 0 O-C-N 121.629 -0.669 . . . . 0.0 109.411 173.882 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 35.2 m -143.21 161.0 17.42 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.836 0 O-C-N 121.812 -0.555 . . . . 0.0 109.638 -178.361 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . 0.4 ' HA ' ' HA ' ' A' ' 22' ' ' ARG . 40.6 tt0 -109.48 126.02 53.08 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.481 -0.762 . . . . 0.0 110.111 178.075 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 60.0 t -106.81 124.4 62.44 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.782 0 O-C-N 121.663 -0.648 . . . . 0.0 110.005 -178.521 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 21.9 tp -95.96 129.27 43.26 Favored 'General case' 0 N--CA 1.494 1.758 0 O-C-N 121.697 -0.627 . . . . 0.0 109.495 174.073 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 85.9 mt -98.86 167.24 10.88 Favored 'General case' 0 N--CA 1.495 1.803 0 O-C-N 121.607 -0.683 . . . . 0.0 111.052 -172.75 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 9.6 p30 -57.95 -22.35 48.63 Favored 'General case' 0 N--CA 1.505 2.313 0 O-C-N 121.832 -0.543 . . . . 0.0 111.555 -177.412 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 43.5 p-10 -92.46 23.28 4.05 Favored 'General case' 0 N--CA 1.498 1.97 0 O-C-N 121.428 -0.795 . . . . 0.0 110.847 -176.823 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 58.77 27.83 16.52 Favored 'General case' 0 N--CA 1.505 2.279 0 O-C-N 121.498 -0.751 . . . . 0.0 110.714 175.194 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 50.8 m -105.54 133.98 49.4 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.531 -0.731 . . . . 0.0 109.542 171.754 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 33.0 ttmt -109.81 141.86 41.88 Favored 'General case' 0 N--CA 1.495 1.799 0 O-C-N 121.714 -0.616 . . . . 0.0 110.46 -176.044 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -153.12 156.09 37.99 Favored 'General case' 0 N--CA 1.496 1.836 0 O-C-N 121.625 -0.672 . . . . 0.0 110.267 178.941 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . 0.4 ' HA ' ' HA ' ' A' ' 12' ' ' GLU . 31.1 ptt180 -140.55 146.58 38.25 Favored 'General case' 0 N--CA 1.497 1.9 0 O-C-N 121.623 -0.673 . . . . 0.0 110.558 179.832 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -171.73 171.48 44.11 Favored Glycine 0 N--CA 1.495 2.589 0 N-CA-C 108.829 -1.709 . . . . 0.0 108.829 -175.132 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 39.8 t -94.56 120.54 44.13 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.874 0 O-C-N 121.419 -1.048 . . . . 0.0 109.309 -175.904 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 75.2 mt -64.31 141.98 17.47 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.102 0 O-C-N 121.545 -0.722 . . . . 0.0 110.402 -172.093 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 5.7 p -121.26 -26.44 5.06 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.653 -0.654 . . . . 0.0 111.345 -179.949 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 2.1 t-20 -162.09 160.41 27.34 Favored 'General case' 0 N--CA 1.5 2.053 0 C-N-CA 118.877 -1.129 . . . . 0.0 111.872 -179.244 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 85.0 t80 -150.01 126.57 10.9 Favored 'General case' 0 N--CA 1.497 1.904 0 N-CA-C 109.116 -0.698 . . . . 0.0 109.116 169.436 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 26.7 t0 -99.77 130.4 45.97 Favored 'General case' 0 N--CA 1.491 1.599 0 N-CA-C 109.064 -0.717 . . . . 0.0 109.064 -177.019 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 22.8 t -68.85 -50.15 52.39 Favored 'General case' 0 N--CA 1.498 1.962 0 C-N-CA 120.037 -0.665 . . . . 0.0 110.597 -176.662 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 19.8 m -59.7 -42.55 93.26 Favored 'General case' 0 N--CA 1.502 2.146 0 O-C-N 121.614 -0.679 . . . . 0.0 110.915 -174.366 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 91.4 m-20 -103.97 -10.08 18.38 Favored 'General case' 0 N--CA 1.497 1.921 0 O-C-N 121.565 -0.709 . . . . 0.0 111.66 -178.136 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 3.0 m 50.09 67.21 0.95 Allowed 'General case' 0 N--CA 1.508 2.443 0 O-C-N 121.0 -1.062 . . . . 0.0 110.943 -174.345 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 47.4 mm -124.72 126.95 72.36 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.072 0 O-C-N 121.541 -0.724 . . . . 0.0 109.469 -175.711 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 11.7 tp -115.78 120.57 39.73 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.675 -0.641 . . . . 0.0 110.501 -169.851 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 99.1 mt-30 -91.06 134.66 34.33 Favored 'General case' 0 N--CA 1.491 1.607 0 N-CA-C 109.39 -0.596 . . . . 0.0 109.39 174.24 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 88.8 mt -117.87 123.8 46.75 Favored 'General case' 0 N--CA 1.497 1.915 0 O-C-N 121.772 -0.58 . . . . 0.0 109.896 173.527 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 73.3 ttt-85 -97.11 109.09 21.91 Favored 'General case' 0 N--CA 1.497 1.877 0 O-C-N 121.699 -0.626 . . . . 0.0 109.8 175.863 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 17.6 tp -85.07 150.63 24.73 Favored 'General case' 0 N--CA 1.494 1.774 0 O-C-N 121.706 -0.621 . . . . 0.0 110.928 -173.91 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -62.3 -10.39 10.86 Favored 'General case' 0 N--CA 1.504 2.233 0 O-C-N 121.907 -0.495 . . . . 0.0 111.892 -173.059 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 39.7 t30 -85.16 29.14 0.67 Allowed 'General case' 0 N--CA 1.499 2.008 0 O-C-N 121.151 -0.968 . . . . 0.0 110.94 174.651 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 74.3 m-20 59.68 31.69 21.03 Favored 'General case' 0 N--CA 1.505 2.307 0 O-C-N 121.213 -0.929 . . . . 0.0 110.424 174.031 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 52.2 m -123.3 137.91 54.74 Favored 'General case' 0 N--CA 1.495 1.797 0 O-C-N 121.413 -0.805 . . . . 0.0 110.348 178.609 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 8.9 t -98.06 149.5 22.42 Favored 'General case' 0 N--CA 1.497 1.902 0 O-C-N 121.694 -0.629 . . . . 0.0 110.274 176.937 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 78.0 tttt -149.72 119.16 6.89 Favored 'General case' 0 N--CA 1.495 1.805 0 O-C-N 121.577 -0.702 . . . . 0.0 110.33 177.897 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 88.7 p -95.52 123.98 39.33 Favored 'General case' 0 N--CA 1.494 1.767 0 O-C-N 121.673 -0.642 . . . . 0.0 110.24 179.009 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 81.4 mt -129.35 135.3 62.05 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.838 0 O-C-N 121.621 -0.674 . . . . 0.0 109.311 179.555 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 59.7 t -82.21 127.59 39.49 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.883 0 O-C-N 121.581 -0.699 . . . . 0.0 109.265 179.122 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 37.7 p -59.21 -24.95 63.57 Favored 'General case' 0 N--CA 1.504 2.25 0 O-C-N 121.611 -0.681 . . . . 0.0 112.06 -169.721 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 57.9 mttm -56.55 -22.91 36.5 Favored 'General case' 0 N--CA 1.503 2.213 0 O-C-N 121.466 -0.771 . . . . 0.0 110.991 -176.833 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 51.0 p30 -83.98 1.26 44.49 Favored 'General case' 0 N--CA 1.499 1.995 0 O-C-N 121.406 -0.809 . . . . 0.0 111.288 176.376 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 99.0 mt -75.63 126.66 36.63 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.066 0 O-C-N 121.171 -0.956 . . . . 0.0 110.042 178.883 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 37.6 ttpt -93.08 -29.27 15.88 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.851 -0.53 . . . . 0.0 109.893 170.562 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 5.1 m-20 -164.07 155.86 16.57 Favored 'General case' 0 N--CA 1.5 2.056 0 O-C-N 121.748 -0.595 . . . . 0.0 109.952 -178.251 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 82.7 mt -132.89 149.69 52.23 Favored 'General case' 0 N--CA 1.496 1.849 0 O-C-N 121.645 -0.659 . . . . 0.0 110.62 -178.804 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 9.5 ptp85 -151.43 144.55 24.63 Favored 'General case' 0 N--CA 1.496 1.838 0 O-C-N 121.71 -0.619 . . . . 0.0 110.083 174.438 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 66.6 mt -86.33 133.16 30.43 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.745 0 O-C-N 121.523 -0.736 . . . . 0.0 109.66 171.697 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 61.8 mt -83.05 138.29 42.78 Favored Pre-proline 0 N--CA 1.497 1.884 0 O-C-N 121.626 -0.671 . . . . 0.0 109.981 -179.781 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 32.3 Cg_endo -68.54 -32.49 24.62 Favored 'Trans proline' 0 N--CA 1.489 1.23 0 O-C-N 123.511 1.269 . . . . 0.0 110.512 -178.995 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 18.3 tptm -84.29 134.75 34.51 Favored 'General case' 0 N--CA 1.497 1.891 0 O-C-N 121.644 -0.66 . . . . 0.0 110.237 -178.881 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 24.3 p30 -140.3 -175.69 4.35 Favored 'General case' 0 N--CA 1.496 1.858 0 O-C-N 121.708 -0.62 . . . . 0.0 110.323 179.728 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 29.9 tp10 -95.16 139.37 31.6 Favored 'General case' 0 N--CA 1.495 1.785 0 O-C-N 121.662 -0.649 . . . . 0.0 110.155 -179.931 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 7.5 tp -68.96 137.69 23.82 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.949 0 O-C-N 121.697 -0.627 . . . . 0.0 110.191 -179.732 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 64' ' ' MET . . . . . . . . . . . . . 2.0 ttt -161.73 90.25 1.46 Allowed Pre-proline 0 N--CA 1.496 1.835 0 O-C-N 121.773 -0.58 . . . . 0.0 110.069 -179.741 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 18.7 Cg_exo -62.67 140.22 79.66 Favored 'Trans proline' 0 N--CA 1.489 1.263 0 O-C-N 123.543 1.286 . . . . 0.0 110.608 179.645 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 32.1 ttmt -159.7 33.07 0.19 Allowed 'General case' 0 N--CA 1.494 1.769 0 O-C-N 121.661 -0.649 . . . . 0.0 110.25 179.847 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 18.0 t-20 -140.55 57.39 1.58 Allowed 'General case' 0 N--CA 1.494 1.773 0 O-C-N 121.647 -0.658 . . . . 0.0 110.039 179.979 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 85.53 -160.21 34.18 Favored Glycine 0 N--CA 1.494 2.525 0 N-CA-C 109.477 -1.449 . . . . 0.0 109.477 -179.6 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 40.0 p -117.88 157.66 26.26 Favored 'General case' 0 N--CA 1.496 1.847 0 O-C-N 121.66 -0.906 . . . . 0.0 110.14 -179.913 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 30.5 mtmm -92.21 -64.57 1.09 Allowed 'General case' 0 N--CA 1.496 1.86 0 O-C-N 121.667 -0.645 . . . . 0.0 110.207 -179.932 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 17.0 p -94.06 161.9 28.34 Favored Pre-proline 0 N--CA 1.494 1.737 0 O-C-N 121.649 -0.657 . . . . 0.0 110.233 -179.215 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 23.3 Cg_endo -65.88 164.67 26.24 Favored 'Trans proline' 0 N--CA 1.489 1.25 0 O-C-N 123.689 1.363 . . . . 0.0 110.397 179.677 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 84.4 p -96.95 25.96 4.98 Favored 'General case' 0 N--CA 1.497 1.876 0 O-C-N 121.684 -0.635 . . . . 0.0 110.848 -179.091 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 36.0 p -105.34 29.52 6.39 Favored 'General case' 0 N--CA 1.497 1.894 0 O-C-N 121.441 -0.787 . . . . 0.0 110.491 179.642 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 10.5 t-20 57.76 166.91 0.04 OUTLIER 'General case' 0 N--CA 1.506 2.342 0 O-C-N 121.57 -0.706 . . . . 0.0 111.022 -178.99 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 93.7 p -141.8 155.04 45.6 Favored 'General case' 0 N--CA 1.496 1.839 0 O-C-N 121.646 -0.659 . . . . 0.0 110.152 179.169 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 6.3 t -138.99 151.27 46.72 Favored 'General case' 0 N--CA 1.498 1.956 0 O-C-N 121.637 -0.665 . . . . 0.0 110.366 179.666 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 23.5 ttpp -70.11 -42.55 72.51 Favored 'General case' 0 N--CA 1.499 1.98 0 O-C-N 121.694 -0.629 . . . . 0.0 110.22 179.161 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 22.4 tp -66.12 -34.83 78.95 Favored 'General case' 0 N--CA 1.501 2.077 0 O-C-N 121.683 -0.636 . . . . 0.0 110.256 -178.904 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 54.7 mttp 54.19 41.01 32.2 Favored 'General case' 0 N--CA 1.507 2.389 0 O-C-N 121.696 -0.628 . . . . 0.0 110.947 178.662 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 97.7 p -112.26 130.58 55.89 Favored 'General case' 0 N--CA 1.496 1.83 0 O-C-N 121.601 -0.687 . . . . 0.0 110.117 178.524 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -165.05 -174.32 3.25 Favored 'General case' 0 N--CA 1.497 1.875 0 O-C-N 121.595 -0.691 . . . . 0.0 110.19 -179.942 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 77.6 mt-10 -96.95 152.87 18.29 Favored 'General case' 0 N--CA 1.495 1.777 0 O-C-N 121.636 -0.665 . . . . 0.0 109.97 178.503 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 23.7 m -96.99 134.15 40.73 Favored 'General case' 0 N--CA 1.495 1.782 0 O-C-N 121.685 -0.634 . . . . 0.0 110.35 -178.279 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 97.2 m-85 -123.76 153.07 41.45 Favored 'General case' 0 N--CA 1.495 1.803 0 O-C-N 121.716 -0.615 . . . . 0.0 110.079 178.461 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 22.9 t -74.14 112.87 10.71 Favored 'General case' 0 N--CA 1.498 1.951 0 O-C-N 121.718 -0.614 . . . . 0.0 110.097 -179.603 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 24.8 t -160.27 172.31 17.59 Favored 'General case' 0 N--CA 1.494 1.731 0 O-C-N 121.727 -0.608 . . . . 0.0 110.215 -179.601 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 94.1 mttt -87.45 143.47 27.21 Favored 'General case' 0 N--CA 1.497 1.896 0 O-C-N 121.649 -0.657 . . . . 0.0 110.043 179.299 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 91.6 m-20 -103.21 125.06 49.7 Favored 'General case' 0 N--CA 1.495 1.794 0 O-C-N 121.71 -0.619 . . . . 0.0 110.242 -179.468 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 18.9 tptm -95.44 -61.55 1.45 Allowed 'General case' 0 N--CA 1.495 1.787 0 O-C-N 121.734 -0.604 . . . . 0.0 110.144 179.696 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 91' ' ' TRP . . . . . . . . . . . . . 98.1 m95 -121.1 154.87 35.58 Favored 'General case' 0 N--CA 1.496 1.832 0 O-C-N 121.627 -0.671 . . . . 0.0 110.157 179.878 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 50.5 m -112.63 146.46 38.59 Favored 'General case' 0 N--CA 1.495 1.794 0 O-C-N 121.771 -0.581 . . . . 0.0 110.206 -179.889 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 93' ' ' MET . . . . . . . . . . . . . 4.1 mmt -65.62 -34.7 78.84 Favored 'General case' 0 N--CA 1.501 2.111 0 O-C-N 121.735 -0.603 . . . . 0.0 110.419 -179.519 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 20.3 t0 . . . . . 0 N--CA 1.495 1.804 0 CA-C-O 118.007 -0.996 . . . . 0.0 110.176 -179.908 . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' B' B ' 240' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.284 0 N-CA-C 109.553 -1.419 . . . . 0.0 109.553 . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' B' B ' 241' ' ' ALA . . . . . . . . . . . . . . . -144.01 156.31 44.35 Favored 'General case' 0 N--CA 1.495 1.776 0 O-C-N 121.713 -0.875 . . . . 0.0 110.256 -179.898 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 242' ' ' THR . . . . . . . . . . . . . 24.2 m -121.31 141.93 50.45 Favored 'General case' 0 N--CA 1.495 1.784 0 O-C-N 121.712 -0.617 . . . . 0.0 110.199 -179.843 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 243' ' ' THR . . . . . . . . . . . . . 40.1 p -123.36 159.92 27.87 Favored 'General case' 0 N--CA 1.496 1.853 0 O-C-N 121.762 -0.587 . . . . 0.0 110.138 -179.935 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 244' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER 52.57 -177.75 0.02 OUTLIER 'General case' 0 N--CA 1.508 2.435 0 O-C-N 121.688 -0.633 . . . . 0.0 111.153 -179.829 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 245' ' ' GLU . . . . . . . . . . . . . 74.5 mm-40 -126.92 157.13 40.23 Favored 'General case' 0 N--CA 1.496 1.83 0 O-C-N 121.554 -0.716 . . . . 0.0 110.157 179.421 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 246' ' ' LYS . . . . . . . . . . . . . 27.0 mtpp -94.14 76.26 4.04 Favored 'General case' 0 N--CA 1.495 1.825 0 O-C-N 121.658 -0.651 . . . . 0.0 110.151 179.632 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 247' ' ' ASN . . . . . . . . . . . . . 89.8 m-20 52.8 35.7 19.44 Favored 'General case' 0 N--CA 1.506 2.35 0 O-C-N 121.522 -0.736 . . . . 0.0 111.006 179.536 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 248' ' ' ILE . . . . . . . . . . . . . 50.2 mm 52.25 90.34 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.507 2.402 0 O-C-N 121.572 -0.705 . . . . 0.0 110.652 -179.888 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 249' ' ' SER . . . . . . . . . . . . . 86.0 p -102.93 29.19 5.59 Favored 'General case' 0 N--CA 1.495 1.804 0 O-C-N 121.689 -0.632 . . . . 0.0 110.556 179.92 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 250' ' ' VAL . . . . . . . . . . . . . 12.5 p -152.79 147.19 14.75 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.867 0 O-C-N 121.53 -0.731 . . . . 0.0 110.151 -179.033 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 251' ' ' ASP . . . . . . . . . . . . . 75.9 m-20 53.07 47.5 24.42 Favored 'General case' 0 N--CA 1.506 2.371 0 O-C-N 121.592 -0.693 . . . . 0.0 110.743 179.82 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 252' ' ' VAL . . . . . . . . . . . . . 59.5 t -81.59 138.72 19.09 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.95 0 O-C-N 121.571 -0.705 . . . . 0.0 110.135 -177.277 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 253' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 54.93 177.1 0.03 OUTLIER 'General case' 0 N--CA 1.506 2.359 0 CA-C-O 121.337 0.589 . . . . 0.0 111.506 176.951 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 254' ' ' ALA . . . . . . . . . . . . . . . -72.18 -8.44 54.78 Favored 'General case' 0 N--CA 1.501 2.076 0 O-C-N 121.744 -0.597 . . . . 0.0 111.753 -179.311 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 255' ' ' ASP . . . . . . . . . . . . . 19.5 t0 -68.0 -28.14 67.17 Favored 'General case' 0 N--CA 1.502 2.13 0 O-C-N 121.178 -0.951 . . . . 0.0 110.425 -176.222 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 256' ' ' ALA . . . . . . . . . . . . . . . -63.61 -36.18 82.95 Favored 'General case' 0 N--CA 1.501 2.097 0 O-C-N 121.465 -0.772 . . . . 0.0 110.326 177.906 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 257' ' ' SER . . . . . . . . . . . . . 74.2 m -55.1 -35.01 64.16 Favored 'General case' 0 N--CA 1.503 2.208 0 O-C-N 121.648 -0.657 . . . . 0.0 110.499 178.436 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 258' ' ' SER . . . . . . . . . . . . . 24.9 m -68.16 -33.25 74.11 Favored 'General case' 0 N--CA 1.498 1.949 0 O-C-N 121.914 -0.491 . . . . 0.0 110.248 -179.468 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 259' ' ' GLN . . . . . . . . . . . . . 94.0 mm-40 -63.24 -36.79 84.83 Favored 'General case' 0 N--CA 1.501 2.109 0 O-C-N 121.648 -0.658 . . . . 0.0 110.463 -179.138 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 260' ' ' LEU . . . . . . . . . . . . . 81.9 mt -67.28 -42.43 83.84 Favored 'General case' 0 N--CA 1.499 2.025 0 O-C-N 121.646 -0.659 . . . . 0.0 110.191 178.989 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 261' ' ' LEU . . . . . . . . . . . . . 24.0 tp -69.79 -36.18 75.48 Favored 'General case' 0 N--CA 1.497 1.893 0 O-C-N 121.615 -0.678 . . . . 0.0 109.736 176.407 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 262' ' ' SER . . . . . . . . . . . . . 69.4 m -62.3 -36.34 81.84 Favored 'General case' 0 N--CA 1.5 2.066 0 O-C-N 121.761 -0.587 . . . . 0.0 110.465 177.41 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 263' ' ' LEU . . . . . . . . . . . . . 20.7 mt -65.31 -45.61 83.65 Favored 'General case' 0 N--CA 1.501 2.076 0 O-C-N 121.679 -0.638 . . . . 0.0 110.116 179.779 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 264' ' ' LEU . . . . . . . . . . . . . 85.3 mt -63.11 -33.67 75.96 Favored 'General case' 0 N--CA 1.502 2.16 0 O-C-N 121.749 -0.594 . . . . 0.0 110.493 177.531 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 265' ' ' LYS . . . . . . . . . . . . . 23.2 ttpt -74.8 -32.49 62.01 Favored 'General case' 0 N--CA 1.498 1.954 0 O-C-N 121.757 -0.589 . . . . 0.0 110.259 -178.633 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 266' ' ' SER . . . . . . . . . . . . . 32.3 t -162.47 133.33 4.92 Favored 'General case' 0 N--CA 1.495 1.81 0 O-C-N 121.556 -0.715 . . . . 0.0 110.136 179.831 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 267' ' ' SER . . . . . . . . . . . . . 23.3 t -152.82 174.41 14.1 Favored 'General case' 0 N--CA 1.495 1.797 0 O-C-N 121.74 -0.6 . . . . 0.0 110.032 179.899 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 268' ' ' THR . . . . . . . . . . . . . 23.8 m -70.1 126.82 30.8 Favored 'General case' 0 N--CA 1.498 1.948 0 O-C-N 121.7 -0.625 . . . . 0.0 110.012 179.963 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 269' ' ' ALA . . . . . . . . . . . . . . . -72.5 161.69 77.82 Favored Pre-proline 0 N--CA 1.499 1.987 0 O-C-N 121.683 -0.636 . . . . 0.0 110.272 -179.361 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 270' ' ' PRO . . . . . . . . . . . . . 23.3 Cg_endo -65.79 150.74 85.76 Favored 'Trans proline' 0 N--CA 1.488 1.202 0 O-C-N 123.744 1.391 . . . . 0.0 110.327 178.541 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 271' ' ' SER . . . . . . . . . . . . . 31.2 t -109.41 138.61 45.5 Favored 'General case' 0 N--CA 1.494 1.77 0 O-C-N 121.64 -0.662 . . . . 0.0 110.443 -178.393 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 272' ' ' ASP . . . . . . . . . . . . . 20.2 t0 -134.11 -58.51 0.85 Allowed 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.717 -0.614 . . . . 0.0 109.987 178.46 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 273' ' ' LEU . . . . . . . . . . . . . 11.1 tp -162.45 30.51 0.11 Allowed 'General case' 0 N--CA 1.495 1.798 0 O-C-N 121.723 -0.611 . . . . 0.0 110.315 177.597 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 274' ' ' ALA . . . . . . . . . . . . . . . -76.1 -37.62 57.92 Favored 'General case' 0 N--CA 1.499 1.989 0 O-C-N 121.534 -0.729 . . . . 0.0 110.224 -179.963 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 275' ' ' THR . . . . . . . . . . . . . 7.1 t -139.16 150.4 64.51 Favored Pre-proline 0 N--CA 1.497 1.885 0 O-C-N 121.695 -0.628 . . . . 0.0 110.212 -178.935 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 276' ' ' PRO . . . . . . . . . . . . . 23.8 Cg_endo -65.87 154.64 73.08 Favored 'Trans proline' 0 N--CA 1.489 1.231 0 O-C-N 123.479 1.252 . . . . 0.0 110.472 178.77 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 277' ' ' GLN . . . . . . . . . . . . . 1.9 mp0 -64.06 -56.22 26.08 Favored Pre-proline 0 N--CA 1.5 2.043 0 O-C-N 121.701 -0.624 . . . . 0.0 110.79 -179.245 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 278' ' ' PRO . . . . . . . . . . . . . 36.4 Cg_endo -70.93 119.35 6.25 Favored 'Trans proline' 0 N--CA 1.486 1.055 0 O-C-N 123.193 1.102 . . . . 0.0 110.33 -178.316 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 279' ' ' SER . . . . . . . . . . . . . 25.9 t -161.08 -70.13 0.06 Allowed 'General case' 0 N--CA 1.495 1.797 0 O-C-N 121.718 -0.614 . . . . 0.0 110.059 178.272 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 280' ' ' THR . . . . . . . . . . . . . 24.3 m -76.21 -40.23 52.75 Favored 'General case' 0 N--CA 1.498 1.949 0 O-C-N 121.627 -0.671 . . . . 0.0 109.977 178.048 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 281' ' ' PHE . . . . . . . . . . . . . 21.8 m-85 -152.46 93.44 3.32 Favored Pre-proline 0 N--CA 1.494 1.74 0 O-C-N 121.734 -0.604 . . . . 0.0 110.127 179.986 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 282' ' ' PRO . . . . . . . . . . . . . 24.0 Cg_exo -60.1 145.93 97.33 Favored 'Trans proline' 0 N--CA 1.491 1.346 0 O-C-N 123.439 1.231 . . . . 0.0 110.833 -178.7 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 283' ' ' GLN . . . . . . . . . . . . . 9.4 tt0 -119.31 99.38 50.38 Favored Pre-proline 0 N--CA 1.495 1.814 0 O-C-N 121.775 -0.578 . . . . 0.0 110.055 179.949 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 284' ' ' PRO . . . . . . . . . . . . . 20.3 Cg_endo -65.12 155.27 69.25 Favored 'Trans proline' 0 N--CA 1.489 1.245 0 O-C-N 123.338 1.178 . . . . 0.0 110.483 -178.378 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 285' ' ' PRO . . . . . . . . . . . . . 21.2 Cg_exo -61.54 152.87 70.5 Favored 'Trans proline' 0 N--CA 1.491 1.378 0 O-C-N 123.592 1.312 . . . . 0.0 110.745 -179.012 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 286' ' ' VAL . . . . . . . . . . . . . 26.9 m -128.39 157.46 40.81 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.022 0 O-C-N 121.807 -0.558 . . . . 0.0 110.018 178.663 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 287' ' ' GLU . . . . . . . . . . . . . 14.6 pt-20 -144.41 38.82 1.27 Allowed 'General case' 0 N--CA 1.497 1.879 0 O-C-N 121.677 -0.639 . . . . 0.0 110.464 -179.545 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 288' ' ' SER . . . . . . . . . . . . . 16.2 m -65.19 -35.22 80.4 Favored 'General case' 0 N--CA 1.5 2.039 0 O-C-N 121.677 -0.639 . . . . 0.0 110.338 179.527 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 289' ' ' HIS . . . . . . . . . . . . . 99.1 m-70 -133.33 161.57 34.14 Favored 'General case' 0 N--CA 1.495 1.794 0 O-C-N 121.668 -0.645 . . . . 0.0 110.174 179.838 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 290' ' ' SER . . . . . . . . . . . . . 96.9 p -120.47 154.41 35.27 Favored 'General case' 0 N--CA 1.496 1.846 0 O-C-N 121.628 -0.67 . . . . 0.0 110.173 179.881 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 291' ' ' SER . . . . . . . . . . . . . 71.9 p . . . . . 0 N--CA 1.495 1.799 0 CA-C-O 118.02 -0.991 . . . . 0.0 110.188 -179.955 . . . . . . . . 0 0 . 1 . 021 nuclear orig full ' A' A ' -1' ' ' MET . . . . . . . . . . . . . 60.9 mtt . . . . . 0 N--CA 1.493 1.72 0 CA-C-O 121.002 0.43 . . . . 0.0 110.157 . . . . . . . . . 0 0 . 1 . 021 nuclear orig full ' A' A ' 0' ' ' GLY . . . . . . . . . . . . . . . -144.62 109.67 0.53 Allowed Glycine 0 N--CA 1.494 2.533 0 N-CA-C 109.518 -1.433 . . . . 0.0 109.518 179.779 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 39.6 ttm -109.84 135.95 49.93 Favored 'General case' 0 N--CA 1.495 1.801 0 O-C-N 121.707 -0.878 . . . . 0.0 110.117 179.584 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 69.1 m -100.22 178.23 4.83 Favored 'General case' 0 N--CA 1.495 1.825 0 O-C-N 121.725 -0.61 . . . . 0.0 110.545 -176.528 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 52.2 t -66.13 -27.84 41.97 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.153 0 O-C-N 121.667 -0.645 . . . . 0.0 110.344 -179.059 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -55.43 -31.81 62.19 Favored 'General case' 0 N--CA 1.505 2.29 0 O-C-N 121.538 -0.726 . . . . 0.0 110.371 -178.057 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 73.7 m-20 -68.84 -35.16 76.62 Favored 'General case' 0 N--CA 1.498 1.951 0 O-C-N 121.747 -0.596 . . . . 0.0 109.912 175.24 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 97.8 m-85 -97.93 10.02 41.31 Favored 'General case' 0 N--CA 1.497 1.9 0 O-C-N 121.751 -0.593 . . . . 0.0 111.284 178.826 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -67.41 129.53 40.19 Favored 'General case' 0 N--CA 1.501 2.114 0 O-C-N 121.208 -0.932 . . . . 0.0 109.975 178.694 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 82.08 0.93 90.14 Favored Glycine 0 N--CA 1.497 2.734 0 N-CA-C 110.647 -0.981 . . . . 0.0 110.647 -175.397 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 57.6 m -76.08 135.24 39.89 Favored 'General case' 0 N--CA 1.498 1.944 0 O-C-N 121.09 -1.241 . . . . 0.0 110.445 178.24 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -84.31 114.25 21.72 Favored 'General case' 0 N--CA 1.498 1.958 0 O-C-N 121.67 -0.644 . . . . 0.0 109.695 174.375 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 35.8 m -140.23 164.04 22.93 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.835 0 O-C-N 121.772 -0.58 . . . . 0.0 109.463 179.992 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 44.1 tt0 -109.36 129.6 55.53 Favored 'General case' 0 N--CA 1.492 1.654 0 C-N-CA 119.782 -0.767 . . . . 0.0 110.02 179.129 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 60.3 t -106.69 127.36 62.24 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.726 0 O-C-N 121.546 -0.721 . . . . 0.0 110.015 -179.042 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 27.1 tp -95.87 125.45 40.44 Favored 'General case' 0 N--CA 1.494 1.769 0 N-CA-C 109.031 -0.729 . . . . 0.0 109.031 173.42 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 87.0 mt -95.51 168.29 10.79 Favored 'General case' 0 N--CA 1.496 1.847 0 O-C-N 121.581 -0.7 . . . . 0.0 111.113 -172.73 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 24.4 p30 -58.02 -21.68 46.21 Favored 'General case' 0 N--CA 1.506 2.339 0 O-C-N 121.856 -0.528 . . . . 0.0 111.632 -176.94 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 46.0 p-10 -91.6 22.51 4.02 Favored 'General case' 0 N--CA 1.499 1.996 0 O-C-N 121.517 -0.739 . . . . 0.0 110.919 -176.641 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 74.4 m-20 58.55 27.37 15.56 Favored 'General case' 0 N--CA 1.506 2.35 0 O-C-N 121.469 -0.769 . . . . 0.0 110.712 175.738 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 49.9 m -108.18 144.39 35.68 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.579 -0.701 . . . . 0.0 109.578 172.887 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 48.2 mttm -109.57 145.47 36.32 Favored 'General case' 0 N--CA 1.495 1.806 0 O-C-N 121.61 -0.681 . . . . 0.0 110.615 -176.512 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -153.07 154.11 34.2 Favored 'General case' 0 N--CA 1.496 1.865 0 O-C-N 121.784 -0.573 . . . . 0.0 109.868 176.272 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 30.4 ptt180 -140.4 151.5 44.99 Favored 'General case' 0 N--CA 1.496 1.841 0 O-C-N 121.635 -0.666 . . . . 0.0 110.529 -179.513 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -171.85 171.09 43.93 Favored Glycine 0 N--CA 1.492 2.419 0 N-CA-C 109.037 -1.625 . . . . 0.0 109.037 -179.846 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 61.3 t -94.63 127.24 46.77 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.845 0 O-C-N 121.651 -0.911 . . . . 0.0 109.163 176.34 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 49.3 mt -61.37 138.4 22.12 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.185 0 O-C-N 121.594 -0.691 . . . . 0.0 110.874 -171.099 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 11.4 p -121.25 -20.59 6.66 Favored 'General case' 0 N--CA 1.493 1.717 0 O-C-N 121.876 -0.515 . . . . 0.0 111.49 -179.548 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 6.7 t30 -165.48 158.57 15.99 Favored 'General case' 0 N--CA 1.505 2.311 0 O-C-N 120.945 -1.097 . . . . 0.0 111.871 177.093 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 65.1 t80 -150.41 119.95 6.95 Favored 'General case' 0 N--CA 1.497 1.901 0 N-CA-C 109.226 -0.657 . . . . 0.0 109.226 173.766 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 17.9 t70 -97.14 127.2 42.88 Favored 'General case' 0 N--CA 1.494 1.757 0 O-C-N 121.641 -0.662 . . . . 0.0 109.293 -177.113 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 22.7 t -65.85 -46.34 78.82 Favored 'General case' 0 N--CA 1.5 2.042 0 O-C-N 121.557 -0.715 . . . . 0.0 110.865 -175.11 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 21.4 t -58.61 -48.06 82.25 Favored 'General case' 0 N--CA 1.502 2.13 0 O-C-N 121.505 -0.747 . . . . 0.0 111.0 -173.575 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 92.4 m-20 -107.02 -1.87 21.69 Favored 'General case' 0 N--CA 1.498 1.927 0 O-C-N 121.594 -0.691 . . . . 0.0 111.804 -178.316 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 69.1 m 49.18 67.18 0.92 Allowed 'General case' 0 N--CA 1.508 2.438 0 O-C-N 121.082 -1.011 . . . . 0.0 110.901 -174.437 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 44.2 mm -113.82 125.79 71.18 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.971 0 O-C-N 121.544 -0.723 . . . . 0.0 109.136 -175.215 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 10.9 tp -116.0 119.03 34.56 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.613 -0.679 . . . . 0.0 110.451 -169.816 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 78.2 mt-30 -90.98 132.39 36.0 Favored 'General case' 0 N--CA 1.489 1.523 0 N-CA-C 109.191 -0.67 . . . . 0.0 109.191 170.862 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 48.8 mt -117.81 123.47 46.03 Favored 'General case' 0 N--CA 1.493 1.71 0 C-N-CA 120.152 -0.619 . . . . 0.0 109.949 175.218 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 56.5 ttt85 -105.1 105.85 16.08 Favored 'General case' 0 N--CA 1.495 1.786 0 O-C-N 121.78 -0.575 . . . . 0.0 110.091 174.101 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 63.3 tp -83.37 155.04 23.72 Favored 'General case' 0 N--CA 1.498 1.949 0 O-C-N 121.609 -0.682 . . . . 0.0 110.515 -177.054 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -68.82 -2.91 10.61 Favored 'General case' 0 N--CA 1.504 2.243 0 O-C-N 121.885 -0.51 . . . . 0.0 112.131 -170.347 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 30.1 m120 -88.04 28.59 1.03 Allowed 'General case' 0 N--CA 1.497 1.907 0 O-C-N 121.029 -1.045 . . . . 0.0 110.795 174.878 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 13.5 t0 64.9 29.03 12.6 Favored 'General case' 0 N--CA 1.505 2.295 0 O-C-N 121.205 -0.934 . . . . 0.0 110.387 175.755 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 74.5 m -125.01 137.95 54.23 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.432 -0.792 . . . . 0.0 110.137 177.897 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 9.1 t -128.22 149.72 50.34 Favored 'General case' 0 N--CA 1.496 1.843 0 O-C-N 121.711 -0.618 . . . . 0.0 110.018 178.818 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 57.7 tttm -151.15 134.9 16.44 Favored 'General case' 0 N--CA 1.497 1.879 0 O-C-N 121.704 -0.623 . . . . 0.0 110.574 -178.339 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 91.0 p -95.0 120.99 36.15 Favored 'General case' 0 N--CA 1.495 1.796 0 O-C-N 121.727 -0.608 . . . . 0.0 110.215 177.556 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 80.9 mt -129.35 136.05 60.31 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.85 0 O-C-N 121.681 -0.637 . . . . 0.0 109.359 -179.597 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 66.4 t -81.71 127.79 39.28 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.001 0 O-C-N 121.631 -0.668 . . . . 0.0 109.202 179.204 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 51.6 p -57.99 -25.06 60.56 Favored 'General case' 0 N--CA 1.505 2.295 0 O-C-N 121.463 -0.773 . . . . 0.0 111.87 -168.97 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 43.4 tptt -57.19 -26.06 60.02 Favored 'General case' 0 N--CA 1.502 2.134 0 O-C-N 121.507 -0.745 . . . . 0.0 111.066 -176.805 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 5.0 p30 -84.69 5.72 27.08 Favored 'General case' 0 N--CA 1.498 1.95 0 C-N-CA 119.69 -0.804 . . . . 0.0 111.286 176.323 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 96.5 mt -75.77 124.41 33.76 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.144 0 O-C-N 121.146 -0.971 . . . . 0.0 109.837 175.461 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 42.5 tttp -92.36 -28.68 16.76 Favored 'General case' 0 N--CA 1.495 1.803 0 C-N-CA 120.396 -0.521 . . . . 0.0 109.953 171.962 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 5.4 m-20 -163.75 154.57 15.92 Favored 'General case' 0 N--CA 1.501 2.085 0 O-C-N 121.791 -0.568 . . . . 0.0 110.125 -178.461 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 84.4 mt -132.96 150.75 52.14 Favored 'General case' 0 N--CA 1.497 1.887 0 O-C-N 121.669 -0.645 . . . . 0.0 110.487 -179.181 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 19.6 ptp180 -151.59 145.71 25.31 Favored 'General case' 0 N--CA 1.495 1.797 0 O-C-N 121.688 -0.632 . . . . 0.0 110.009 174.824 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 64.8 mt -86.32 133.27 30.16 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.837 0 O-C-N 121.527 -0.733 . . . . 0.0 109.86 173.864 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 61.1 mt -83.27 163.11 51.76 Favored Pre-proline 0 N--CA 1.497 1.893 0 O-C-N 121.594 -0.692 . . . . 0.0 110.145 -178.903 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 31.9 Cg_exo -57.75 -27.78 79.25 Favored 'Trans proline' 0 N--CA 1.493 1.448 0 O-C-N 123.639 1.336 . . . . 0.0 111.109 -178.057 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 60.8 tttt -80.11 114.18 18.83 Favored 'General case' 0 N--CA 1.498 1.958 0 O-C-N 121.603 -0.685 . . . . 0.0 109.974 178.473 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 45.5 p30 -161.75 -167.53 1.72 Allowed 'General case' 0 N--CA 1.498 1.948 0 O-C-N 121.679 -0.638 . . . . 0.0 110.277 -178.576 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 50.9 mt-10 -95.63 158.27 15.53 Favored 'General case' 0 N--CA 1.496 1.845 0 O-C-N 121.687 -0.633 . . . . 0.0 110.122 179.326 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 19.0 tt -63.7 -32.7 57.91 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.052 0 O-C-N 121.709 -0.619 . . . . 0.0 110.509 -178.983 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 64' ' ' MET . . . . . . . . . . . . . 8.2 ttp 51.49 91.0 0.07 OUTLIER Pre-proline 0 N--CA 1.504 2.265 0 O-C-N 121.671 -0.643 . . . . 0.0 111.135 179.807 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 23.8 Cg_endo -65.91 139.49 57.01 Favored 'Trans proline' 0 N--CA 1.489 1.245 0 O-C-N 123.529 1.279 . . . . 0.0 110.43 179.779 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 38.5 ttpt -93.37 -49.63 5.84 Favored 'General case' 0 N--CA 1.495 1.801 0 O-C-N 121.687 -0.633 . . . . 0.0 110.281 -179.172 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 29.9 m120 -101.99 139.12 38.04 Favored 'General case' 0 N--CA 1.495 1.801 0 O-C-N 121.703 -0.623 . . . . 0.0 110.326 -178.747 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . -153.34 110.67 0.46 Allowed Glycine 0 N--CA 1.493 2.489 0 N-CA-C 109.434 -1.466 . . . . 0.0 109.434 179.385 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 40.3 p -125.54 166.57 16.42 Favored 'General case' 0 N--CA 1.496 1.871 0 O-C-N 121.606 -0.938 . . . . 0.0 110.247 -179.262 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 53.3 mttm -91.39 151.34 20.87 Favored 'General case' 0 N--CA 1.497 1.894 0 O-C-N 121.677 -0.639 . . . . 0.0 110.136 179.827 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 66.8 m -79.59 157.28 74.9 Favored Pre-proline 0 N--CA 1.498 1.936 0 O-C-N 121.754 -0.591 . . . . 0.0 110.193 -179.596 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 21.8 Cg_endo -65.29 -30.42 54.21 Favored 'Trans proline' 0 N--CA 1.49 1.291 0 O-C-N 123.729 1.384 . . . . 0.0 110.668 -179.861 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 97.2 p -105.76 156.52 18.22 Favored 'General case' 0 N--CA 1.495 1.795 0 O-C-N 121.58 -0.7 . . . . 0.0 110.207 179.856 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 24.0 m -104.45 138.73 40.4 Favored 'General case' 0 N--CA 1.494 1.775 0 O-C-N 121.815 -0.553 . . . . 0.0 110.225 -179.631 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 39.2 p-10 -142.28 -174.26 4.07 Favored 'General case' 0 N--CA 1.495 1.797 0 O-C-N 121.681 -0.637 . . . . 0.0 110.437 -179.832 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 11.8 t -74.35 157.92 34.87 Favored 'General case' 0 N--CA 1.498 1.965 0 O-C-N 121.689 -0.632 . . . . 0.0 110.12 179.983 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 23.5 m -105.88 143.44 34.02 Favored 'General case' 0 N--CA 1.495 1.805 0 O-C-N 121.691 -0.631 . . . . 0.0 110.28 -178.71 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 74.6 tttt 54.35 35.56 23.26 Favored 'General case' 0 N--CA 1.505 2.293 0 O-C-N 121.586 -0.696 . . . . 0.0 110.923 179.59 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -68.05 -34.68 76.91 Favored 'General case' 0 N--CA 1.499 1.997 0 O-C-N 121.632 -0.667 . . . . 0.0 110.014 178.476 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 62.5 mttm -63.92 -32.95 74.66 Favored 'General case' 0 N--CA 1.502 2.137 0 O-C-N 121.726 -0.609 . . . . 0.0 110.429 179.742 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 30.6 t 56.7 -82.48 0.01 OUTLIER 'General case' 0 N--CA 1.507 2.412 0 O-C-N 122.046 -0.409 . . . . 0.0 111.367 -179.317 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -136.2 160.23 39.3 Favored 'General case' 0 N--CA 1.495 1.805 0 O-C-N 121.245 -0.909 . . . . 0.0 110.257 -178.233 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 44.7 tt0 -95.19 147.73 23.14 Favored 'General case' 0 N--CA 1.495 1.794 0 O-C-N 121.725 -0.61 . . . . 0.0 110.048 -179.906 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 27.5 p -66.19 -37.94 86.82 Favored 'General case' 0 N--CA 1.501 2.081 0 O-C-N 121.68 -0.638 . . . . 0.0 110.454 -177.972 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 96.4 m-85 -113.98 115.06 27.04 Favored 'General case' 0 N--CA 1.496 1.862 0 O-C-N 121.493 -0.754 . . . . 0.0 110.172 177.394 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 86.7 p -160.88 169.35 22.81 Favored 'General case' 0 N--CA 1.494 1.757 0 O-C-N 121.636 -0.665 . . . . 0.0 110.141 179.531 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 30.8 t -112.28 123.29 49.95 Favored 'General case' 0 N--CA 1.495 1.788 0 O-C-N 121.704 -0.623 . . . . 0.0 110.099 178.775 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 55.5 mtpt -67.77 -41.98 82.41 Favored 'General case' 0 N--CA 1.499 2.023 0 O-C-N 121.768 -0.583 . . . . 0.0 110.281 -179.431 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 91.8 m-20 -136.33 127.82 28.63 Favored 'General case' 0 N--CA 1.495 1.79 0 O-C-N 121.78 -0.575 . . . . 0.0 110.226 -179.976 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 71.6 mttt -65.35 -32.98 74.9 Favored 'General case' 0 N--CA 1.501 2.09 0 O-C-N 121.664 -0.648 . . . . 0.0 110.394 178.848 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 91' ' ' TRP . . . . . . . . . . . . . 48.7 p90 -115.34 155.76 26.75 Favored 'General case' 0 N--CA 1.496 1.852 0 O-C-N 121.718 -0.614 . . . . 0.0 110.275 179.683 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 25.6 t -109.48 141.22 42.22 Favored 'General case' 0 N--CA 1.495 1.784 0 O-C-N 121.72 -0.612 . . . . 0.0 110.28 -179.853 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 93' ' ' MET . . . . . . . . . . . . . 56.5 ttp -99.12 130.95 45.47 Favored 'General case' 0 N--CA 1.495 1.779 0 O-C-N 121.713 -0.617 . . . . 0.0 110.175 -179.824 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 19.7 t70 . . . . . 0 N--CA 1.495 1.807 0 CA-C-O 117.996 -1.002 . . . . 0.0 110.294 -179.736 . . . . . . . . 0 0 . 1 . 021 nuclear orig full ' B' B ' 240' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.319 0 N-CA-C 109.537 -1.425 . . . . 0.0 109.537 . . . . . . . . . 0 0 . 1 . 021 nuclear orig full ' B' B ' 241' ' ' ALA . . . . . . . . . . . . . . . -67.55 -36.97 81.99 Favored 'General case' 0 N--CA 1.499 1.985 0 O-C-N 121.612 -0.934 . . . . 0.0 110.291 -179.904 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 242' ' ' THR . . . . . . . . . . . . . 24.2 m -126.36 133.56 51.3 Favored 'General case' 0 N--CA 1.495 1.823 0 O-C-N 121.7 -0.625 . . . . 0.0 110.186 179.522 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 243' ' ' THR . . . . . . . . . . . . . 41.8 p -83.11 -33.08 26.4 Favored 'General case' 0 N--CA 1.498 1.942 0 O-C-N 121.719 -0.613 . . . . 0.0 110.321 179.923 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 244' ' ' LYS . . . . . . . . . . . . . 89.0 mttt -110.85 154.35 24.14 Favored 'General case' 0 N--CA 1.496 1.827 0 O-C-N 121.657 -0.652 . . . . 0.0 110.19 -179.542 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 245' ' ' GLU . . . . . . . . . . . . . 54.7 mt-10 -96.12 142.72 27.97 Favored 'General case' 0 N--CA 1.495 1.789 0 O-C-N 121.671 -0.643 . . . . 0.0 110.139 179.463 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 246' ' ' LYS . . . . . . . . . . . . . 81.3 mttt -65.28 -33.66 76.51 Favored 'General case' 0 N--CA 1.5 2.044 0 O-C-N 121.676 -0.64 . . . . 0.0 110.444 -179.458 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 247' ' ' ASN . . . . . . . . . . . . . 15.1 t-20 53.44 72.68 0.42 Allowed 'General case' 0 N--CA 1.505 2.32 0 O-C-N 121.497 -0.752 . . . . 0.0 110.92 179.704 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 248' ' ' ILE . . . . . . . . . . . . . 80.1 mt 53.95 77.94 0.07 OUTLIER 'Isoleucine or valine' 0 N--CA 1.507 2.402 0 O-C-N 121.456 -0.777 . . . . 0.0 110.416 -179.922 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 249' ' ' SER . . . . . . . . . . . . . 3.1 m -93.29 -27.34 16.86 Favored 'General case' 0 N--CA 1.496 1.868 0 O-C-N 121.639 -0.663 . . . . 0.0 110.672 179.149 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 250' ' ' VAL . . . . . . . . . . . . . 13.5 p -87.07 149.05 4.22 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.884 0 O-C-N 121.566 -0.709 . . . . 0.0 110.368 -178.438 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 251' ' ' ASP . . . . . . . . . . . . . 3.7 m-20 52.32 38.09 24.02 Favored 'General case' 0 N--CA 1.507 2.379 0 O-C-N 121.672 -0.643 . . . . 0.0 111.076 -178.817 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 252' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER 52.04 -177.28 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.507 2.378 0 O-C-N 121.783 -0.573 . . . . 0.0 111.2 177.795 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' B' B ' 253' ' ' ASP . . . . . . . . . . . . . 53.4 p-10 -81.64 171.17 14.94 Favored 'General case' 0 N--CA 1.499 1.977 0 O-C-N 121.538 -0.726 . . . . 0.0 110.556 -179.491 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 254' ' ' ALA . . . . . . . . . . . . . . . -69.06 -13.57 62.52 Favored 'General case' 0 N--CA 1.501 2.12 0 O-C-N 121.762 -0.586 . . . . 0.0 111.31 178.662 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 255' ' ' ASP . . . . . . . . . . . . . 9.7 m-20 -70.69 -25.95 63.2 Favored 'General case' 0 N--CA 1.501 2.101 0 O-C-N 121.307 -0.871 . . . . 0.0 110.702 -176.897 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 256' ' ' ALA . . . . . . . . . . . . . . . -62.45 -35.73 80.21 Favored 'General case' 0 N--CA 1.501 2.124 0 O-C-N 121.375 -0.828 . . . . 0.0 110.467 179.945 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 257' ' ' SER . . . . . . . . . . . . . 34.5 t -54.38 -34.96 62.27 Favored 'General case' 0 N--CA 1.503 2.204 0 O-C-N 121.592 -0.692 . . . . 0.0 110.396 176.682 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 258' ' ' SER . . . . . . . . . . . . . 25.3 m -67.99 -31.25 70.82 Favored 'General case' 0 N--CA 1.498 1.934 0 O-C-N 121.888 -0.507 . . . . 0.0 110.25 178.978 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 259' ' ' GLN . . . . . . . . . . . . . 48.7 tt0 -61.47 -37.59 84.17 Favored 'General case' 0 N--CA 1.502 2.134 0 O-C-N 121.635 -0.666 . . . . 0.0 110.381 178.964 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 260' ' ' LEU . . . . . . . . . . . . . 46.0 mt -65.93 -42.36 90.2 Favored 'General case' 0 N--CA 1.5 2.038 0 O-C-N 121.721 -0.612 . . . . 0.0 110.306 178.449 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 261' ' ' LEU . . . . . . . . . . . . . 18.9 tp -69.89 -36.55 75.53 Favored 'General case' 0 N--CA 1.498 1.961 0 O-C-N 121.717 -0.614 . . . . 0.0 109.75 176.83 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 262' ' ' SER . . . . . . . . . . . . . 49.1 m -62.16 -37.0 83.56 Favored 'General case' 0 N--CA 1.501 2.078 0 O-C-N 121.714 -0.616 . . . . 0.0 110.556 176.614 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 263' ' ' LEU . . . . . . . . . . . . . 18.9 mt -64.7 -42.78 95.05 Favored 'General case' 0 N--CA 1.502 2.133 0 O-C-N 121.698 -0.626 . . . . 0.0 110.186 179.64 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 264' ' ' LEU . . . . . . . . . . . . . 85.0 mt -62.21 -34.08 75.78 Favored 'General case' 0 N--CA 1.502 2.154 0 O-C-N 121.724 -0.61 . . . . 0.0 110.566 178.513 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 265' ' ' LYS . . . . . . . . . . . . . 29.2 mtpt -74.98 -34.12 61.95 Favored 'General case' 0 N--CA 1.499 1.994 0 O-C-N 121.718 -0.614 . . . . 0.0 109.976 179.915 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 266' ' ' SER . . . . . . . . . . . . . 64.8 m 51.38 -173.34 0.02 OUTLIER 'General case' 0 N--CA 1.506 2.355 0 O-C-N 121.707 -0.621 . . . . 0.0 111.22 179.136 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 267' ' ' SER . . . . . . . . . . . . . 47.3 m -118.33 150.3 39.72 Favored 'General case' 0 N--CA 1.495 1.818 0 O-C-N 121.665 -0.647 . . . . 0.0 110.15 179.531 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 268' ' ' THR . . . . . . . . . . . . . 9.0 t -67.81 144.09 55.51 Favored 'General case' 0 N--CA 1.5 2.034 0 O-C-N 121.717 -0.614 . . . . 0.0 110.375 -179.404 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 269' ' ' ALA . . . . . 0.419 ' CB ' ' CD ' ' B' ' 270' ' ' PRO . . . -171.12 -60.17 0.0 OUTLIER Pre-proline 0 N--CA 1.499 1.978 0 O-C-N 121.636 -0.665 . . . . 0.0 110.383 -179.666 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' B' B ' 270' ' ' PRO . . . . . 0.419 ' CD ' ' CB ' ' B' ' 269' ' ' ALA . 30.7 Cg_endo -68.56 164.09 34.3 Favored 'Trans proline' 0 N--CA 1.488 1.188 0 O-C-N 123.152 1.08 . . . . 0.0 110.282 178.579 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' B' B ' 271' ' ' SER . . . . . . . . . . . . . 50.5 m -66.22 153.54 42.22 Favored 'General case' 0 N--CA 1.499 2.025 0 O-C-N 121.605 -0.684 . . . . 0.0 110.336 -179.381 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 272' ' ' ASP . . . . . . . . . . . . . 25.9 t0 -101.08 154.52 18.65 Favored 'General case' 0 N--CA 1.496 1.828 0 O-C-N 121.69 -0.631 . . . . 0.0 110.247 -179.064 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 273' ' ' LEU . . . . . . . . . . . . . 12.3 tp 52.78 33.01 13.2 Favored 'General case' 0 N--CA 1.506 2.334 0 O-C-N 121.637 -0.664 . . . . 0.0 110.93 179.883 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 274' ' ' ALA . . . . . . . . . . . . . . . -74.5 -40.82 61.58 Favored 'General case' 0 N--CA 1.497 1.921 0 O-C-N 121.635 -0.666 . . . . 0.0 110.07 179.308 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 275' ' ' THR . . . . . . . . . . . . . 20.0 m -135.86 87.58 24.67 Favored Pre-proline 0 N--CA 1.494 1.773 0 O-C-N 121.699 -0.626 . . . . 0.0 110.06 179.324 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 276' ' ' PRO . . . . . . . . . . . . . 30.6 Cg_endo -68.15 78.86 0.59 Allowed 'Trans proline' 0 N--CA 1.488 1.189 0 O-C-N 123.525 1.276 . . . . 0.0 110.392 -179.58 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 277' ' ' GLN . . . . . 0.421 ' N ' ' CD ' ' B' ' 278' ' ' PRO . 1.4 tt0 -85.94 -48.67 0.55 Allowed Pre-proline 0 N--CA 1.498 1.955 0 O-C-N 121.554 -0.716 . . . . 0.0 110.864 179.2 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' B' B ' 278' ' ' PRO . . . . . 0.421 ' CD ' ' N ' ' B' ' 277' ' ' GLN . 23.4 Cg_exo -60.64 154.44 54.61 Favored 'Trans proline' 0 N--CA 1.493 1.449 0 O-C-N 123.037 1.02 . . . . 0.0 110.759 -179.188 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' B' B ' 279' ' ' SER . . . . . . . . . . . . . 29.9 t -104.47 149.92 25.02 Favored 'General case' 0 N--CA 1.495 1.806 0 O-C-N 121.74 -0.6 . . . . 0.0 110.094 179.799 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 280' ' ' THR . . . . . . . . . . . . . 23.6 m -75.77 138.83 41.47 Favored 'General case' 0 N--CA 1.497 1.924 0 O-C-N 121.672 -0.643 . . . . 0.0 110.206 -179.063 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 281' ' ' PHE . . . . . . . . . . . . . 4.7 t80 52.9 68.23 3.2 Favored Pre-proline 0 N--CA 1.506 2.358 0 O-C-N 121.561 -0.712 . . . . 0.0 110.955 -179.858 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 282' ' ' PRO . . . . . . . . . . . . . 16.8 Cg_exo -63.7 -47.09 7.69 Favored 'Trans proline' 0 N--CA 1.49 1.304 0 O-C-N 123.48 1.253 . . . . 0.0 110.514 179.33 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 283' ' ' GLN . . . . . . . . . . . . . 42.2 mt-30 -150.63 155.17 35.95 Favored Pre-proline 0 N--CA 1.494 1.751 0 O-C-N 121.746 -0.596 . . . . 0.0 110.211 179.553 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 284' ' ' PRO . . . . . . . . . . . . . 36.3 Cg_endo -70.47 152.75 65.85 Favored 'Trans proline' 0 N--CA 1.486 1.052 0 O-C-N 123.644 1.339 . . . . 0.0 110.339 179.905 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 285' ' ' PRO . . . . . . . . . . . . . 33.4 Cg_endo -69.19 168.17 21.59 Favored 'Trans proline' 0 N--CA 1.488 1.189 0 O-C-N 123.626 1.329 . . . . 0.0 110.251 179.189 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 286' ' ' VAL . . . . . . . . . . . . . 27.2 m -124.06 140.05 48.63 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.991 0 O-C-N 121.673 -0.642 . . . . 0.0 110.258 179.261 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 287' ' ' GLU . . . . . . . . . . . . . 74.8 mm-40 -76.49 -34.93 58.63 Favored 'General case' 0 N--CA 1.498 1.925 0 O-C-N 121.698 -0.626 . . . . 0.0 110.401 -179.284 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 288' ' ' SER . . . . . . . . . . . . . 48.5 m -119.49 150.5 40.13 Favored 'General case' 0 N--CA 1.496 1.835 0 O-C-N 121.724 -0.61 . . . . 0.0 110.292 -178.157 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 289' ' ' HIS . . . . . . . . . . . . . 32.2 m170 -65.54 -33.57 76.24 Favored 'General case' 0 N--CA 1.5 2.042 0 O-C-N 121.68 -0.638 . . . . 0.0 110.372 179.704 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 290' ' ' SER . . . . . . . . . . . . . 21.2 m -64.63 -34.12 77.53 Favored 'General case' 0 N--CA 1.5 2.042 0 O-C-N 121.692 -0.63 . . . . 0.0 110.409 -179.791 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 291' ' ' SER . . . . . . . . . . . . . 8.8 m . . . . . 0 N--CA 1.505 2.318 0 CA-C-O 117.951 -1.024 . . . . 0.0 111.022 -179.976 . . . . . . . . 0 0 . 1 . 022 nuclear orig full ' A' A ' -1' ' ' MET . . . . . . . . . . . . . 48.1 ttm . . . . . 0 N--CA 1.491 1.589 0 CA-C-O 121.043 0.449 . . . . 0.0 110.203 . . . . . . . . . 0 0 . 1 . 022 nuclear orig full ' A' A ' 0' ' ' GLY . . . . . . . . . . . . . . . -83.51 -171.22 47.38 Favored Glycine 0 N--CA 1.493 2.478 0 N-CA-C 109.508 -1.437 . . . . 0.0 109.508 179.576 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 49.4 ttm -90.42 131.54 36.13 Favored 'General case' 0 N--CA 1.496 1.854 0 O-C-N 121.614 -0.933 . . . . 0.0 110.149 179.946 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 69.7 m -91.68 178.84 5.81 Favored 'General case' 0 N--CA 1.496 1.843 0 O-C-N 121.757 -0.59 . . . . 0.0 110.247 -178.547 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 65.6 t -66.4 -27.73 41.31 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.065 0 O-C-N 121.727 -0.608 . . . . 0.0 110.337 -178.887 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -54.98 -30.63 59.62 Favored 'General case' 0 N--CA 1.505 2.303 0 O-C-N 121.487 -0.758 . . . . 0.0 110.439 -178.422 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 9.7 m-20 -68.89 -30.72 69.27 Favored 'General case' 0 N--CA 1.499 1.995 0 O-C-N 121.753 -0.592 . . . . 0.0 110.244 174.981 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 97.4 m-85 -95.56 10.06 37.96 Favored 'General case' 0 N--CA 1.497 1.909 0 O-C-N 121.636 -0.665 . . . . 0.0 111.502 -178.16 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 3.9 m-30 -67.3 139.88 57.29 Favored 'General case' 0 N--CA 1.502 2.135 0 O-C-N 121.171 -0.955 . . . . 0.0 110.077 174.184 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 83.65 -3.14 86.13 Favored Glycine 0 N--CA 1.497 2.746 0 N-CA-C 110.768 -0.933 . . . . 0.0 110.768 -177.089 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 66.2 m -75.27 138.97 42.23 Favored 'General case' 0 N--CA 1.497 1.887 0 O-C-N 121.115 -1.227 . . . . 0.0 110.508 179.685 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 2.4 m120 -84.58 118.8 24.57 Favored 'General case' 0 N--CA 1.498 1.971 0 O-C-N 121.651 -0.656 . . . . 0.0 109.454 174.407 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 35.8 m -143.19 162.3 17.02 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.822 0 O-C-N 121.693 -0.629 . . . . 0.0 109.854 -179.116 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . 0.43 ' HA ' ' HA ' ' A' ' 22' ' ' ARG . 47.7 tt0 -109.47 127.22 54.26 Favored 'General case' 0 N--CA 1.493 1.692 0 O-C-N 121.56 -0.713 . . . . 0.0 110.047 176.331 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 58.0 t -106.89 123.52 62.0 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.747 0 O-C-N 121.48 -0.763 . . . . 0.0 109.951 -178.324 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 17.6 tp -96.0 135.1 38.22 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.663 -0.648 . . . . 0.0 109.472 175.737 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 86.2 mt -103.67 169.0 8.78 Favored 'General case' 0 N--CA 1.497 1.908 0 O-C-N 121.61 -0.681 . . . . 0.0 111.22 -172.605 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 24.1 p30 -59.05 -21.73 59.59 Favored 'General case' 0 N--CA 1.507 2.391 0 O-C-N 121.843 -0.535 . . . . 0.0 111.677 -177.507 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 47.7 p-10 -93.45 24.53 3.9 Favored 'General case' 0 N--CA 1.498 1.96 0 O-C-N 121.497 -0.752 . . . . 0.0 110.797 -175.309 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 74.3 m-20 59.31 25.64 14.33 Favored 'General case' 0 N--CA 1.505 2.298 0 O-C-N 121.523 -0.736 . . . . 0.0 110.73 176.834 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 70.7 m -97.67 163.07 12.98 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.631 -0.668 . . . . 0.0 109.274 170.657 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 13.0 ptmt -145.4 138.02 25.98 Favored 'General case' 0 N--CA 1.495 1.818 0 O-C-N 121.59 -0.694 . . . . 0.0 110.46 -176.688 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -153.02 161.62 42.31 Favored 'General case' 0 N--CA 1.496 1.863 0 O-C-N 121.728 -0.607 . . . . 0.0 110.299 179.893 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . 0.43 ' HA ' ' HA ' ' A' ' 12' ' ' GLU . 32.5 ptt180 -142.06 147.15 36.35 Favored 'General case' 0 N--CA 1.496 1.826 0 O-C-N 121.701 -0.624 . . . . 0.0 110.782 -179.751 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -171.73 171.42 44.08 Favored Glycine 0 N--CA 1.494 2.561 0 N-CA-C 108.76 -1.736 . . . . 0.0 108.76 -175.47 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 39.9 t -94.59 120.89 44.65 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.901 0 O-C-N 121.424 -1.045 . . . . 0.0 109.35 -175.451 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 92.6 mt -64.29 143.45 15.69 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.118 0 O-C-N 121.566 -0.709 . . . . 0.0 110.498 -171.899 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 6.3 p -121.23 -28.16 4.75 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.785 -0.572 . . . . 0.0 111.256 179.334 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 27.5 t30 -161.66 160.77 29.07 Favored 'General case' 0 N--CA 1.5 2.065 0 C-N-CA 118.919 -1.112 . . . . 0.0 111.899 -177.881 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 82.0 t80 -150.08 125.81 10.38 Favored 'General case' 0 N--CA 1.499 2.002 0 N-CA-C 109.052 -0.721 . . . . 0.0 109.052 169.724 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 17.8 t70 -99.68 128.56 45.78 Favored 'General case' 0 N--CA 1.492 1.664 0 N-CA-C 109.089 -0.708 . . . . 0.0 109.089 -177.484 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 21.8 m -66.43 -46.37 76.71 Favored 'General case' 0 N--CA 1.499 2.015 0 C-N-CA 120.053 -0.659 . . . . 0.0 110.673 -175.736 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 16.3 t -58.22 -48.06 81.55 Favored 'General case' 0 N--CA 1.503 2.206 0 O-C-N 121.485 -0.76 . . . . 0.0 110.957 -173.971 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 90.4 m-20 -104.59 -5.38 21.51 Favored 'General case' 0 N--CA 1.497 1.895 0 O-C-N 121.614 -0.679 . . . . 0.0 111.643 -178.486 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 71.0 m 49.36 67.25 0.91 Allowed 'General case' 0 N--CA 1.507 2.418 0 O-C-N 121.132 -0.98 . . . . 0.0 110.937 -174.32 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 45.5 mm -120.68 126.41 75.21 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.019 0 O-C-N 121.665 -0.647 . . . . 0.0 109.323 -174.959 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 11.9 tp -115.76 120.38 39.13 Favored 'General case' 0 N--CA 1.494 1.762 0 O-C-N 121.68 -0.637 . . . . 0.0 110.504 -169.065 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 99.0 mt-30 -90.99 134.68 34.29 Favored 'General case' 0 N--CA 1.491 1.593 0 N-CA-C 109.468 -0.568 . . . . 0.0 109.468 174.485 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 90.2 mt -117.82 123.82 46.86 Favored 'General case' 0 N--CA 1.496 1.842 0 O-C-N 121.841 -0.537 . . . . 0.0 109.915 174.342 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 58.0 ttt85 -96.64 108.54 21.17 Favored 'General case' 0 N--CA 1.496 1.83 0 O-C-N 121.669 -0.645 . . . . 0.0 109.829 175.283 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 17.9 tp -84.83 153.37 22.99 Favored 'General case' 0 N--CA 1.494 1.739 0 O-C-N 121.745 -0.597 . . . . 0.0 110.962 -174.155 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -63.57 -9.65 14.4 Favored 'General case' 0 N--CA 1.503 2.183 0 O-C-N 121.985 -0.447 . . . . 0.0 111.928 -171.781 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 30.0 m120 -86.14 27.47 0.91 Allowed 'General case' 0 N--CA 1.498 1.953 0 O-C-N 121.106 -0.996 . . . . 0.0 110.984 175.679 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 15.7 t0 62.89 29.23 16.57 Favored 'General case' 0 N--CA 1.504 2.235 0 O-C-N 120.975 -1.078 . . . . 0.0 110.595 175.481 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 63.8 m -123.14 137.81 54.81 Favored 'General case' 0 N--CA 1.496 1.872 0 O-C-N 121.344 -0.847 . . . . 0.0 110.402 -179.522 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 10.2 t -97.62 151.02 20.51 Favored 'General case' 0 N--CA 1.495 1.82 0 O-C-N 121.735 -0.603 . . . . 0.0 110.281 176.756 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 57.9 tttt -149.24 119.15 7.11 Favored 'General case' 0 N--CA 1.496 1.854 0 O-C-N 121.691 -0.631 . . . . 0.0 110.202 177.812 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 88.1 p -95.21 123.95 38.99 Favored 'General case' 0 N--CA 1.495 1.798 0 O-C-N 121.64 -0.662 . . . . 0.0 110.294 -179.831 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 82.7 mt -129.27 134.83 63.14 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.866 0 O-C-N 121.692 -0.63 . . . . 0.0 109.379 178.889 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 66.6 t -82.71 127.56 39.55 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.889 0 O-C-N 121.622 -0.674 . . . . 0.0 109.306 179.318 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 67.9 p -58.29 -24.93 61.09 Favored 'General case' 0 N--CA 1.507 2.408 0 O-C-N 121.545 -0.722 . . . . 0.0 111.916 -169.793 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 56.3 tttt -56.51 -23.26 38.39 Favored 'General case' 0 N--CA 1.502 2.135 0 O-C-N 121.464 -0.772 . . . . 0.0 111.149 -177.055 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 50.4 p30 -84.0 1.47 43.59 Favored 'General case' 0 N--CA 1.498 1.941 0 O-C-N 121.419 -0.8 . . . . 0.0 111.301 176.677 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 97.8 mt -76.13 127.56 37.44 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.074 0 O-C-N 121.163 -0.961 . . . . 0.0 110.055 179.05 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 45.8 tptt -92.14 -30.86 15.74 Favored 'General case' 0 N--CA 1.495 1.789 0 O-C-N 121.868 -0.52 . . . . 0.0 109.602 169.283 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 5.3 m-20 -163.91 159.37 20.86 Favored 'General case' 0 N--CA 1.499 2.007 0 O-C-N 121.87 -0.519 . . . . 0.0 109.89 -178.56 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 85.5 mt -132.94 149.33 52.25 Favored 'General case' 0 N--CA 1.496 1.868 0 O-C-N 121.699 -0.626 . . . . 0.0 110.342 -179.241 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 6.8 ptm180 -150.71 137.6 19.1 Favored 'General case' 0 N--CA 1.496 1.832 0 O-C-N 121.716 -0.615 . . . . 0.0 109.978 176.462 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 68.6 mt -84.77 133.18 29.89 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.795 0 O-C-N 121.503 -0.748 . . . . 0.0 109.843 175.182 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 56.4 mt -85.4 117.04 67.97 Favored Pre-proline 0 N--CA 1.496 1.863 0 O-C-N 121.592 -0.693 . . . . 0.0 110.137 179.404 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 27.3 Cg_endo -66.71 143.95 69.86 Favored 'Trans proline' 0 N--CA 1.489 1.259 0 O-C-N 123.346 1.182 . . . . 0.0 110.311 178.602 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 47.3 tttm -96.67 105.14 17.19 Favored 'General case' 0 N--CA 1.496 1.852 0 O-C-N 121.684 -0.635 . . . . 0.0 110.175 -179.653 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 28.9 t30 -162.63 141.53 8.9 Favored 'General case' 0 N--CA 1.497 1.875 0 O-C-N 121.686 -0.633 . . . . 0.0 110.177 179.513 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 40.2 tt0 54.65 99.0 0.01 OUTLIER 'General case' 0 N--CA 1.507 2.409 0 O-C-N 121.591 -0.693 . . . . 0.0 111.014 179.431 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 81.7 mt -107.62 134.21 50.07 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.914 0 O-C-N 121.66 -0.65 . . . . 0.0 109.677 179.82 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 64' ' ' MET . . . . . . . . . . . . . 20.1 ttm 51.96 58.02 15.76 Favored Pre-proline 0 N--CA 1.504 2.269 0 O-C-N 121.589 -0.694 . . . . 0.0 110.974 -179.277 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 29.0 Cg_endo -67.6 143.86 64.15 Favored 'Trans proline' 0 N--CA 1.488 1.184 0 O-C-N 123.501 1.264 . . . . 0.0 110.367 -179.949 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 82.8 tttt -64.91 -33.79 76.86 Favored 'General case' 0 N--CA 1.501 2.081 0 O-C-N 121.716 -0.615 . . . . 0.0 110.291 179.275 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 6.1 t-20 54.85 41.55 31.82 Favored 'General case' 0 N--CA 1.505 2.28 0 O-C-N 121.559 -0.713 . . . . 0.0 110.867 -179.639 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . -105.21 41.86 2.05 Favored Glycine 0 N--CA 1.494 2.512 0 N-CA-C 109.482 -1.447 . . . . 0.0 109.482 179.402 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 22.3 m -96.93 149.26 22.09 Favored 'General case' 0 N--CA 1.495 1.817 0 O-C-N 121.667 -0.902 . . . . 0.0 110.242 -179.336 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 37.6 tttp -62.39 -39.74 94.2 Favored 'General case' 0 N--CA 1.501 2.101 0 O-C-N 121.619 -0.676 . . . . 0.0 110.473 -179.528 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 72.5 m -140.34 158.97 65.33 Favored Pre-proline 0 N--CA 1.494 1.765 0 O-C-N 121.645 -0.659 . . . . 0.0 110.126 179.25 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 18.4 Cg_exo -62.55 135.07 51.02 Favored 'Trans proline' 0 N--CA 1.49 1.268 0 O-C-N 123.617 1.325 . . . . 0.0 110.606 179.092 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 22.7 t -140.55 141.69 35.23 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.652 -0.655 . . . . 0.0 110.161 179.611 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 44.8 p -69.44 -34.2 74.08 Favored 'General case' 0 N--CA 1.499 1.978 0 O-C-N 121.692 -0.63 . . . . 0.0 110.138 179.645 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 91.6 m-20 -118.68 145.46 45.47 Favored 'General case' 0 N--CA 1.496 1.825 0 O-C-N 121.681 -0.637 . . . . 0.0 110.202 179.611 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 47.9 m -120.24 149.31 42.48 Favored 'General case' 0 N--CA 1.495 1.816 0 O-C-N 121.638 -0.664 . . . . 0.0 110.211 -179.893 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 23.7 m -100.99 137.84 38.82 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.646 -0.658 . . . . 0.0 110.13 179.784 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 18.7 tptm -101.47 142.3 33.06 Favored 'General case' 0 N--CA 1.496 1.826 0 O-C-N 121.679 -0.638 . . . . 0.0 110.287 -179.141 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 82.7 mt -89.81 155.72 18.98 Favored 'General case' 0 N--CA 1.497 1.89 0 O-C-N 121.762 -0.586 . . . . 0.0 110.125 179.197 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 49.8 mtpt 53.69 40.77 31.88 Favored 'General case' 0 N--CA 1.506 2.33 0 O-C-N 121.629 -0.669 . . . . 0.0 110.799 179.893 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 22.9 t -138.21 162.9 33.09 Favored 'General case' 0 N--CA 1.495 1.787 0 O-C-N 121.719 -0.613 . . . . 0.0 110.13 -179.998 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -66.12 144.43 56.69 Favored 'General case' 0 N--CA 1.499 2.0 0 O-C-N 121.644 -0.66 . . . . 0.0 110.339 -179.584 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 13.2 mm-40 -67.15 141.57 57.33 Favored 'General case' 0 N--CA 1.499 1.989 0 O-C-N 121.658 -0.651 . . . . 0.0 110.342 -179.04 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 25.0 m -125.16 141.66 51.97 Favored 'General case' 0 N--CA 1.494 1.769 0 O-C-N 121.68 -0.638 . . . . 0.0 110.115 179.937 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 98.0 m-85 -113.61 134.51 54.67 Favored 'General case' 0 N--CA 1.495 1.79 0 O-C-N 121.596 -0.69 . . . . 0.0 110.14 179.515 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 48.0 m -122.6 142.67 50.39 Favored 'General case' 0 N--CA 1.495 1.812 0 O-C-N 121.667 -0.646 . . . . 0.0 110.171 179.921 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 99.4 p -144.59 31.04 1.2 Allowed 'General case' 0 N--CA 1.495 1.796 0 O-C-N 121.7 -0.625 . . . . 0.0 110.396 179.073 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 31.0 ttpt -100.17 129.51 46.2 Favored 'General case' 0 N--CA 1.494 1.74 0 O-C-N 121.517 -0.739 . . . . 0.0 110.157 -179.687 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 91.6 m-20 -111.68 151.41 28.9 Favored 'General case' 0 N--CA 1.496 1.84 0 O-C-N 121.588 -0.695 . . . . 0.0 110.22 179.954 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 63.8 tttt -79.45 134.88 36.55 Favored 'General case' 0 N--CA 1.497 1.903 0 O-C-N 121.65 -0.656 . . . . 0.0 110.142 -179.824 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 91' ' ' TRP . . . . . . . . . . . . . 81.6 t90 -103.82 126.92 51.28 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.64 -0.663 . . . . 0.0 110.238 -179.811 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 27.2 t -146.14 150.21 35.47 Favored 'General case' 0 N--CA 1.494 1.773 0 O-C-N 121.717 -0.614 . . . . 0.0 110.221 179.862 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 93' ' ' MET . . . . . . . . . . . . . 73.2 mtm 56.47 -83.23 0.01 OUTLIER 'General case' 0 N--CA 1.506 2.344 0 O-C-N 121.956 -0.465 . . . . 0.0 111.325 -179.209 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 10.6 p-10 . . . . . 0 N--CA 1.496 1.874 0 O-C-N 121.102 -0.999 . . . . 0.0 110.243 -178.819 . . . . . . . . 0 0 . 1 . 022 nuclear orig full ' B' B ' 240' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 2.405 0 N-CA-C 109.501 -1.439 . . . . 0.0 109.501 . . . . . . . . . 0 0 . 1 . 022 nuclear orig full ' B' B ' 241' ' ' ALA . . . . . . . . . . . . . . . -68.27 -30.5 69.54 Favored 'General case' 0 N--CA 1.501 2.083 0 O-C-N 121.709 -0.877 . . . . 0.0 110.539 179.718 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 242' ' ' THR . . . . . . . . . . . . . 23.6 m -63.36 -37.04 85.71 Favored 'General case' 0 N--CA 1.501 2.123 0 O-C-N 121.517 -0.739 . . . . 0.0 110.607 -177.875 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 243' ' ' THR . . . . . . . . . . . . . 40.2 p -119.27 154.43 33.47 Favored 'General case' 0 N--CA 1.497 1.917 0 O-C-N 121.601 -0.687 . . . . 0.0 110.39 -178.538 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 244' ' ' LYS . . . . . . . . . . . . . 83.4 tttt -99.35 -41.3 7.5 Favored 'General case' 0 N--CA 1.496 1.826 0 O-C-N 121.673 -0.642 . . . . 0.0 110.171 179.276 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 245' ' ' GLU . . . . . . . . . . . . . 50.6 mt-10 52.72 -177.55 0.02 OUTLIER 'General case' 0 N--CA 1.507 2.387 0 O-C-N 121.601 -0.687 . . . . 0.0 111.132 -179.849 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 246' ' ' LYS . . . . . . . . . . . . . 50.1 pttt -161.14 133.09 5.77 Favored 'General case' 0 N--CA 1.496 1.866 0 O-C-N 121.613 -0.68 . . . . 0.0 110.417 -179.871 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 247' ' ' ASN . . . . . . . . . . . . . 91.8 m-20 -113.46 143.24 44.84 Favored 'General case' 0 N--CA 1.495 1.793 0 O-C-N 121.724 -0.61 . . . . 0.0 110.173 179.744 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 248' ' ' ILE . . . . . . . . . . . . . 72.6 mt 52.87 51.48 0.38 Allowed 'Isoleucine or valine' 0 N--CA 1.508 2.428 0 O-C-N 121.508 -0.745 . . . . 0.0 110.227 -179.249 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 249' ' ' SER . . . . . . . . . . . . . 58.5 m -90.32 -28.24 18.88 Favored 'General case' 0 N--CA 1.496 1.862 0 O-C-N 121.512 -0.743 . . . . 0.0 110.783 -178.572 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 250' ' ' VAL . . . . . . . . . . . . . 57.4 t -85.05 -55.23 7.08 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.01 0 O-C-N 121.558 -0.713 . . . . 0.0 109.909 -176.602 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 251' ' ' ASP . . . . . . . . . . . . . 16.1 m-20 51.04 -172.39 0.02 OUTLIER 'General case' 0 N--CA 1.506 2.365 0 O-C-N 121.542 -0.724 . . . . 0.0 111.048 -177.936 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 252' ' ' VAL . . . . . . . . . . . . . 24.1 m -153.64 127.28 1.24 Allowed 'Isoleucine or valine' 0 N--CA 1.499 2.005 0 O-C-N 121.649 -0.657 . . . . 0.0 109.788 -178.526 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 253' ' ' ASP . . . . . . . . . . . . . 5.3 m-20 -161.54 108.49 1.4 Allowed 'General case' 0 N--CA 1.497 1.882 0 O-C-N 121.822 -0.549 . . . . 0.0 109.847 -179.28 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 254' ' ' ALA . . . . . . . . . . . . . . . -66.82 -35.84 80.98 Favored 'General case' 0 N--CA 1.499 1.977 0 O-C-N 121.584 -0.697 . . . . 0.0 110.372 -179.371 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 255' ' ' ASP . . . . . . . . . . . . . 74.6 m-20 -73.7 -31.72 63.55 Favored 'General case' 0 N--CA 1.5 2.029 0 O-C-N 121.738 -0.601 . . . . 0.0 110.36 -179.593 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 256' ' ' ALA . . . . . . . . . . . . . . . -63.5 -37.09 85.97 Favored 'General case' 0 N--CA 1.501 2.1 0 O-C-N 121.626 -0.671 . . . . 0.0 110.328 179.966 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 257' ' ' SER . . . . . . . . . . . . . 45.4 m -55.53 -36.17 66.46 Favored 'General case' 0 N--CA 1.503 2.219 0 O-C-N 121.668 -0.645 . . . . 0.0 110.422 177.93 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 258' ' ' SER . . . . . . . . . . . . . 25.6 t -69.51 -32.79 71.86 Favored 'General case' 0 N--CA 1.498 1.973 0 C-N-CA 120.365 -0.534 . . . . 0.0 110.274 179.171 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 259' ' ' GLN . . . . . . . . . . . . . 29.2 tt0 -63.27 -38.37 90.88 Favored 'General case' 0 N--CA 1.501 2.1 0 O-C-N 121.629 -0.669 . . . . 0.0 110.472 -179.37 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 260' ' ' LEU . . . . . . . . . . . . . 84.5 mt -67.16 -42.33 84.48 Favored 'General case' 0 N--CA 1.5 2.027 0 O-C-N 121.652 -0.655 . . . . 0.0 110.251 179.872 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 261' ' ' LEU . . . . . . . . . . . . . 21.6 tp -70.01 -36.61 75.24 Favored 'General case' 0 N--CA 1.496 1.873 0 O-C-N 121.668 -0.645 . . . . 0.0 109.757 176.852 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 262' ' ' SER . . . . . . . . . . . . . 22.6 t -62.25 -37.51 85.72 Favored 'General case' 0 N--CA 1.501 2.086 0 O-C-N 121.745 -0.597 . . . . 0.0 110.389 177.036 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 263' ' ' LEU . . . . . . . . . . . . . 28.2 mt -64.91 -41.64 95.4 Favored 'General case' 0 N--CA 1.501 2.093 0 O-C-N 121.651 -0.655 . . . . 0.0 110.314 179.365 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 264' ' ' LEU . . . . . . . . . . . . . 85.8 mt -62.26 -34.73 77.1 Favored 'General case' 0 N--CA 1.503 2.203 0 O-C-N 121.68 -0.638 . . . . 0.0 110.516 178.601 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 265' ' ' LYS . . . . . . . . . . . . . 53.9 tttm -75.19 -34.09 61.49 Favored 'General case' 0 N--CA 1.498 1.952 0 O-C-N 121.692 -0.63 . . . . 0.0 110.065 -179.391 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 266' ' ' SER . . . . . . . . . . . . . 86.6 p -162.48 158.67 24.02 Favored 'General case' 0 N--CA 1.496 1.838 0 O-C-N 121.665 -0.647 . . . . 0.0 110.074 179.834 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 267' ' ' SER . . . . . . . . . . . . . 12.7 t -90.29 -32.27 16.6 Favored 'General case' 0 N--CA 1.496 1.844 0 O-C-N 121.662 -0.649 . . . . 0.0 110.396 -179.348 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 268' ' ' THR . . . . . . . . . . . . . 37.8 p -85.31 132.11 34.3 Favored 'General case' 0 N--CA 1.497 1.917 0 O-C-N 121.598 -0.689 . . . . 0.0 110.263 -179.192 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 269' ' ' ALA . . . . . . . . . . . . . . . -170.31 155.76 5.28 Favored Pre-proline 0 N--CA 1.499 1.994 0 O-C-N 121.658 -0.651 . . . . 0.0 109.915 179.271 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 270' ' ' PRO . . . . . . . . . . . . . 29.1 Cg_endo -67.76 128.13 17.41 Favored 'Trans proline' 0 N--CA 1.488 1.159 0 O-C-N 123.664 1.349 . . . . 0.0 110.323 179.381 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 271' ' ' SER . . . . . . . . . . . . . 4.0 m -161.73 -52.1 0.04 OUTLIER 'General case' 0 N--CA 1.495 1.818 0 O-C-N 121.703 -0.623 . . . . 0.0 110.113 179.887 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 272' ' ' ASP . . . . . . . . . . . . . 74.5 m-20 -100.07 29.75 4.11 Favored 'General case' 0 N--CA 1.496 1.835 0 O-C-N 121.726 -0.609 . . . . 0.0 110.489 179.989 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 273' ' ' LEU . . . . . . . . . . . . . 82.8 mt 57.23 -81.88 0.02 OUTLIER 'General case' 0 N--CA 1.506 2.367 0 O-C-N 121.902 -0.499 . . . . 0.0 111.287 -178.67 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 274' ' ' ALA . . . . . . . . . . . . . . . -75.05 147.3 40.79 Favored 'General case' 0 N--CA 1.498 1.974 0 O-C-N 121.21 -0.931 . . . . 0.0 110.19 -178.431 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 275' ' ' THR . . . . . . . . . . . . . 24.0 p -112.37 161.51 25.83 Favored Pre-proline 0 N--CA 1.494 1.758 0 O-C-N 121.706 -0.621 . . . . 0.0 110.162 179.841 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 276' ' ' PRO . . . . . . . . . . . . . 27.6 Cg_endo -66.89 129.39 20.73 Favored 'Trans proline' 0 N--CA 1.489 1.224 0 O-C-N 123.714 1.376 . . . . 0.0 110.443 -179.794 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 277' ' ' GLN . . . . . . . . . . . . . 4.5 mp0 -88.49 -49.87 0.41 Allowed Pre-proline 0 N--CA 1.497 1.915 0 O-C-N 121.699 -0.625 . . . . 0.0 110.79 179.947 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 278' ' ' PRO . . . . . . . . . . . . . 27.8 Cg_exo -57.49 135.39 69.5 Favored 'Trans proline' 0 N--CA 1.495 1.578 0 O-C-N 123.046 1.024 . . . . 0.0 110.839 179.054 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 279' ' ' SER . . . . . . . . . . . . . 27.3 m -67.14 -37.88 84.57 Favored 'General case' 0 N--CA 1.499 2.002 0 O-C-N 121.715 -0.616 . . . . 0.0 110.274 179.757 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 280' ' ' THR . . . . . . . . . . . . . 11.3 m 52.1 94.27 0.02 OUTLIER 'General case' 0 N--CA 1.506 2.328 0 O-C-N 121.696 -0.627 . . . . 0.0 111.052 -179.389 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 281' ' ' PHE . . . . . . . . . . . . . 50.4 p90 -140.22 130.15 13.66 Favored Pre-proline 0 N--CA 1.496 1.842 0 O-C-N 121.612 -0.68 . . . . 0.0 110.269 -179.532 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 282' ' ' PRO . . . . . . . . . . . . . 58.3 Cg_endo -78.43 91.27 1.2 Allowed 'Trans proline' 0 N--CA 1.485 1.006 0 O-C-N 123.323 1.17 . . . . 0.0 110.503 178.952 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 283' ' ' GLN . . . . . . . . . . . . . 3.0 tp60 -80.68 -51.06 1.01 Allowed Pre-proline 0 N--CA 1.497 1.889 0 O-C-N 121.63 -0.669 . . . . 0.0 110.985 178.239 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 284' ' ' PRO . . . . . . . . . . . . . 46.7 Cg_endo -75.58 157.09 40.49 Favored 'Trans proline' 0 N--CA 1.486 1.087 0 O-C-N 123.133 1.07 . . . . 0.0 110.316 -176.964 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 285' ' ' PRO . . . . . . . . . . . . . 22.4 Cg_endo -65.46 -31.92 50.51 Favored 'Trans proline' 0 N--CA 1.489 1.228 0 O-C-N 123.715 1.376 . . . . 0.0 110.587 -179.911 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 286' ' ' VAL . . . . . . . . . . . . . 61.3 t -119.42 132.81 68.17 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.929 0 O-C-N 121.687 -0.633 . . . . 0.0 109.689 179.697 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 287' ' ' GLU . . . . . . . . . . . . . 46.1 tt0 -67.54 -35.74 79.64 Favored 'General case' 0 N--CA 1.5 2.031 0 O-C-N 121.714 -0.617 . . . . 0.0 110.133 179.5 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 288' ' ' SER . . . . . . . . . . . . . 4.8 m 51.92 87.27 0.03 OUTLIER 'General case' 0 N--CA 1.507 2.395 0 O-C-N 121.686 -0.634 . . . . 0.0 111.103 -179.816 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 289' ' ' HIS . . . . . . . . . . . . . 76.6 m80 52.09 -173.97 0.03 OUTLIER 'General case' 0 N--CA 1.506 2.356 0 O-C-N 121.486 -0.759 . . . . 0.0 111.116 179.503 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 290' ' ' SER . . . . . . . . . . . . . 97.7 p -134.09 157.77 45.32 Favored 'General case' 0 N--CA 1.495 1.779 0 O-C-N 121.674 -0.641 . . . . 0.0 110.151 179.634 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 291' ' ' SER . . . . . . . . . . . . . 47.9 t . . . . . 0 N--CA 1.495 1.809 0 CA-C-O 117.974 -1.013 . . . . 0.0 110.214 -179.931 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 73.0 m . . . . . 0 N--CA 1.496 1.829 0 CA-C-O 120.983 0.42 . . . . 0.64 110.027 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 3' ' ' VAL . . . . . 0.426 HG12 ' CE1' ' A' ' 7' ' ' TYR . 66.8 t -66.55 -27.82 41.43 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.13 0 O-C-N 121.675 -0.641 . . . . 0.7 110.301 -178.486 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -55.18 -31.16 61.16 Favored 'General case' 0 N--CA 1.504 2.251 0 O-C-N 121.492 -0.755 . . . . 0.4 110.504 -178.262 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 9.7 m-20 -69.05 -30.59 68.96 Favored 'General case' 0 N--CA 1.498 1.962 0 O-C-N 121.833 -0.542 . . . . 1.17 110.304 174.903 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 6' ' ' PHE . . . . . 0.423 ' CE1' HD21 ' B' ' 260' ' ' LEU . 95.4 m-85 -95.49 10.01 38.04 Favored 'General case' 0 N--CA 1.497 1.887 0 O-C-N 121.638 -0.664 . . . . 0.66 111.537 -177.88 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 7' ' ' TYR . . . . . 0.426 ' CE1' HG12 ' A' ' 3' ' ' VAL . 3.4 m-30 -67.1 136.1 54.64 Favored 'General case' 0 N--CA 1.502 2.144 0 O-C-N 121.2 -0.938 . . . . 2.41 109.966 174.172 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 8' ' ' GLY . . . . . 0.423 ' O ' HG13 ' A' ' 24' ' ' VAL . . . 83.13 -0.9 89.5 Favored Glycine 0 N--CA 1.498 2.794 0 N-CA-C 110.583 -1.007 . . . . 0.26 110.583 -175.711 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 27.4 t -77.24 134.77 38.49 Favored 'General case' 0 N--CA 1.498 1.951 0 O-C-N 121.2 -1.176 . . . . 1.3 110.451 178.409 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 12.7 t-20 -83.52 120.03 25.43 Favored 'General case' 0 N--CA 1.497 1.896 0 O-C-N 121.623 -0.673 . . . . 2.09 109.612 173.227 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 11' ' ' VAL . . . . . 0.528 HG12 ' HA ' ' A' ' 57' ' ' ILE . 35.9 m -142.73 162.92 17.86 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.714 0 O-C-N 121.79 -0.569 . . . . 0.24 109.718 -178.89 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 12' ' ' GLU . . . . . 0.442 ' HB2' HD11 ' A' ' 58' ' ' LEU . 49.4 tt0 -109.39 147.31 32.99 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.654 -0.654 . . . . 1.06 109.533 177.04 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 13' ' ' VAL . . . . . 0.671 HG22 ' CD2' ' A' ' 55' ' ' LEU . 57.7 t -136.07 125.16 38.77 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.79 0 O-C-N 121.642 -0.661 . . . . 0.28 109.742 -174.259 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 14' ' ' LEU . . . . . 0.443 HD13 ' HG2' ' A' ' 20' ' ' LYS . 24.1 tp -95.93 127.84 42.3 Favored 'General case' 0 N--CA 1.493 1.701 0 N-CA-C 109.238 -0.653 . . . . 0.34 109.238 174.942 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 85.1 mt -92.78 171.83 8.73 Favored 'General case' 0 N--CA 1.496 1.83 0 O-C-N 121.659 -0.651 . . . . 0.28 110.887 -173.961 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 24.0 p30 -56.89 -22.39 36.93 Favored 'General case' 0 N--CA 1.505 2.281 0 O-C-N 121.731 -0.606 . . . . 0.36 111.518 -177.814 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 53.2 p-10 -92.99 22.92 4.55 Favored 'General case' 0 N--CA 1.498 1.972 0 O-C-N 121.613 -0.679 . . . . 0.72 110.835 -178.038 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 74.3 m-20 58.73 27.81 16.44 Favored 'General case' 0 N--CA 1.506 2.334 0 O-C-N 121.446 -0.784 . . . . 1.0 110.647 176.279 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 49.9 m -105.81 146.9 29.28 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.511 -0.743 . . . . 0.32 109.697 173.052 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 20' ' ' LYS . . . . . 0.443 ' HG2' HD13 ' A' ' 14' ' ' LEU . 73.6 mttt -109.55 145.55 36.16 Favored 'General case' 0 N--CA 1.495 1.783 0 O-C-N 121.572 -0.705 . . . . 1.63 110.609 -176.64 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -153.07 131.52 12.14 Favored 'General case' 0 N--CA 1.496 1.833 0 O-C-N 121.809 -0.557 . . . . 0.38 110.266 176.74 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 22' ' ' ARG . . . . . 0.519 ' O ' HD13 ' A' ' 39' ' ' LEU . 16.6 ptp180 -126.17 144.26 50.82 Favored 'General case' 0 N--CA 1.497 1.92 0 O-C-N 121.659 -0.651 . . . . 2.17 110.427 -178.133 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -171.77 171.4 44.08 Favored Glycine 0 N--CA 1.496 2.642 0 N-CA-C 109.189 -1.564 . . . . 0.25 109.189 -176.101 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 24' ' ' VAL . . . . . 0.423 HG13 ' O ' ' A' ' 8' ' ' GLY . 47.2 t -94.67 119.9 43.32 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.958 0 O-C-N 121.593 -0.945 . . . . 0.24 109.375 -176.963 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 25' ' ' ILE . . . . . 0.425 ' HA ' HD23 ' A' ' 37' ' ' LEU . 90.7 mt -64.21 144.16 14.98 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.139 0 O-C-N 121.658 -0.652 . . . . 0.48 110.531 -171.482 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 26' ' ' THR . . . . . 0.778 HG21 ' HG3' ' A' ' 38' ' ' ARG . 19.1 p -121.28 -27.28 4.89 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.823 -0.548 . . . . 0.6 111.152 178.128 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 27' ' ' ASN . . . . . 0.497 ' O ' HD12 ' A' ' 35' ' ' LEU . 2.1 t-20 -161.37 160.79 29.98 Favored 'General case' 0 N--CA 1.5 2.029 0 C-N-CA 118.97 -1.092 . . . . 1.09 111.823 -178.921 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 28' ' ' PHE . . . . . 0.493 ' CE1' HG21 ' A' ' 49' ' ' THR . 84.1 t80 -150.11 126.97 11.07 Favored 'General case' 0 N--CA 1.498 1.954 0 N-CA-C 109.138 -0.689 . . . . 0.65 109.138 170.234 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 17.9 t70 -99.7 129.16 45.8 Favored 'General case' 0 N--CA 1.491 1.619 0 N-CA-C 109.121 -0.696 . . . . 1.15 109.121 -178.263 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 22.8 m -67.41 -47.67 69.58 Favored 'General case' 0 N--CA 1.498 1.949 0 O-C-N 121.647 -0.658 . . . . 1.32 110.714 -175.609 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 22.1 m -59.47 -45.23 92.23 Favored 'General case' 0 N--CA 1.503 2.206 0 O-C-N 121.596 -0.69 . . . . 1.18 110.892 -173.878 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 91.3 m-20 -104.69 -7.09 19.83 Favored 'General case' 0 N--CA 1.497 1.891 0 O-C-N 121.645 -0.659 . . . . 1.34 111.608 -178.386 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 16.7 m 49.64 67.23 0.93 Allowed 'General case' 0 N--CA 1.507 2.422 0 O-C-N 121.058 -1.026 . . . . 1.19 110.857 -174.378 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 34' ' ' ILE . . . . . 1.039 HD12 HG22 ' A' ' 48' ' ' VAL . 45.5 mm -121.4 125.98 74.34 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.993 0 O-C-N 121.545 -0.722 . . . . 0.31 109.333 -175.224 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.497 HD12 ' O ' ' A' ' 27' ' ' ASN . 11.5 tp -115.87 120.76 40.27 Favored 'General case' 0 N--CA 1.494 1.748 0 O-C-N 121.735 -0.603 . . . . 0.26 110.559 -168.865 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 98.8 mt-30 -91.03 132.8 35.79 Favored 'General case' 0 N--CA 1.49 1.563 0 N-CA-C 109.494 -0.558 . . . . 1.02 109.494 173.87 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 37' ' ' LEU . . . . . 0.425 HD23 ' HA ' ' A' ' 25' ' ' ILE . 16.3 mt -117.86 123.82 46.82 Favored 'General case' 0 N--CA 1.495 1.819 0 O-C-N 121.824 -0.547 . . . . 0.54 109.992 176.408 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 38' ' ' ARG . . . . . 0.778 ' HG3' HG21 ' A' ' 26' ' ' THR . 26.4 mtp85 -96.79 107.09 19.51 Favored 'General case' 0 N--CA 1.496 1.87 0 O-C-N 121.651 -0.656 . . . . 2.79 109.935 175.545 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 39' ' ' LEU . . . . . 0.519 HD13 ' O ' ' A' ' 22' ' ' ARG . 17.2 tp -84.53 152.08 24.15 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.684 -0.635 . . . . 0.81 110.911 -174.618 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -66.37 -5.83 12.18 Favored 'General case' 0 N--CA 1.502 2.143 0 O-C-N 121.946 -0.471 . . . . 0.48 112.006 -172.251 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 91.1 m-20 -86.61 27.91 0.92 Allowed 'General case' 0 N--CA 1.498 1.946 0 O-C-N 121.107 -0.995 . . . . 2.36 110.925 174.504 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 8.0 t70 62.96 29.46 16.47 Favored 'General case' 0 N--CA 1.504 2.251 0 O-C-N 121.099 -1.0 . . . . 2.02 110.524 175.687 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 49.9 m -124.51 137.91 54.38 Favored 'General case' 0 N--CA 1.495 1.808 0 O-C-N 121.316 -0.865 . . . . 0.81 110.554 -179.597 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 8.6 t -97.97 151.0 20.75 Favored 'General case' 0 N--CA 1.497 1.876 0 O-C-N 121.75 -0.593 . . . . 0.66 110.116 175.265 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 37.9 ttmt -150.49 119.13 6.52 Favored 'General case' 0 N--CA 1.495 1.791 0 O-C-N 121.521 -0.737 . . . . 1.97 110.393 179.023 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 88.8 p -95.12 122.87 38.24 Favored 'General case' 0 N--CA 1.496 1.834 0 O-C-N 121.687 -0.633 . . . . 0.29 110.27 179.356 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 82.0 mt -129.36 136.36 59.58 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.866 0 O-C-N 121.654 -0.654 . . . . 0.31 109.301 179.427 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 48' ' ' VAL . . . . . 1.039 HG22 HD12 ' A' ' 34' ' ' ILE . 66.9 t -81.88 127.63 39.43 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.914 0 O-C-N 121.565 -0.709 . . . . 0.35 109.165 179.068 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 49' ' ' THR . . . . . 0.493 HG21 ' CE1' ' A' ' 28' ' ' PHE . 34.6 p -59.53 -24.86 64.04 Favored 'General case' 0 N--CA 1.504 2.266 0 O-C-N 121.56 -0.713 . . . . 0.33 111.998 -170.606 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 77.1 tttt -56.55 -25.49 52.29 Favored 'General case' 0 N--CA 1.502 2.173 0 O-C-N 121.45 -0.781 . . . . 3.28 110.943 -176.558 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 7.3 p30 -84.09 4.63 29.34 Favored 'General case' 0 N--CA 1.499 2.007 0 C-N-CA 119.714 -0.794 . . . . 0.54 111.364 176.517 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 98.2 mt -75.8 126.46 36.56 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.137 0 O-C-N 121.07 -1.019 . . . . 0.49 109.872 175.933 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 47.3 tptt -91.44 -29.95 16.76 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.833 -0.542 . . . . 1.89 109.903 170.579 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 5.3 m-20 -164.29 157.01 17.24 Favored 'General case' 0 N--CA 1.5 2.06 0 O-C-N 121.795 -0.566 . . . . 0.86 110.026 -178.136 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 55' ' ' LEU . . . . . 0.671 ' CD2' HG22 ' A' ' 13' ' ' VAL . 84.1 mt -132.97 150.74 52.14 Favored 'General case' 0 N--CA 1.497 1.92 0 O-C-N 121.756 -0.59 . . . . 0.59 110.581 -178.65 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 9.2 ptp85 -152.79 142.33 21.78 Favored 'General case' 0 N--CA 1.497 1.884 0 O-C-N 121.729 -0.607 . . . . 1.93 109.973 175.349 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 57' ' ' ILE . . . . . 0.528 ' HA ' HG12 ' A' ' 11' ' ' VAL . 68.8 mt -86.42 133.25 30.24 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.928 0 O-C-N 121.501 -0.75 . . . . 0.32 110.094 175.14 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 58' ' ' LEU . . . . . 0.482 HD11 ' HB2' ' A' ' 22' ' ' ARG . 59.6 mt . . . . . 0 N--CA 1.499 1.981 0 O-C-N 121.634 -0.666 . . . . 0.48 110.029 -179.557 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 257' ' ' SER . . . . . . . . . . . . . 49.0 m . . . . . 0 N--CA 1.503 2.207 0 CA-C-O 121.219 0.533 . . . . 1.2 110.459 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' B' B ' 258' ' ' SER . . . . . . . . . . . . . 25.4 m -69.07 -32.27 71.6 Favored 'General case' 0 N--CA 1.498 1.968 0 C-N-CA 120.502 -0.479 . . . . 1.3 110.3 -179.883 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 259' ' ' GLN . . . . . . . . . . . . . 98.5 mt-30 -63.42 -36.88 85.2 Favored 'General case' 0 N--CA 1.501 2.086 0 O-C-N 121.557 -0.714 . . . . 2.24 110.46 -179.038 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 260' ' ' LEU . . . . . 0.423 HD21 ' CE1' ' A' ' 6' ' ' PHE . 83.3 mt -68.18 -43.9 77.1 Favored 'General case' 0 N--CA 1.5 2.051 0 O-C-N 121.691 -0.631 . . . . 0.49 110.206 179.349 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 261' ' ' LEU . . . . . . . . . . . . . 21.7 tp -68.88 -35.06 76.43 Favored 'General case' 0 N--CA 1.498 1.932 0 O-C-N 121.703 -0.623 . . . . 0.39 109.756 176.039 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 262' ' ' SER . . . . . . . . . . . . . 23.1 t -62.74 -37.98 88.74 Favored 'General case' 0 N--CA 1.5 2.028 0 O-C-N 121.714 -0.616 . . . . 1.21 110.599 178.127 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 263' ' ' LEU . . . . . . . . . . . . . 33.8 mt . . . . . 0 N--CA 1.501 2.117 0 O-C-N 121.663 -0.648 . . . . 0.64 110.09 -179.212 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 70.7 m . . . . . 0 N--CA 1.495 1.794 0 CA-C-O 120.994 0.426 . . . . 0.0 110.085 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 3' ' ' VAL . . . . . 0.416 HG12 ' CE1' ' A' ' 7' ' ' TYR . 73.2 t -66.18 -27.82 41.85 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.061 0 O-C-N 121.703 -0.623 . . . . 0.0 110.278 -179.153 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -55.06 -31.07 60.87 Favored 'General case' 0 N--CA 1.505 2.295 0 O-C-N 121.454 -0.779 . . . . 0.0 110.405 -178.907 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 74.4 m-20 -68.91 -30.62 69.13 Favored 'General case' 0 N--CA 1.499 1.991 0 O-C-N 121.845 -0.534 . . . . 0.0 110.279 174.886 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 96.1 m-85 -95.63 10.13 37.85 Favored 'General case' 0 N--CA 1.497 1.909 0 O-C-N 121.652 -0.655 . . . . 0.0 111.507 -178.025 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 7' ' ' TYR . . . . . 0.416 ' CE1' HG12 ' A' ' 3' ' ' VAL . 3.1 m-30 -67.28 133.18 49.2 Favored 'General case' 0 N--CA 1.502 2.141 0 O-C-N 121.17 -0.956 . . . . 0.0 110.018 173.986 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 8' ' ' GLY . . . . . 0.417 ' O ' HG13 ' A' ' 24' ' ' VAL . . . 83.66 -2.15 87.75 Favored Glycine 0 N--CA 1.497 2.753 0 N-CA-C 110.695 -0.962 . . . . 0.0 110.695 -176.086 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 30.4 t -77.27 138.91 39.67 Favored 'General case' 0 N--CA 1.497 1.918 0 O-C-N 121.11 -1.23 . . . . 0.0 110.461 177.948 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 14.8 t-20 -83.7 121.99 28.03 Favored 'General case' 0 N--CA 1.497 1.924 0 O-C-N 121.69 -0.631 . . . . 0.0 109.659 173.652 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 11' ' ' VAL . . . . . 0.457 HG12 ' HA ' ' A' ' 57' ' ' ILE . 35.8 m -143.24 159.75 17.46 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.775 0 O-C-N 121.79 -0.568 . . . . 0.0 109.598 -179.22 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 12' ' ' GLU . . . . . 0.565 ' HB2' HD11 ' A' ' 58' ' ' LEU . 46.5 tt0 -109.45 123.74 49.87 Favored 'General case' 0 N--CA 1.493 1.71 0 C-N-CA 119.901 -0.72 . . . . 0.0 109.984 177.009 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 13' ' ' VAL . . . . . 0.594 HG22 ' CD2' ' A' ' 55' ' ' LEU . 60.3 t -106.77 123.4 61.74 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.822 0 O-C-N 121.592 -0.693 . . . . 0.0 109.964 -177.128 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 27.0 tp -96.03 127.53 42.13 Favored 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.69 -0.631 . . . . 0.0 109.622 175.537 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 84.6 mt -97.83 169.87 9.36 Favored 'General case' 0 N--CA 1.495 1.813 0 O-C-N 121.623 -0.673 . . . . 0.0 110.977 -171.945 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 25.0 p30 -58.07 -21.18 44.71 Favored 'General case' 0 N--CA 1.505 2.314 0 O-C-N 121.782 -0.574 . . . . 0.0 111.594 -178.427 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 52.9 p-10 -90.27 21.01 4.02 Favored 'General case' 0 N--CA 1.499 1.978 0 O-C-N 121.548 -0.72 . . . . 0.0 111.121 -177.372 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 74.4 m-20 58.84 27.39 16.05 Favored 'General case' 0 N--CA 1.505 2.298 0 O-C-N 121.36 -0.838 . . . . 0.0 110.734 175.046 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 49.1 m -109.76 133.85 52.67 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.486 -0.759 . . . . 0.0 109.613 172.159 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 22.2 ttpt -109.78 143.12 40.06 Favored 'General case' 0 N--CA 1.494 1.748 0 O-C-N 121.618 -0.677 . . . . 0.0 110.738 -176.377 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -153.08 159.72 42.84 Favored 'General case' 0 N--CA 1.495 1.805 0 O-C-N 121.756 -0.59 . . . . 0.0 109.838 178.264 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 22' ' ' ARG . . . . . 0.519 ' O ' HD13 ' A' ' 39' ' ' LEU . 33.9 ptt-85 -141.27 148.64 40.15 Favored 'General case' 0 N--CA 1.497 1.895 0 O-C-N 121.625 -0.672 . . . . 0.0 110.831 -178.779 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -171.7 171.41 44.06 Favored Glycine 0 N--CA 1.495 2.631 0 N-CA-C 108.805 -1.718 . . . . 0.0 108.805 -176.589 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 24' ' ' VAL . . . . . 0.417 HG13 ' O ' ' A' ' 8' ' ' GLY . 46.4 t -94.57 122.5 46.08 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.944 0 O-C-N 121.428 -1.042 . . . . 0.0 109.348 -175.371 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 25' ' ' ILE . . . . . 0.642 ' HA ' HD23 ' A' ' 37' ' ' LEU . 93.6 mt -64.85 142.73 16.54 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.152 0 O-C-N 121.665 -0.647 . . . . 0.0 110.496 -172.066 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 26' ' ' THR . . . . . 0.627 HG21 ' HB2' ' A' ' 38' ' ' ARG . 6.7 p -121.22 -26.46 5.07 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.758 -0.589 . . . . 0.0 111.363 179.09 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 27' ' ' ASN . . . . . 0.523 ' O ' HD12 ' A' ' 35' ' ' LEU . 6.9 t-20 -162.07 160.49 27.49 Favored 'General case' 0 N--CA 1.499 2.009 0 C-N-CA 118.93 -1.108 . . . . 0.0 111.912 -179.109 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 28' ' ' PHE . . . . . 0.498 ' HE1' HG21 ' A' ' 49' ' ' THR . 86.8 t80 -150.03 127.49 11.49 Favored 'General case' 0 N--CA 1.498 1.935 0 N-CA-C 109.136 -0.69 . . . . 0.0 109.136 169.18 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 17.9 t70 -99.43 130.41 45.7 Favored 'General case' 0 N--CA 1.492 1.654 0 N-CA-C 109.002 -0.74 . . . . 0.0 109.002 -177.726 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 23.1 t -68.8 -50.31 51.23 Favored 'General case' 0 N--CA 1.498 1.956 0 C-N-CA 120.097 -0.641 . . . . 0.0 110.538 -176.268 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 21.8 t -59.57 -43.0 93.72 Favored 'General case' 0 N--CA 1.502 2.147 0 O-C-N 121.614 -0.679 . . . . 0.0 110.907 -174.415 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 91.6 m-20 -103.47 -10.02 18.87 Favored 'General case' 0 N--CA 1.498 1.929 0 O-C-N 121.628 -0.67 . . . . 0.0 111.615 -178.079 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 1.9 m 49.94 67.34 0.92 Allowed 'General case' 0 N--CA 1.508 2.443 0 O-C-N 121.072 -1.018 . . . . 0.0 110.938 -174.284 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 34' ' ' ILE . . . . . 1.123 HD12 HG22 ' A' ' 48' ' ' VAL . 46.9 mm -124.31 126.51 72.17 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.09 0 O-C-N 121.615 -0.678 . . . . 0.0 109.472 -175.753 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.523 HD12 ' O ' ' A' ' 27' ' ' ASN . 11.7 tp -115.8 121.17 41.64 Favored 'General case' 0 N--CA 1.494 1.75 0 O-C-N 121.692 -0.63 . . . . 0.0 110.517 -169.243 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 78.9 mt-30 -91.27 134.33 34.66 Favored 'General case' 0 N--CA 1.491 1.577 0 N-CA-C 109.436 -0.579 . . . . 0.0 109.436 173.684 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 37' ' ' LEU . . . . . 0.642 HD23 ' HA ' ' A' ' 25' ' ' ILE . 89.3 mt -117.78 123.85 46.98 Favored 'General case' 0 N--CA 1.497 1.891 0 O-C-N 121.729 -0.607 . . . . 0.0 109.862 173.635 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 38' ' ' ARG . . . . . 0.627 ' HB2' HG21 ' A' ' 26' ' ' THR . 64.8 ttt180 -97.12 108.4 21.12 Favored 'General case' 0 N--CA 1.497 1.918 0 O-C-N 121.678 -0.639 . . . . 0.0 109.813 176.371 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 39' ' ' LEU . . . . . 0.519 HD13 ' O ' ' A' ' 22' ' ' ARG . 19.1 tp -84.81 151.85 24.05 Favored 'General case' 0 N--CA 1.494 1.77 0 O-C-N 121.758 -0.589 . . . . 0.0 110.925 -174.522 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -65.88 -6.69 13.05 Favored 'General case' 0 N--CA 1.503 2.176 0 O-C-N 121.97 -0.456 . . . . 0.0 111.951 -172.481 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 91.6 m-20 -86.58 27.81 0.93 Allowed 'General case' 0 N--CA 1.498 1.974 0 O-C-N 121.103 -0.998 . . . . 0.0 110.909 174.73 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 7.9 t70 62.99 29.45 16.43 Favored 'General case' 0 N--CA 1.505 2.275 0 O-C-N 121.078 -1.014 . . . . 0.0 110.52 175.591 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 51.0 m -123.19 137.85 54.79 Favored 'General case' 0 N--CA 1.496 1.872 0 O-C-N 121.36 -0.837 . . . . 0.0 110.411 -179.651 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 8.9 t -98.89 151.02 21.31 Favored 'General case' 0 N--CA 1.497 1.902 0 O-C-N 121.754 -0.591 . . . . 0.0 110.278 176.08 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 85.4 tttt -149.81 119.12 6.83 Favored 'General case' 0 N--CA 1.494 1.767 0 O-C-N 121.579 -0.7 . . . . 0.0 110.301 178.183 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 91.2 p -96.12 122.87 39.42 Favored 'General case' 0 N--CA 1.496 1.827 0 O-C-N 121.647 -0.658 . . . . 0.0 110.175 178.653 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 82.3 mt -129.32 136.2 60.0 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.871 0 O-C-N 121.698 -0.626 . . . . 0.0 109.377 179.682 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 48' ' ' VAL . . . . . 1.123 HG22 HD12 ' A' ' 34' ' ' ILE . 59.3 t -82.37 127.6 39.5 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.91 0 O-C-N 121.6 -0.687 . . . . 0.0 109.196 178.762 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 49' ' ' THR . . . . . 0.498 HG21 ' HE1' ' A' ' 28' ' ' PHE . 37.5 p -59.92 -24.88 64.7 Favored 'General case' 0 N--CA 1.505 2.302 0 O-C-N 121.563 -0.711 . . . . 0.0 112.021 -170.265 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 91.4 mttt -56.84 -23.65 45.62 Favored 'General case' 0 N--CA 1.503 2.204 0 O-C-N 121.461 -0.774 . . . . 0.0 111.006 -176.616 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 45.7 p30 -84.34 2.75 38.96 Favored 'General case' 0 N--CA 1.498 1.957 0 C-N-CA 119.718 -0.793 . . . . 0.0 111.402 176.407 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 98.9 mt -75.12 126.15 35.55 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.119 0 O-C-N 121.204 -0.935 . . . . 0.0 109.997 178.17 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 40.9 tttp -92.79 -28.87 16.3 Favored 'General case' 0 N--CA 1.493 1.722 0 O-C-N 121.848 -0.532 . . . . 0.0 109.954 171.111 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 5.3 m-20 -163.98 155.27 16.14 Favored 'General case' 0 N--CA 1.501 2.086 0 O-C-N 121.806 -0.559 . . . . 0.0 110.005 -178.033 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 55' ' ' LEU . . . . . 0.594 ' CD2' HG22 ' A' ' 13' ' ' VAL . 85.2 mt -132.95 149.03 52.27 Favored 'General case' 0 N--CA 1.496 1.833 0 O-C-N 121.708 -0.62 . . . . 0.0 110.563 -178.973 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 6.6 ptm180 -151.52 136.05 16.99 Favored 'General case' 0 N--CA 1.497 1.88 0 O-C-N 121.784 -0.573 . . . . 0.0 109.893 175.262 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 57' ' ' ILE . . . . . 0.457 ' HA ' HG12 ' A' ' 11' ' ' VAL . 68.7 mt -84.42 133.18 29.84 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.893 0 O-C-N 121.424 -0.798 . . . . 0.0 109.876 175.841 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 58' ' ' LEU . . . . . 0.565 HD11 ' HB2' ' A' ' 12' ' ' GLU . 32.3 mt . . . . . 0 N--CA 1.497 1.909 0 O-C-N 121.581 -0.7 . . . . 0.0 110.01 179.619 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 257' ' ' SER . . . . . . . . . . . . . 24.3 m . . . . . 0 N--CA 1.503 2.213 0 CA-C-O 121.348 0.594 . . . . 0.0 110.389 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' B' B ' 258' ' ' SER . . . . . . . . . . . . . 24.0 m -69.56 -32.75 71.72 Favored 'General case' 0 N--CA 1.498 1.934 0 C-N-CA 120.501 -0.48 . . . . 0.0 110.252 179.189 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 259' ' ' GLN . . . . . . . . . . . . . 48.4 tt0 -63.05 -37.85 88.82 Favored 'General case' 0 N--CA 1.501 2.085 0 O-C-N 121.66 -0.65 . . . . 0.0 110.494 -179.248 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 260' ' ' LEU . . . . . . . . . . . . . 84.5 mt -67.47 -42.68 82.61 Favored 'General case' 0 N--CA 1.499 2.01 0 O-C-N 121.611 -0.681 . . . . 0.0 110.154 179.69 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 261' ' ' LEU . . . . . . . . . . . . . 23.1 tp -69.65 -35.87 75.57 Favored 'General case' 0 N--CA 1.497 1.913 0 O-C-N 121.665 -0.647 . . . . 0.0 109.743 175.802 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 262' ' ' SER . . . . . . . . . . . . . 22.8 t -62.72 -38.29 89.89 Favored 'General case' 0 N--CA 1.5 2.074 0 O-C-N 121.743 -0.598 . . . . 0.0 110.634 178.013 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 263' ' ' LEU . . . . . . . . . . . . . 34.9 mt . . . . . 0 N--CA 1.501 2.123 0 O-C-N 121.673 -0.642 . . . . 0.0 110.221 -179.306 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 70.8 m . . . . . 0 N--CA 1.494 1.755 0 CA-C-O 120.982 0.42 . . . . 0.0 110.057 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 3' ' ' VAL . . . . . 0.45 HG12 ' CE1' ' A' ' 7' ' ' TYR . 67.1 t -66.69 -27.92 41.56 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.084 0 O-C-N 121.652 -0.655 . . . . 0.0 110.086 179.474 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -55.02 -30.46 59.56 Favored 'General case' 0 N--CA 1.505 2.289 0 O-C-N 121.451 -0.781 . . . . 0.0 110.395 -179.523 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 74.4 m-20 -68.46 -31.15 70.25 Favored 'General case' 0 N--CA 1.499 1.99 0 O-C-N 121.802 -0.561 . . . . 0.0 110.186 174.676 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 96.1 m-85 -96.02 10.07 38.67 Favored 'General case' 0 N--CA 1.498 1.948 0 O-C-N 121.712 -0.618 . . . . 0.0 111.469 -178.755 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 7' ' ' TYR . . . . . 0.45 ' CE1' HG12 ' A' ' 3' ' ' VAL . 3.6 m-30 -67.19 140.28 57.46 Favored 'General case' 0 N--CA 1.503 2.178 0 O-C-N 121.153 -0.967 . . . . 0.0 110.102 174.647 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 8' ' ' GLY . . . . . 0.424 ' O ' HG13 ' A' ' 24' ' ' VAL . . . 82.33 0.05 89.43 Favored Glycine 0 N--CA 1.497 2.727 0 N-CA-C 110.574 -1.01 . . . . 0.0 110.574 -175.982 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 30.2 t -77.41 134.91 38.3 Favored 'General case' 0 N--CA 1.497 1.912 0 O-C-N 121.129 -1.218 . . . . 0.0 110.492 179.208 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 11.8 t-20 -83.23 118.73 23.83 Favored 'General case' 0 N--CA 1.497 1.889 0 O-C-N 121.625 -0.672 . . . . 0.0 109.596 173.063 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 11' ' ' VAL . . . . . 0.538 HG12 ' HA ' ' A' ' 57' ' ' ILE . 35.6 m -142.45 161.68 19.04 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.678 0 O-C-N 121.674 -0.641 . . . . 0.0 109.741 -177.381 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 12' ' ' GLU . . . . . 0.525 ' HB2' HD11 ' A' ' 58' ' ' LEU . 46.7 tt0 -109.32 147.41 32.74 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.684 -0.635 . . . . 0.0 109.632 177.103 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 13' ' ' VAL . . . . . 0.594 ' CG1' HG23 ' A' ' 52' ' ' ILE . 60.9 t -137.14 126.41 36.43 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.743 0 O-C-N 121.621 -0.674 . . . . 0.0 109.709 -175.36 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 14' ' ' LEU . . . . . 0.442 HD13 ' HG2' ' A' ' 20' ' ' LYS . 23.7 tp -95.89 129.79 43.04 Favored 'General case' 0 N--CA 1.492 1.646 0 N-CA-C 109.432 -0.581 . . . . 0.0 109.432 176.525 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 0.503 HD23 ' HA ' ' A' ' 52' ' ' ILE . 82.3 mt -90.6 170.14 10.42 Favored 'General case' 0 N--CA 1.496 1.857 0 O-C-N 121.657 -0.652 . . . . 0.0 110.565 -175.53 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 23.9 p30 -56.8 -22.95 39.98 Favored 'General case' 0 N--CA 1.506 2.351 0 O-C-N 121.751 -0.593 . . . . 0.0 111.51 -177.799 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 53.6 p-10 -94.2 24.15 4.58 Favored 'General case' 0 N--CA 1.497 1.89 0 O-C-N 121.535 -0.728 . . . . 0.0 110.733 -177.714 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 10.4 m-20 59.41 28.43 17.8 Favored 'General case' 0 N--CA 1.506 2.346 0 O-C-N 121.446 -0.783 . . . . 0.0 110.607 175.721 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 50.3 m -103.87 144.83 30.98 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.437 -0.789 . . . . 0.0 109.659 172.359 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 20' ' ' LYS . . . . . 0.442 ' HG2' HD13 ' A' ' 14' ' ' LEU . 97.2 mttt -109.57 145.07 36.99 Favored 'General case' 0 N--CA 1.495 1.791 0 O-C-N 121.543 -0.723 . . . . 0.0 110.665 -176.166 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -153.05 133.4 13.58 Favored 'General case' 0 N--CA 1.496 1.86 0 O-C-N 121.713 -0.617 . . . . 0.0 110.229 176.359 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 22' ' ' ARG . . . . . 0.488 ' O ' HD13 ' A' ' 39' ' ' LEU . 35.1 ptt180 -128.48 144.78 51.2 Favored 'General case' 0 N--CA 1.498 1.957 0 O-C-N 121.685 -0.634 . . . . 0.0 110.39 -178.009 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -171.78 171.43 44.1 Favored Glycine 0 N--CA 1.496 2.635 0 N-CA-C 109.229 -1.548 . . . . 0.0 109.229 -175.36 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 24' ' ' VAL . . . . . 0.424 HG13 ' O ' ' A' ' 8' ' ' GLY . 47.4 t -94.59 119.11 42.11 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.986 0 O-C-N 121.609 -0.936 . . . . 0.0 109.355 -176.968 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 25' ' ' ILE . . . . . 0.423 ' HA ' HD23 ' A' ' 37' ' ' LEU . 89.7 mt -64.29 143.57 15.57 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.163 0 O-C-N 121.704 -0.623 . . . . 0.0 110.56 -171.381 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 26' ' ' THR . . . . . 0.584 HG21 ' HB2' ' A' ' 38' ' ' ARG . 10.1 p -121.24 -25.89 5.17 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.773 -0.58 . . . . 0.0 111.237 178.246 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 2.0 t-20 -162.28 158.07 23.76 Favored 'General case' 0 N--CA 1.501 2.121 0 O-C-N 121.0 -1.063 . . . . 0.0 111.774 -179.08 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 28' ' ' PHE . . . . . 0.568 ' HE1' HG21 ' A' ' 49' ' ' THR . 91.2 t80 -150.16 124.29 9.43 Favored 'General case' 0 N--CA 1.5 2.056 0 N-CA-C 109.361 -0.607 . . . . 0.0 109.361 171.428 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 29' ' ' ASP . . . . . 0.402 ' O ' ' N ' ' A' ' 33' ' ' SER . 21.7 t70 -98.12 126.27 43.49 Favored 'General case' 0 N--CA 1.492 1.658 0 N-CA-C 109.091 -0.707 . . . . 0.0 109.091 -179.296 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 87.0 p -65.16 -43.03 93.1 Favored 'General case' 0 N--CA 1.5 2.07 0 O-C-N 121.65 -0.656 . . . . 0.0 110.778 -174.143 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 19.6 m -60.21 -48.05 83.37 Favored 'General case' 0 N--CA 1.503 2.196 0 O-C-N 121.522 -0.736 . . . . 0.0 110.884 -173.573 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 91.7 m-20 -107.07 -0.05 23.18 Favored 'General case' 0 N--CA 1.498 1.961 0 O-C-N 121.621 -0.675 . . . . 0.0 111.697 -179.258 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 33' ' ' SER . . . . . 0.402 ' N ' ' O ' ' A' ' 29' ' ' ASP . 38.8 p 45.71 67.08 0.79 Allowed 'General case' 0 N--CA 1.508 2.45 0 O-C-N 121.423 -0.798 . . . . 0.0 111.142 -174.754 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 34' ' ' ILE . . . . . 1.074 HD12 HG22 ' A' ' 48' ' ' VAL . 44.8 mm -114.5 125.79 71.89 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.981 0 O-C-N 121.553 -0.717 . . . . 0.0 109.222 -175.917 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 11.3 tp -115.84 120.52 39.53 Favored 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.633 -0.667 . . . . 0.0 110.53 -168.605 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 67.3 mt-30 -91.04 132.11 36.21 Favored 'General case' 0 N--CA 1.489 1.51 0 N-CA-C 109.201 -0.666 . . . . 0.0 109.201 171.952 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 37' ' ' LEU . . . . . 0.423 HD23 ' HA ' ' A' ' 25' ' ' ILE . 16.7 mt -117.77 123.76 46.77 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.812 -0.555 . . . . 0.0 110.07 175.837 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 38' ' ' ARG . . . . . 0.584 ' HB2' HG21 ' A' ' 26' ' ' THR . 72.8 ttt180 -96.29 104.95 16.95 Favored 'General case' 0 N--CA 1.496 1.868 0 O-C-N 121.721 -0.612 . . . . 0.0 109.79 176.001 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 39' ' ' LEU . . . . . 0.488 HD13 ' O ' ' A' ' 22' ' ' ARG . 18.4 tp -84.56 153.63 23.13 Favored 'General case' 0 N--CA 1.495 1.803 0 O-C-N 121.699 -0.626 . . . . 0.0 110.949 -173.602 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -67.46 -4.59 11.77 Favored 'General case' 0 N--CA 1.503 2.201 0 O-C-N 121.895 -0.503 . . . . 0.0 111.986 -171.753 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 30.1 m120 -87.1 27.62 1.01 Allowed 'General case' 0 N--CA 1.498 1.925 0 O-C-N 121.063 -1.023 . . . . 0.0 110.871 174.063 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 15.3 t0 63.13 29.28 16.16 Favored 'General case' 0 N--CA 1.505 2.286 0 O-C-N 121.079 -1.013 . . . . 0.0 110.521 175.848 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 48.7 m -125.65 137.85 53.89 Favored 'General case' 0 N--CA 1.495 1.818 0 O-C-N 121.357 -0.839 . . . . 0.0 110.528 -179.33 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 9.7 t -97.94 151.03 20.7 Favored 'General case' 0 N--CA 1.497 1.917 0 O-C-N 121.764 -0.585 . . . . 0.0 110.122 174.986 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 45' ' ' LYS . . . . . 0.426 ' CE ' HD11 ' A' ' 47' ' ' ILE . 42.1 tttp -148.96 119.09 7.21 Favored 'General case' 0 N--CA 1.496 1.84 0 O-C-N 121.562 -0.711 . . . . 0.0 110.384 179.049 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 90.3 p -96.46 120.34 36.6 Favored 'General case' 0 N--CA 1.495 1.805 0 O-C-N 121.712 -0.617 . . . . 0.0 110.286 179.271 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 47' ' ' ILE . . . . . 0.426 HD11 ' CE ' ' A' ' 45' ' ' LYS . 82.5 mt -129.42 138.89 53.16 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.908 0 O-C-N 121.712 -0.618 . . . . 0.0 109.343 179.251 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 48' ' ' VAL . . . . . 1.074 HG22 HD12 ' A' ' 34' ' ' ILE . 63.2 t -82.12 127.69 39.39 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.955 0 C-N-CA 120.001 -0.679 . . . . 0.0 109.207 178.54 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 49' ' ' THR . . . . . 0.568 HG21 ' HE1' ' A' ' 28' ' ' PHE . 41.9 p -59.34 -25.08 63.9 Favored 'General case' 0 N--CA 1.504 2.235 0 O-C-N 121.624 -0.672 . . . . 0.0 112.059 -169.449 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 60.0 tttt -57.58 -23.15 49.2 Favored 'General case' 0 N--CA 1.502 2.149 0 O-C-N 121.546 -0.721 . . . . 0.0 111.261 -175.524 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 10.3 p30 -81.17 -3.46 52.26 Favored 'General case' 0 N--CA 1.499 2.01 0 C-N-CA 119.702 -0.799 . . . . 0.0 111.058 176.078 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 52' ' ' ILE . . . . . 0.761 HG21 HD11 ' A' ' 55' ' ' LEU . 95.8 mt -79.79 135.28 25.84 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.021 0 O-C-N 121.265 -0.897 . . . . 0.0 110.219 177.926 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 83.6 tttt -92.08 -28.47 17.11 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.9 -0.5 . . . . 0.0 109.785 170.294 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 54' ' ' ASP . . . . . 0.402 ' HA ' HD13 ' B' ' 261' ' ' LEU . 1.6 m-20 -164.83 158.46 17.42 Favored 'General case' 0 N--CA 1.503 2.204 0 O-C-N 121.735 -0.603 . . . . 0.0 110.287 -177.012 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 55' ' ' LEU . . . . . 0.761 HD11 HG21 ' A' ' 52' ' ' ILE . 4.2 mp -132.93 153.64 51.21 Favored 'General case' 0 N--CA 1.497 1.893 0 O-C-N 121.74 -0.6 . . . . 0.0 110.411 178.227 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 20.1 ptp180 -151.87 146.39 25.63 Favored 'General case' 0 N--CA 1.496 1.863 0 O-C-N 121.719 -0.613 . . . . 0.0 109.964 175.549 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 57' ' ' ILE . . . . . 0.538 ' HA ' HG12 ' A' ' 11' ' ' VAL . 62.4 mt -85.54 133.32 29.78 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.956 0 O-C-N 121.559 -0.713 . . . . 0.0 109.87 173.732 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 58' ' ' LEU . . . . . 0.525 HD11 ' HB2' ' A' ' 12' ' ' GLU . 61.3 mt . . . . . 0 N--CA 1.498 1.946 0 O-C-N 121.559 -0.713 . . . . 0.0 110.073 -177.971 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 257' ' ' SER . . . . . . . . . . . . . 27.1 m . . . . . 0 N--CA 1.503 2.195 0 CA-C-O 121.091 0.472 . . . . 0.0 110.643 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' B' B ' 258' ' ' SER . . . . . . . . . . . . . 60.2 p -69.32 -30.87 69.02 Favored 'General case' 0 N--CA 1.5 2.029 0 C-N-CA 120.366 -0.534 . . . . 0.0 110.4 -177.604 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 259' ' ' GLN . . . . . . . . . . . . . 47.4 tt0 -64.96 -40.1 94.48 Favored 'General case' 0 N--CA 1.5 2.051 0 O-C-N 121.623 -0.673 . . . . 0.0 110.395 -179.721 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 260' ' ' LEU . . . . . 0.461 ' HA ' HD12 ' B' ' 263' ' ' LEU . 83.7 mt -68.84 -38.98 80.19 Favored 'General case' 0 N--CA 1.499 1.993 0 O-C-N 121.686 -0.634 . . . . 0.0 110.243 179.882 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 261' ' ' LEU . . . . . 0.612 HD13 HD12 ' A' ' 55' ' ' LEU . 29.6 tp -67.91 -36.98 81.13 Favored 'General case' 0 N--CA 1.498 1.965 0 O-C-N 121.638 -0.664 . . . . 0.0 110.018 179.064 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 262' ' ' SER . . . . . . . . . . . . . 23.0 t -62.48 -38.54 90.25 Favored 'General case' 0 N--CA 1.501 2.101 0 O-C-N 121.754 -0.591 . . . . 0.0 110.465 177.587 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 263' ' ' LEU . . . . . 0.461 HD12 ' HA ' ' B' ' 260' ' ' LEU . 45.7 mt . . . . . 0 N--CA 1.501 2.076 0 O-C-N 121.663 -0.648 . . . . 0.0 110.363 179.208 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 68.6 m . . . . . 0 N--CA 1.496 1.858 0 CA-C-O 120.933 0.397 . . . . 0.0 110.047 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 3' ' ' VAL . . . . . 0.422 HG12 ' CE1' ' A' ' 7' ' ' TYR . 78.5 t -66.64 -27.75 41.09 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.06 0 O-C-N 121.699 -0.626 . . . . 0.0 110.303 -178.543 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -55.33 -31.53 61.77 Favored 'General case' 0 N--CA 1.504 2.272 0 O-C-N 121.375 -0.828 . . . . 0.0 110.399 -178.828 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 74.4 m-20 -69.04 -30.64 69.04 Favored 'General case' 0 N--CA 1.499 2.0 0 O-C-N 121.85 -0.531 . . . . 0.0 110.283 174.845 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 91.0 m-85 -95.4 10.02 37.86 Favored 'General case' 0 N--CA 1.497 1.917 0 O-C-N 121.59 -0.694 . . . . 0.0 111.536 -178.08 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 7' ' ' TYR . . . . . 0.422 ' CE1' HG12 ' A' ' 3' ' ' VAL . 2.9 m-30 -67.2 134.57 51.95 Favored 'General case' 0 N--CA 1.502 2.163 0 O-C-N 121.072 -1.017 . . . . 0.0 109.941 173.953 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 8' ' ' GLY . . . . . 0.435 ' O ' HG13 ' A' ' 24' ' ' VAL . . . 83.49 -1.05 89.3 Favored Glycine 0 N--CA 1.496 2.676 0 N-CA-C 110.84 -0.904 . . . . 0.0 110.84 -178.046 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 9' ' ' SER . . . . . 0.634 ' OG ' HD12 ' A' ' 25' ' ' ILE . 83.1 p -77.82 137.59 38.5 Favored 'General case' 0 N--CA 1.499 2.01 0 O-C-N 121.064 -1.257 . . . . 0.0 110.516 176.855 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 27.0 t-20 -85.17 119.28 25.38 Favored 'General case' 0 N--CA 1.498 1.952 0 O-C-N 121.592 -0.692 . . . . 0.0 109.925 174.102 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 11' ' ' VAL . . . . . 0.517 HG12 ' HA ' ' A' ' 57' ' ' ILE . 35.2 m -142.5 163.02 18.37 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.729 0 N-CA-C 109.448 -0.575 . . . . 0.0 109.448 -179.837 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 12' ' ' GLU . . . . . 0.527 ' HB2' HD11 ' A' ' 58' ' ' LEU . 41.8 tt0 -109.34 127.4 54.3 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.489 -0.757 . . . . 0.0 110.072 178.236 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 13' ' ' VAL . . . . . 0.61 HG22 ' CD2' ' A' ' 55' ' ' LEU . 55.5 t -106.83 124.78 62.7 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.744 0 O-C-N 121.619 -0.675 . . . . 0.0 109.913 -177.848 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 22.2 tp -96.02 126.73 41.46 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.687 -0.633 . . . . 0.0 109.456 174.31 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 86.3 mt -97.46 166.37 11.56 Favored 'General case' 0 N--CA 1.495 1.819 0 O-C-N 121.588 -0.695 . . . . 0.0 111.167 -171.38 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 16.7 p30 -58.09 -22.62 51.33 Favored 'General case' 0 N--CA 1.506 2.333 0 O-C-N 121.746 -0.596 . . . . 0.0 111.535 -177.277 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 40.3 p-10 -93.0 23.56 4.18 Favored 'General case' 0 N--CA 1.497 1.918 0 O-C-N 121.571 -0.705 . . . . 0.0 110.847 -176.551 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 74.3 m-20 59.1 27.7 16.75 Favored 'General case' 0 N--CA 1.505 2.292 0 O-C-N 121.398 -0.814 . . . . 0.0 110.671 175.838 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 50.5 m -104.62 133.98 48.55 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.502 -0.749 . . . . 0.0 109.63 172.339 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 30.2 ttmt -109.66 138.76 45.56 Favored 'General case' 0 N--CA 1.495 1.793 0 O-C-N 121.715 -0.616 . . . . 0.0 110.413 -176.008 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -153.02 160.54 43.0 Favored 'General case' 0 N--CA 1.496 1.845 0 O-C-N 121.718 -0.614 . . . . 0.0 110.278 179.438 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 6.8 ptp85 -140.69 154.44 46.37 Favored 'General case' 0 N--CA 1.496 1.831 0 O-C-N 121.665 -0.647 . . . . 0.0 110.355 -179.914 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 23' ' ' GLY . . . . . 0.515 ' HA2' HD13 ' A' ' 39' ' ' LEU . . . -171.85 171.13 43.95 Favored Glycine 0 N--CA 1.494 2.527 0 N-CA-C 109.059 -1.616 . . . . 0.0 109.059 179.429 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 24' ' ' VAL . . . . . 0.435 HG13 ' O ' ' A' ' 8' ' ' GLY . 40.9 t -94.7 123.05 46.67 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.983 0 O-C-N 121.66 -0.906 . . . . 0.0 109.259 176.3 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 25' ' ' ILE . . . . . 0.634 HD12 ' OG ' ' A' ' 9' ' ' SER . 96.0 mt -63.18 141.43 18.14 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.182 0 O-C-N 121.62 -0.675 . . . . 0.0 110.499 -171.953 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 26' ' ' THR . . . . . 0.641 HG21 ' HB2' ' A' ' 38' ' ' ARG . 12.2 p -121.15 -25.41 5.3 Favored 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.818 -0.551 . . . . 0.0 111.229 -179.545 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 27' ' ' ASN . . . . . 0.488 ' O ' HD12 ' A' ' 35' ' ' LEU . 2.0 t-20 -163.38 161.42 24.44 Favored 'General case' 0 N--CA 1.5 2.075 0 O-C-N 120.901 -1.124 . . . . 0.0 111.849 178.864 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 28' ' ' PHE . . . . . 0.453 ' HE1' HG21 ' A' ' 49' ' ' THR . 84.5 t80 -150.03 129.0 12.59 Favored 'General case' 0 N--CA 1.498 1.963 0 N-CA-C 109.23 -0.655 . . . . 0.0 109.23 169.032 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 21.2 t70 -98.77 131.23 45.06 Favored 'General case' 0 N--CA 1.492 1.625 0 N-CA-C 109.031 -0.729 . . . . 0.0 109.031 -178.359 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 87.4 p -69.81 -50.64 41.01 Favored 'General case' 0 N--CA 1.498 1.953 0 C-N-CA 120.032 -0.667 . . . . 0.0 110.616 -175.35 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 5.2 t -59.63 -42.61 93.1 Favored 'General case' 0 N--CA 1.502 2.131 0 O-C-N 121.567 -0.708 . . . . 0.0 110.782 -174.632 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 28.6 m120 -103.79 -10.06 18.56 Favored 'General case' 0 N--CA 1.496 1.875 0 O-C-N 121.663 -0.648 . . . . 0.0 111.518 -177.266 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 2.1 m 49.94 67.31 0.92 Allowed 'General case' 0 N--CA 1.508 2.452 0 O-C-N 121.027 -1.046 . . . . 0.0 110.876 -174.153 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 34' ' ' ILE . . . . . 1.125 HD12 HG22 ' A' ' 48' ' ' VAL . 45.8 mm -123.51 125.86 72.18 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.043 0 O-C-N 121.519 -0.738 . . . . 0.0 109.333 -175.698 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.488 HD12 ' O ' ' A' ' 27' ' ' ASN . 9.5 tp -115.7 122.73 46.42 Favored 'General case' 0 N--CA 1.495 1.792 0 O-C-N 121.701 -0.624 . . . . 0.0 110.628 -168.639 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 78.4 mt-30 -91.03 133.22 35.49 Favored 'General case' 0 N--CA 1.49 1.562 0 N-CA-C 109.445 -0.576 . . . . 0.0 109.445 172.318 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 13.7 mt -117.83 123.54 46.16 Favored 'General case' 0 N--CA 1.494 1.772 0 C-N-CA 120.224 -0.59 . . . . 0.0 110.036 174.676 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 38' ' ' ARG . . . . . 0.641 ' HB2' HG21 ' A' ' 26' ' ' THR . 63.3 ttt180 -104.5 105.01 14.96 Favored 'General case' 0 N--CA 1.495 1.811 0 O-C-N 121.761 -0.587 . . . . 0.0 110.132 174.62 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 39' ' ' LEU . . . . . 0.515 HD13 ' HA2' ' A' ' 23' ' ' GLY . 62.9 tp -83.65 155.45 23.18 Favored 'General case' 0 N--CA 1.499 1.977 0 O-C-N 121.535 -0.728 . . . . 0.0 110.679 -176.086 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -67.19 -3.1 6.8 Favored 'General case' 0 N--CA 1.503 2.22 0 O-C-N 121.806 -0.559 . . . . 0.0 112.154 -170.497 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 35.4 p-10 -85.75 28.99 0.73 Allowed 'General case' 0 N--CA 1.499 1.993 0 O-C-N 121.044 -1.035 . . . . 0.0 110.937 173.166 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 74.1 m-20 59.05 29.28 18.8 Favored 'General case' 0 N--CA 1.505 2.298 0 O-C-N 121.26 -0.9 . . . . 0.0 110.357 177.138 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 68.9 m -121.5 141.93 50.55 Favored 'General case' 0 N--CA 1.494 1.758 0 O-C-N 121.502 -0.748 . . . . 0.0 109.99 177.112 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 9.0 t -128.16 147.37 50.55 Favored 'General case' 0 N--CA 1.495 1.816 0 O-C-N 121.621 -0.674 . . . . 0.0 109.966 179.903 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 77.1 tttt -150.76 134.11 16.26 Favored 'General case' 0 N--CA 1.495 1.798 0 C-N-CA 120.157 -0.617 . . . . 0.0 110.595 -177.325 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 88.4 p -94.72 123.04 37.94 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.817 -0.552 . . . . 0.0 110.105 177.93 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 82.2 mt -129.25 137.92 55.76 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.857 0 N-CA-C 109.252 -0.648 . . . . 0.0 109.252 179.683 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 48' ' ' VAL . . . . . 1.125 HG22 HD12 ' A' ' 34' ' ' ILE . 58.7 t -82.41 127.61 39.48 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.874 0 O-C-N 121.598 -0.689 . . . . 0.0 109.297 179.638 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 49' ' ' THR . . . . . 0.453 HG21 ' HE1' ' A' ' 28' ' ' PHE . 34.2 p -59.88 -24.89 64.64 Favored 'General case' 0 N--CA 1.504 2.269 0 O-C-N 121.552 -0.717 . . . . 0.0 112.052 -170.727 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 51.4 mttm -57.14 -25.23 58.55 Favored 'General case' 0 N--CA 1.503 2.224 0 O-C-N 121.474 -0.766 . . . . 0.0 110.96 -176.289 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 6.4 p30 -84.35 4.85 29.39 Favored 'General case' 0 N--CA 1.499 1.998 0 C-N-CA 119.659 -0.817 . . . . 0.0 111.381 176.295 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 98.9 mt -75.59 127.72 37.1 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.13 0 O-C-N 121.119 -0.988 . . . . 0.0 109.831 175.953 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 85.3 tttt -92.9 -29.62 15.82 Favored 'General case' 0 N--CA 1.493 1.697 0 O-C-N 121.853 -0.53 . . . . 0.0 109.738 170.844 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 5.3 m-20 -164.09 155.18 15.77 Favored 'General case' 0 N--CA 1.5 2.048 0 O-C-N 121.821 -0.549 . . . . 0.0 110.091 -177.715 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 55' ' ' LEU . . . . . 0.61 ' CD2' HG22 ' A' ' 13' ' ' VAL . 80.0 mt -132.95 148.97 52.28 Favored 'General case' 0 N--CA 1.496 1.861 0 O-C-N 121.675 -0.641 . . . . 0.0 110.4 -179.346 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 19.7 ptp180 -150.8 146.46 26.39 Favored 'General case' 0 N--CA 1.496 1.874 0 O-C-N 121.75 -0.594 . . . . 0.0 109.933 174.937 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 57' ' ' ILE . . . . . 0.517 ' HA ' HG12 ' A' ' 11' ' ' VAL . 59.2 mt -86.98 133.24 30.45 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.866 0 O-C-N 121.497 -0.752 . . . . 0.0 109.97 173.455 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 58' ' ' LEU . . . . . 0.527 HD11 ' HB2' ' A' ' 12' ' ' GLU . 73.0 mt . . . . . 0 N--CA 1.498 1.955 0 O-C-N 121.628 -0.67 . . . . 0.0 110.153 -179.205 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 257' ' ' SER . . . . . . . . . . . . . 23.6 m . . . . . 0 N--CA 1.502 2.139 0 CA-C-O 121.231 0.539 . . . . 0.0 110.546 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' B' B ' 258' ' ' SER . . . . . . . . . . . . . 62.4 p -70.3 -31.79 69.27 Favored 'General case' 0 N--CA 1.498 1.973 0 C-N-CA 120.306 -0.558 . . . . 0.0 110.373 -179.265 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 259' ' ' GLN . . . . . . . . . . . . . 77.7 mt-30 -65.39 -34.87 79.32 Favored 'General case' 0 N--CA 1.501 2.085 0 O-C-N 121.597 -0.69 . . . . 0.0 110.361 -179.986 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 260' ' ' LEU . . . . . 0.419 ' HA ' HD12 ' B' ' 263' ' ' LEU . 82.7 mt -68.48 -40.93 80.75 Favored 'General case' 0 N--CA 1.499 2.018 0 O-C-N 121.661 -0.649 . . . . 0.0 110.19 179.878 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 261' ' ' LEU . . . . . . . . . . . . . 24.6 tp -69.81 -40.77 75.75 Favored 'General case' 0 N--CA 1.498 1.967 0 O-C-N 121.671 -0.643 . . . . 0.0 109.972 177.678 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 262' ' ' SER . . . . . . . . . . . . . 83.5 p -63.07 -33.85 76.34 Favored 'General case' 0 N--CA 1.501 2.081 0 O-C-N 121.678 -0.639 . . . . 0.0 110.462 177.64 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 263' ' ' LEU . . . . . 0.419 HD12 ' HA ' ' B' ' 260' ' ' LEU . 25.3 mt . . . . . 0 N--CA 1.501 2.118 0 O-C-N 121.606 -0.684 . . . . 0.0 110.204 178.682 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 73.9 m . . . . . 0 N--CA 1.496 1.87 0 CA-C-O 121.1 0.476 . . . . 0.0 110.435 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 3' ' ' VAL . . . . . 0.453 HG21 ' CE1' ' A' ' 28' ' ' PHE . 55.9 t -64.97 -27.95 43.63 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.165 0 O-C-N 121.707 -0.621 . . . . 0.0 110.408 -179.298 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -55.45 -31.39 61.91 Favored 'General case' 0 N--CA 1.504 2.234 0 O-C-N 121.418 -0.801 . . . . 0.0 110.515 -178.664 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 74.4 m-20 -68.5 -34.24 75.54 Favored 'General case' 0 N--CA 1.499 1.984 0 O-C-N 121.793 -0.567 . . . . 0.0 109.973 174.787 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 6' ' ' PHE . . . . . 0.411 ' CD1' HD21 ' B' ' 260' ' ' LEU . 96.6 m-85 -97.5 10.12 40.64 Favored 'General case' 0 N--CA 1.496 1.867 0 O-C-N 121.732 -0.605 . . . . 0.0 111.246 178.931 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -67.41 127.95 34.61 Favored 'General case' 0 N--CA 1.501 2.09 0 O-C-N 121.223 -0.923 . . . . 0.0 110.162 -178.661 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 8' ' ' GLY . . . . . 0.456 ' O ' HG13 ' A' ' 24' ' ' VAL . . . 83.24 -2.11 87.58 Favored Glycine 0 N--CA 1.498 2.77 0 N-CA-C 110.851 -0.899 . . . . 0.0 110.851 -177.51 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 57.0 p -76.85 145.05 38.61 Favored 'General case' 0 N--CA 1.498 1.949 0 O-C-N 120.969 -1.312 . . . . 0.0 110.168 177.499 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 10' ' ' ASN . . . . . 0.78 ' CG ' HG22 ' A' ' 24' ' ' VAL . 2.3 m-20 -85.21 119.27 25.41 Favored 'General case' 0 N--CA 1.496 1.87 0 O-C-N 121.644 -0.66 . . . . 0.0 109.598 174.785 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 11' ' ' VAL . . . . . 0.479 HG12 ' HA ' ' A' ' 57' ' ' ILE . 32.9 m -142.44 159.84 19.42 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.846 0 O-C-N 121.69 -0.631 . . . . 0.0 109.754 179.885 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 12' ' ' GLU . . . . . 0.577 ' HB2' HD11 ' A' ' 58' ' ' LEU . 46.5 tt0 -109.4 128.94 55.52 Favored 'General case' 0 N--CA 1.494 1.731 0 C-N-CA 119.912 -0.715 . . . . 0.0 110.169 179.023 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 13' ' ' VAL . . . . . 0.562 HG22 ' CD2' ' A' ' 55' ' ' LEU . 60.4 t -106.78 127.69 62.1 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.766 0 O-C-N 121.728 -0.608 . . . . 0.0 109.957 -179.289 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 14' ' ' LEU . . . . . 0.533 HD13 ' HG2' ' A' ' 20' ' ' LYS . 29.0 tp -95.74 127.73 42.02 Favored 'General case' 0 N--CA 1.494 1.733 0 N-CA-C 109.125 -0.695 . . . . 0.0 109.125 173.776 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 83.8 mt -96.05 168.27 10.72 Favored 'General case' 0 N--CA 1.495 1.821 0 O-C-N 121.653 -0.654 . . . . 0.0 111.097 -172.846 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 24.2 p30 -57.89 -22.06 46.48 Favored 'General case' 0 N--CA 1.506 2.333 0 O-C-N 121.815 -0.553 . . . . 0.0 111.484 -178.537 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 25.1 p30 -91.29 22.36 3.91 Favored 'General case' 0 N--CA 1.499 1.996 0 O-C-N 121.586 -0.696 . . . . 0.0 111.078 -177.364 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 74.4 m-20 59.79 28.53 18.01 Favored 'General case' 0 N--CA 1.506 2.361 0 O-C-N 121.393 -0.817 . . . . 0.0 110.813 172.805 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 17.9 m -111.49 147.32 35.58 Favored 'General case' 0 N--CA 1.494 1.743 0 O-C-N 121.474 -0.766 . . . . 0.0 109.573 171.229 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 20' ' ' LYS . . . . . 0.533 ' HG2' HD13 ' A' ' 14' ' ' LEU . 97.1 mttt -109.59 150.29 28.43 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.616 -0.677 . . . . 0.0 110.608 -177.248 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -153.01 154.15 34.35 Favored 'General case' 0 N--CA 1.496 1.867 0 O-C-N 121.824 -0.548 . . . . 0.0 109.999 176.188 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 22' ' ' ARG . . . . . 0.405 ' O ' HD22 ' A' ' 39' ' ' LEU . 7.7 ptp85 -138.22 150.41 46.71 Favored 'General case' 0 N--CA 1.494 1.765 0 O-C-N 121.569 -0.707 . . . . 0.0 110.494 179.75 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 23' ' ' GLY . . . . . 0.425 ' HA2' HD13 ' A' ' 39' ' ' LEU . . . -171.83 171.16 43.96 Favored Glycine 0 N--CA 1.492 2.383 0 N-CA-C 109.069 -1.613 . . . . 0.0 109.069 -178.958 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 24' ' ' VAL . . . . . 0.78 HG22 ' CG ' ' A' ' 10' ' ' ASN . 40.6 t -94.48 125.39 47.1 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.912 0 O-C-N 121.676 -0.896 . . . . 0.0 109.082 176.156 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 25' ' ' ILE . . . . . 0.498 ' HA ' HD23 ' A' ' 37' ' ' LEU . 45.7 mt -61.23 137.03 24.13 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.259 0 O-C-N 121.568 -0.707 . . . . 0.0 110.824 -171.554 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 26' ' ' THR . . . . . 0.709 HG21 ' HB2' ' A' ' 38' ' ' ARG . 10.0 p -121.15 -19.81 6.99 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.921 -0.487 . . . . 0.0 111.581 -178.25 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 4.0 t-20 -165.74 158.14 14.97 Favored 'General case' 0 N--CA 1.504 2.268 0 O-C-N 120.886 -1.134 . . . . 0.0 111.937 176.517 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 28' ' ' PHE . . . . . 0.453 ' CE1' HG21 ' A' ' 3' ' ' VAL . 77.2 t80 -150.34 119.99 7.0 Favored 'General case' 0 N--CA 1.496 1.853 0 N-CA-C 109.101 -0.703 . . . . 0.0 109.101 172.618 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 21.2 t70 -98.21 128.28 44.59 Favored 'General case' 0 N--CA 1.492 1.641 0 N-CA-C 109.248 -0.649 . . . . 0.0 109.248 -176.949 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 22.7 m -67.48 -47.97 68.51 Favored 'General case' 0 N--CA 1.498 1.956 0 O-C-N 121.578 -0.701 . . . . 0.0 110.661 -175.856 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 22.2 m -59.32 -45.49 91.2 Favored 'General case' 0 N--CA 1.502 2.164 0 O-C-N 121.591 -0.693 . . . . 0.0 110.897 -174.058 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 91.4 m-20 -105.53 -5.63 20.05 Favored 'General case' 0 N--CA 1.496 1.861 0 O-C-N 121.63 -0.669 . . . . 0.0 111.743 -177.973 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 58.7 m 49.42 67.18 0.93 Allowed 'General case' 0 N--CA 1.508 2.461 0 O-C-N 121.023 -1.048 . . . . 0.0 110.925 -174.277 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 34' ' ' ILE . . . . . 1.09 HD12 HG22 ' A' ' 48' ' ' VAL . 44.5 mm -117.7 125.9 74.4 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.974 0 O-C-N 121.537 -0.727 . . . . 0.0 109.236 -175.407 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 11.0 tp -115.93 118.97 34.44 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.687 -0.633 . . . . 0.0 110.477 -170.539 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 78.2 mt-30 -91.51 133.34 35.59 Favored 'General case' 0 N--CA 1.49 1.537 0 N-CA-C 109.333 -0.617 . . . . 0.0 109.333 171.872 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 37' ' ' LEU . . . . . 0.498 HD23 ' HA ' ' A' ' 25' ' ' ILE . 52.0 mt -117.84 123.55 46.17 Favored 'General case' 0 N--CA 1.493 1.684 0 C-N-CA 120.222 -0.591 . . . . 0.0 110.009 174.535 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 38' ' ' ARG . . . . . 0.709 ' HB2' HG21 ' A' ' 26' ' ' THR . 40.7 ttp180 -105.65 104.97 14.8 Favored 'General case' 0 N--CA 1.496 1.826 0 O-C-N 121.758 -0.589 . . . . 0.0 110.126 174.137 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 39' ' ' LEU . . . . . 0.425 HD13 ' HA2' ' A' ' 23' ' ' GLY . 64.5 tp -83.59 156.53 22.7 Favored 'General case' 0 N--CA 1.499 1.982 0 O-C-N 121.64 -0.663 . . . . 0.0 110.616 -175.977 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -68.05 -3.03 8.88 Favored 'General case' 0 N--CA 1.502 2.166 0 O-C-N 121.898 -0.501 . . . . 0.0 112.208 -170.582 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 30.1 m120 -86.75 29.13 0.82 Allowed 'General case' 0 N--CA 1.499 1.986 0 O-C-N 121.104 -0.997 . . . . 0.0 110.782 173.734 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 73.1 m-20 60.76 31.54 20.1 Favored 'General case' 0 N--CA 1.506 2.332 0 O-C-N 121.213 -0.929 . . . . 0.0 110.278 175.728 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 67.0 m -125.76 138.62 53.86 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.447 -0.783 . . . . 0.0 109.981 177.33 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 9.1 t -128.21 147.26 50.57 Favored 'General case' 0 N--CA 1.496 1.85 0 O-C-N 121.652 -0.655 . . . . 0.0 109.988 179.511 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 7.6 tmtm? -150.63 135.93 17.84 Favored 'General case' 0 N--CA 1.495 1.794 0 O-C-N 121.666 -0.646 . . . . 0.0 110.439 -177.959 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 88.5 p -94.67 124.51 38.75 Favored 'General case' 0 N--CA 1.495 1.813 0 O-C-N 121.745 -0.597 . . . . 0.0 110.208 178.372 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 82.8 mt -129.32 133.92 64.69 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.894 0 O-C-N 121.687 -0.633 . . . . 0.0 109.356 179.238 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 48' ' ' VAL . . . . . 1.09 HG22 HD12 ' A' ' 34' ' ' ILE . 63.6 t -81.88 127.74 39.33 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.925 0 C-N-CA 119.999 -0.68 . . . . 0.0 109.182 179.214 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 49' ' ' THR . . . . . 0.405 ' HB ' HD12 ' A' ' 52' ' ' ILE . 80.8 p -57.37 -25.06 58.87 Favored 'General case' 0 N--CA 1.506 2.37 0 O-C-N 121.474 -0.766 . . . . 0.0 111.927 -168.197 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 16.0 ttpp -56.8 -26.36 57.7 Favored 'General case' 0 N--CA 1.501 2.116 0 O-C-N 121.464 -0.773 . . . . 0.0 111.022 -177.126 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 5.0 p30 -84.83 6.13 25.88 Favored 'General case' 0 N--CA 1.498 1.946 0 C-N-CA 119.729 -0.788 . . . . 0.0 111.389 176.709 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 52' ' ' ILE . . . . . 0.405 HD12 ' HB ' ' A' ' 49' ' ' THR . 97.7 mt -75.67 126.73 36.74 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.144 0 O-C-N 121.151 -0.968 . . . . 0.0 109.909 176.095 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 76.3 tttt -93.13 -29.17 15.9 Favored 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.802 -0.561 . . . . 0.0 109.929 170.727 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 5.0 m-20 -163.71 154.86 16.32 Favored 'General case' 0 N--CA 1.501 2.075 0 O-C-N 121.723 -0.611 . . . . 0.0 110.112 -177.836 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 55' ' ' LEU . . . . . 0.562 ' CD2' HG22 ' A' ' 13' ' ' VAL . 86.7 mt -132.99 148.22 52.27 Favored 'General case' 0 N--CA 1.497 1.886 0 O-C-N 121.667 -0.645 . . . . 0.0 110.507 -179.248 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 4.7 ptm180 -152.19 142.33 22.3 Favored 'General case' 0 N--CA 1.495 1.793 0 O-C-N 121.757 -0.589 . . . . 0.0 109.959 175.934 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 57' ' ' ILE . . . . . 0.479 ' HA ' HG12 ' A' ' 11' ' ' VAL . 69.9 mt -85.07 133.14 30.04 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.86 0 O-C-N 121.495 -0.753 . . . . 0.0 109.678 172.575 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 58' ' ' LEU . . . . . 0.577 HD11 ' HB2' ' A' ' 12' ' ' GLU . 40.6 mt . . . . . 0 N--CA 1.497 1.905 0 O-C-N 121.496 -0.752 . . . . 0.0 110.204 -177.975 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 257' ' ' SER . . . . . . . . . . . . . 36.8 m . . . . . 0 N--CA 1.503 2.195 0 CA-C-O 121.165 0.507 . . . . 0.0 110.659 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' B' B ' 258' ' ' SER . . . . . . . . . . . . . 59.8 p -69.85 -29.63 66.92 Favored 'General case' 0 N--CA 1.5 2.039 0 C-N-CA 120.268 -0.573 . . . . 0.0 110.468 -178.225 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 259' ' ' GLN . . . . . . . . . . . . . 98.8 mt-30 -64.0 -38.77 92.28 Favored 'General case' 0 N--CA 1.502 2.126 0 O-C-N 121.547 -0.721 . . . . 0.0 110.487 -179.698 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 260' ' ' LEU . . . . . 0.485 ' HA ' HD12 ' B' ' 263' ' ' LEU . 81.3 mt -67.77 -44.29 77.8 Favored 'General case' 0 N--CA 1.501 2.076 0 O-C-N 121.608 -0.682 . . . . 0.0 110.246 179.713 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 261' ' ' LEU . . . . . . . . . . . . . 22.8 tp -68.61 -35.94 78.0 Favored 'General case' 0 N--CA 1.497 1.899 0 O-C-N 121.652 -0.655 . . . . 0.0 109.799 176.778 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 262' ' ' SER . . . . . . . . . . . . . 23.0 t -62.3 -36.72 83.02 Favored 'General case' 0 N--CA 1.5 2.064 0 O-C-N 121.753 -0.592 . . . . 0.0 110.457 177.521 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 263' ' ' LEU . . . . . 0.485 HD12 ' HA ' ' B' ' 260' ' ' LEU . 23.2 mt . . . . . 0 N--CA 1.501 2.109 0 O-C-N 121.703 -0.623 . . . . 0.0 110.099 179.582 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 69.8 m . . . . . 0 N--CA 1.495 1.81 0 CA-C-O 120.928 0.394 . . . . 0.0 110.167 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 3' ' ' VAL . . . . . 0.449 HG12 ' CE1' ' A' ' 7' ' ' TYR . 65.7 t -66.45 -27.8 41.46 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.054 0 O-C-N 121.761 -0.587 . . . . 0.0 110.274 -179.368 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -55.3 -31.11 61.37 Favored 'General case' 0 N--CA 1.504 2.231 0 O-C-N 121.376 -0.828 . . . . 0.0 110.388 -179.033 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 9.7 m-20 -68.66 -31.13 70.04 Favored 'General case' 0 N--CA 1.499 1.985 0 O-C-N 121.821 -0.549 . . . . 0.0 110.222 174.647 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 96.4 m-85 -95.67 10.07 38.1 Favored 'General case' 0 N--CA 1.497 1.908 0 O-C-N 121.585 -0.697 . . . . 0.0 111.531 -178.955 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 7' ' ' TYR . . . . . 0.449 ' CE1' HG12 ' A' ' 3' ' ' VAL . 3.3 m-30 -67.24 139.05 57.33 Favored 'General case' 0 N--CA 1.502 2.17 0 O-C-N 121.196 -0.94 . . . . 0.0 109.961 174.783 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 82.84 -0.32 89.68 Favored Glycine 0 N--CA 1.497 2.762 0 N-CA-C 110.602 -0.999 . . . . 0.0 110.602 -175.541 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 29.0 t -76.57 137.66 39.68 Favored 'General case' 0 N--CA 1.498 1.935 0 O-C-N 121.154 -1.204 . . . . 0.0 110.509 -179.991 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 10' ' ' ASN . . . . . 0.667 ' CG ' HG22 ' A' ' 24' ' ' VAL . 2.4 m120 -84.14 115.59 22.48 Favored 'General case' 0 N--CA 1.498 1.97 0 O-C-N 121.684 -0.635 . . . . 0.0 109.418 174.143 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 11' ' ' VAL . . . . . 0.646 HG21 HD11 ' A' ' 25' ' ' ILE . 35.7 m -141.89 162.45 20.11 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.725 0 O-C-N 121.699 -0.626 . . . . 0.0 109.769 -178.443 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 12' ' ' GLU . . . . . 0.569 ' HB2' HD11 ' A' ' 58' ' ' LEU . 47.0 tt0 -109.48 129.11 55.58 Favored 'General case' 0 N--CA 1.492 1.675 0 C-N-CA 119.914 -0.714 . . . . 0.0 110.012 177.933 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 13' ' ' VAL . . . . . 0.56 HG22 ' CD2' ' A' ' 55' ' ' LEU . 61.7 t -106.66 126.53 62.5 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.655 0 O-C-N 121.614 -0.679 . . . . 0.0 109.838 -179.439 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 14' ' ' LEU . . . . . 0.413 HD13 ' HG2' ' A' ' 20' ' ' LYS . 28.5 tp -95.86 126.63 41.25 Favored 'General case' 0 N--CA 1.493 1.703 0 N-CA-C 109.155 -0.683 . . . . 0.0 109.155 175.14 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 86.8 mt -96.39 167.11 11.37 Favored 'General case' 0 N--CA 1.496 1.836 0 O-C-N 121.587 -0.696 . . . . 0.0 111.076 -172.822 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 24.3 p30 -58.54 -21.81 53.6 Favored 'General case' 0 N--CA 1.504 2.263 0 O-C-N 121.82 -0.55 . . . . 0.0 111.685 -176.96 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 41.8 p-10 -92.76 23.51 4.09 Favored 'General case' 0 N--CA 1.497 1.924 0 O-C-N 121.531 -0.731 . . . . 0.0 110.899 -176.191 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 74.3 m-20 58.73 27.57 16.13 Favored 'General case' 0 N--CA 1.505 2.307 0 O-C-N 121.472 -0.767 . . . . 0.0 110.606 176.06 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 50.6 m -106.37 144.57 32.87 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.527 -0.733 . . . . 0.0 109.485 172.741 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 20' ' ' LYS . . . . . 0.413 ' HG2' HD13 ' A' ' 14' ' ' LEU . 74.4 mttt -109.64 148.83 30.64 Favored 'General case' 0 N--CA 1.496 1.836 0 O-C-N 121.582 -0.699 . . . . 0.0 110.557 -176.305 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -153.05 153.56 33.1 Favored 'General case' 0 N--CA 1.496 1.869 0 O-C-N 121.717 -0.614 . . . . 0.0 110.248 176.123 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 22' ' ' ARG . . . . . 0.503 ' O ' HD13 ' A' ' 39' ' ' LEU . 31.1 ptt180 -144.0 143.25 31.12 Favored 'General case' 0 N--CA 1.498 1.951 0 O-C-N 121.663 -0.648 . . . . 0.0 110.533 178.265 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -171.78 171.45 44.11 Favored Glycine 0 N--CA 1.494 2.51 0 N-CA-C 108.878 -1.689 . . . . 0.0 108.878 -174.986 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 24' ' ' VAL . . . . . 0.667 HG22 ' CG ' ' A' ' 10' ' ' ASN . 39.5 t -94.54 118.37 40.42 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.916 0 O-C-N 121.468 -1.019 . . . . 0.0 109.382 -176.461 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 25' ' ' ILE . . . . . 0.646 HD11 HG21 ' A' ' 11' ' ' VAL . 76.5 mt -63.72 143.27 15.81 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.122 0 O-C-N 121.657 -0.652 . . . . 0.0 110.442 -172.064 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 26' ' ' THR . . . . . 0.623 HG21 ' HB2' ' A' ' 38' ' ' ARG . 7.0 p -121.2 -27.76 4.83 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.733 -0.604 . . . . 0.0 111.283 -179.664 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 7.3 t-20 -161.94 158.25 24.98 Favored 'General case' 0 N--CA 1.499 2.012 0 C-N-CA 119.004 -1.078 . . . . 0.0 111.594 -177.622 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 28' ' ' PHE . . . . . 0.512 ' CE1' HG21 ' A' ' 49' ' ' THR . 77.1 t80 -150.1 126.71 10.92 Favored 'General case' 0 N--CA 1.498 1.936 0 N-CA-C 109.235 -0.654 . . . . 0.0 109.235 170.17 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 17.8 t70 -100.31 130.98 46.49 Favored 'General case' 0 N--CA 1.491 1.594 0 N-CA-C 109.095 -0.705 . . . . 0.0 109.095 -177.711 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 19.5 m -68.55 -48.69 63.62 Favored 'General case' 0 N--CA 1.498 1.975 0 C-N-CA 120.031 -0.668 . . . . 0.0 110.629 -175.703 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 25.2 m -59.49 -44.16 93.15 Favored 'General case' 0 N--CA 1.503 2.206 0 O-C-N 121.57 -0.706 . . . . 0.0 110.859 -174.078 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 29.6 m120 -103.88 -8.84 19.4 Favored 'General case' 0 N--CA 1.497 1.882 0 O-C-N 121.622 -0.674 . . . . 0.0 111.52 -178.164 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 16.1 m 49.46 67.22 0.92 Allowed 'General case' 0 N--CA 1.507 2.387 0 O-C-N 121.141 -0.974 . . . . 0.0 110.928 -174.381 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 34' ' ' ILE . . . . . 1.076 HD12 HG22 ' A' ' 48' ' ' VAL . 45.8 mm -121.96 125.91 73.78 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.071 0 O-C-N 121.629 -0.669 . . . . 0.0 109.407 -175.679 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 7.3 tp -115.81 119.69 36.83 Favored 'General case' 0 N--CA 1.494 1.767 0 O-C-N 121.648 -0.658 . . . . 0.0 110.429 -168.847 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 98.9 mt-30 -90.98 134.25 34.63 Favored 'General case' 0 N--CA 1.49 1.544 0 C-N-CA 120.315 -0.554 . . . . 0.0 109.576 174.72 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 37' ' ' LEU . . . . . 0.421 HD23 ' HA ' ' A' ' 25' ' ' ILE . 15.8 mt -117.79 123.83 46.91 Favored 'General case' 0 N--CA 1.495 1.787 0 O-C-N 121.939 -0.476 . . . . 0.0 109.966 174.72 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 38' ' ' ARG . . . . . 0.623 ' HB2' HG21 ' A' ' 26' ' ' THR . 74.4 ttt-85 -97.27 106.2 18.48 Favored 'General case' 0 N--CA 1.497 1.897 0 O-C-N 121.741 -0.6 . . . . 0.0 109.779 175.746 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 39' ' ' LEU . . . . . 0.503 HD13 ' O ' ' A' ' 22' ' ' ARG . 18.8 tp -84.72 152.06 23.98 Favored 'General case' 0 N--CA 1.495 1.777 0 O-C-N 121.678 -0.639 . . . . 0.0 110.877 -174.227 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -68.14 -3.55 10.84 Favored 'General case' 0 N--CA 1.502 2.146 0 O-C-N 121.928 -0.482 . . . . 0.0 111.982 -172.455 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 23.2 m120 -87.05 27.56 1.01 Allowed 'General case' 0 N--CA 1.498 1.941 0 O-C-N 121.07 -1.019 . . . . 0.0 110.923 173.545 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 14.8 t0 63.11 29.31 16.2 Favored 'General case' 0 N--CA 1.505 2.279 0 O-C-N 121.042 -1.036 . . . . 0.0 110.523 176.088 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 50.7 m -125.08 137.8 54.19 Favored 'General case' 0 N--CA 1.495 1.81 0 O-C-N 121.313 -0.867 . . . . 0.0 110.568 -179.267 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 9.8 t -98.11 151.04 20.8 Favored 'General case' 0 N--CA 1.496 1.845 0 O-C-N 121.817 -0.552 . . . . 0.0 110.208 175.362 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 33.6 ttmt -150.2 119.17 6.68 Favored 'General case' 0 N--CA 1.495 1.817 0 O-C-N 121.525 -0.734 . . . . 0.0 110.362 178.577 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 89.7 p -96.2 123.81 39.96 Favored 'General case' 0 N--CA 1.495 1.797 0 O-C-N 121.675 -0.64 . . . . 0.0 110.249 179.079 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 82.5 mt -129.4 135.89 60.62 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.887 0 N-CA-C 109.309 -0.626 . . . . 0.0 109.309 179.203 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 48' ' ' VAL . . . . . 1.076 HG22 HD12 ' A' ' 34' ' ' ILE . 64.0 t -81.87 127.6 39.46 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.895 0 C-N-CA 120.032 -0.667 . . . . 0.0 109.265 179.358 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 49' ' ' THR . . . . . 0.512 HG21 ' CE1' ' A' ' 28' ' ' PHE . 39.0 p -59.17 -24.85 63.42 Favored 'General case' 0 N--CA 1.504 2.239 0 O-C-N 121.668 -0.645 . . . . 0.0 112.071 -169.744 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 63.4 tttt -56.46 -24.1 43.33 Favored 'General case' 0 N--CA 1.504 2.227 0 O-C-N 121.46 -0.775 . . . . 0.0 110.981 -176.824 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 46.5 p30 -83.91 2.52 38.22 Favored 'General case' 0 N--CA 1.499 1.987 0 O-C-N 121.468 -0.77 . . . . 0.0 111.281 176.598 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 98.8 mt -75.47 127.34 36.95 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.113 0 O-C-N 121.195 -0.941 . . . . 0.0 109.987 177.978 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 50.4 tttm -92.45 -29.79 16.07 Favored 'General case' 0 N--CA 1.494 1.739 0 O-C-N 121.871 -0.518 . . . . 0.0 109.652 170.506 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 54' ' ' ASP . . . . . 0.411 ' HA ' HD22 ' B' ' 261' ' ' LEU . 5.3 m-20 -163.95 156.89 17.94 Favored 'General case' 0 N--CA 1.499 2.022 0 O-C-N 121.795 -0.566 . . . . 0.0 110.053 -178.141 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 55' ' ' LEU . . . . . 0.56 ' CD2' HG22 ' A' ' 13' ' ' VAL . 84.3 mt -133.01 148.54 52.25 Favored 'General case' 0 N--CA 1.496 1.858 0 O-C-N 121.675 -0.641 . . . . 0.0 110.513 -179.376 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 6.5 ptm180 -151.94 143.04 23.2 Favored 'General case' 0 N--CA 1.495 1.812 0 O-C-N 121.673 -0.642 . . . . 0.0 110.046 176.006 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 57' ' ' ILE . . . . . 0.504 ' HA ' HG12 ' A' ' 11' ' ' VAL . 68.7 mt -85.33 133.2 29.98 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.843 0 O-C-N 121.443 -0.786 . . . . 0.0 109.718 173.218 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 58' ' ' LEU . . . . . 0.569 HD11 ' HB2' ' A' ' 12' ' ' GLU . 59.2 mt . . . . . 0 N--CA 1.497 1.915 0 O-C-N 121.583 -0.698 . . . . 0.0 110.164 -179.021 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 257' ' ' SER . . . . . . . . . . . . . 40.5 m . . . . . 0 N--CA 1.504 2.248 0 CA-C-O 121.24 0.543 . . . . 0.0 110.373 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' B' B ' 258' ' ' SER . . . . . . . . . . . . . 25.3 m -69.29 -33.23 72.87 Favored 'General case' 0 N--CA 1.499 1.983 0 C-N-CA 120.423 -0.511 . . . . 0.0 110.272 179.855 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 259' ' ' GLN . . . . . . . . . . . . . 78.2 mt-30 -63.79 -36.99 85.7 Favored 'General case' 0 N--CA 1.501 2.084 0 O-C-N 121.628 -0.67 . . . . 0.0 110.43 -179.433 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 260' ' ' LEU . . . . . 0.458 ' HA ' HD12 ' B' ' 263' ' ' LEU . 82.7 mt -66.59 -42.66 86.63 Favored 'General case' 0 N--CA 1.5 2.072 0 O-C-N 121.639 -0.663 . . . . 0.0 110.231 179.556 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 261' ' ' LEU . . . . . 0.411 HD22 ' HA ' ' A' ' 54' ' ' ASP . 22.5 tp -70.43 -37.49 74.39 Favored 'General case' 0 N--CA 1.498 1.928 0 O-C-N 121.719 -0.613 . . . . 0.0 109.749 176.511 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 262' ' ' SER . . . . . . . . . . . . . 22.8 t -62.53 -36.92 84.14 Favored 'General case' 0 N--CA 1.5 2.051 0 O-C-N 121.771 -0.581 . . . . 0.0 110.443 176.896 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 263' ' ' LEU . . . . . 0.458 HD12 ' HA ' ' B' ' 260' ' ' LEU . 24.1 mt . . . . . 0 N--CA 1.5 2.074 0 O-C-N 121.681 -0.637 . . . . 0.0 110.28 179.691 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 69.5 m . . . . . 0 N--CA 1.495 1.791 0 CA-C-O 121.016 0.436 . . . . 0.0 110.263 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 57.3 t -65.2 -27.99 43.48 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.164 0 O-C-N 121.702 -0.624 . . . . 0.0 110.194 179.192 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -55.19 -31.76 61.67 Favored 'General case' 0 N--CA 1.505 2.283 0 O-C-N 121.518 -0.739 . . . . 0.0 110.349 179.902 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 74.5 m-20 -68.64 -35.9 77.9 Favored 'General case' 0 N--CA 1.499 1.994 0 O-C-N 121.818 -0.551 . . . . 0.0 109.942 175.444 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 97.7 m-85 -97.67 10.0 41.12 Favored 'General case' 0 N--CA 1.497 1.892 0 O-C-N 121.708 -0.62 . . . . 0.0 111.217 178.877 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -67.41 128.63 37.15 Favored 'General case' 0 N--CA 1.501 2.082 0 O-C-N 121.257 -0.902 . . . . 0.0 110.061 179.048 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 8' ' ' GLY . . . . . 0.469 ' O ' HG13 ' A' ' 24' ' ' VAL . . . 82.24 -0.73 88.56 Favored Glycine 0 N--CA 1.497 2.716 0 N-CA-C 110.693 -0.963 . . . . 0.0 110.693 -175.794 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 30.4 t -76.61 136.67 39.21 Favored 'General case' 0 N--CA 1.497 1.883 0 O-C-N 120.989 -1.301 . . . . 0.0 110.4 177.794 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 14.3 t-20 -83.36 120.09 25.44 Favored 'General case' 0 N--CA 1.497 1.896 0 O-C-N 121.608 -0.683 . . . . 0.0 109.669 174.722 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 11' ' ' VAL . . . . . 0.529 HG12 ' HA ' ' A' ' 57' ' ' ILE . 35.0 m -142.83 164.52 16.66 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.733 0 O-C-N 121.794 -0.567 . . . . 0.0 109.505 -178.824 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 12' ' ' GLU . . . . . 0.44 ' HB2' HD11 ' A' ' 58' ' ' LEU . 36.8 tt0 -109.36 128.85 55.43 Favored 'General case' 0 N--CA 1.493 1.697 0 C-N-CA 119.87 -0.732 . . . . 0.0 109.894 176.412 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 60.4 t -106.83 126.6 62.76 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.741 0 O-C-N 121.659 -0.65 . . . . 0.0 109.857 -179.285 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 14' ' ' LEU . . . . . 0.405 HD13 ' HG2' ' A' ' 20' ' ' LYS . 24.1 tp -95.84 127.92 42.29 Favored 'General case' 0 N--CA 1.494 1.74 0 N-CA-C 109.263 -0.643 . . . . 0.0 109.263 175.483 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 83.6 mt -96.1 161.87 13.78 Favored 'General case' 0 N--CA 1.496 1.864 0 O-C-N 121.609 -0.682 . . . . 0.0 110.923 -173.466 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 24.2 p30 -57.81 -21.76 43.79 Favored 'General case' 0 N--CA 1.506 2.327 0 O-C-N 121.855 -0.528 . . . . 0.0 111.418 179.886 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 24.8 p30 -90.91 22.49 3.61 Favored 'General case' 0 N--CA 1.5 2.073 0 O-C-N 121.618 -0.676 . . . . 0.0 111.067 -177.717 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 74.3 m-20 60.26 29.01 18.65 Favored 'General case' 0 N--CA 1.506 2.346 0 O-C-N 121.356 -0.84 . . . . 0.0 110.807 172.561 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 23.8 m -110.79 143.8 40.76 Favored 'General case' 0 N--CA 1.495 1.798 0 O-C-N 121.472 -0.767 . . . . 0.0 109.551 170.838 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 20' ' ' LYS . . . . . 0.405 ' HG2' HD13 ' A' ' 14' ' ' LEU . 34.2 mtpt -109.67 144.89 37.4 Favored 'General case' 0 N--CA 1.494 1.743 0 O-C-N 121.574 -0.704 . . . . 0.0 110.467 -176.69 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -153.09 157.93 41.14 Favored 'General case' 0 N--CA 1.497 1.905 0 O-C-N 121.8 -0.562 . . . . 0.0 110.145 177.081 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 30.7 ptt180 -143.97 152.61 41.28 Favored 'General case' 0 N--CA 1.496 1.846 0 O-C-N 121.578 -0.701 . . . . 0.0 110.441 178.081 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 23' ' ' GLY . . . . . 0.435 ' HA2' HD13 ' A' ' 39' ' ' LEU . . . -171.81 171.26 44.01 Favored Glycine 0 N--CA 1.494 2.503 0 N-CA-C 109.128 -1.589 . . . . 0.0 109.128 -179.075 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 24' ' ' VAL . . . . . 0.469 HG13 ' O ' ' A' ' 8' ' ' GLY . 43.9 t -94.64 126.06 47.14 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.918 0 O-C-N 121.59 -0.947 . . . . 0.0 109.288 176.619 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 25' ' ' ILE . . . . . 0.493 ' HA ' HD23 ' A' ' 37' ' ' LEU . 50.9 mt -61.66 137.99 22.91 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.253 0 O-C-N 121.64 -0.663 . . . . 0.0 110.896 -170.805 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 26' ' ' THR . . . . . 0.666 HG21 ' HB2' ' A' ' 38' ' ' ARG . 13.7 p -121.19 -19.06 7.23 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.922 -0.486 . . . . 0.0 111.465 -179.82 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 3.7 t-20 -166.15 158.8 14.65 Favored 'General case' 0 N--CA 1.503 2.222 0 O-C-N 120.917 -1.115 . . . . 0.0 111.751 176.046 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 65.0 t80 -150.32 124.96 9.69 Favored 'General case' 0 N--CA 1.495 1.818 0 N-CA-C 109.244 -0.651 . . . . 0.0 109.244 173.314 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 20.2 t70 -98.18 130.86 44.92 Favored 'General case' 0 N--CA 1.492 1.64 0 N-CA-C 109.004 -0.739 . . . . 0.0 109.004 -179.741 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 23.1 t -71.56 -53.76 12.71 Favored 'General case' 0 N--CA 1.498 1.956 0 C-N-CA 120.007 -0.677 . . . . 0.0 110.633 -175.845 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 22.9 m -61.93 -37.9 86.41 Favored 'General case' 0 N--CA 1.5 2.061 0 O-C-N 121.591 -0.693 . . . . 0.0 110.699 -175.819 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 91.5 m-20 -103.77 -9.85 18.74 Favored 'General case' 0 N--CA 1.498 1.942 0 O-C-N 121.746 -0.596 . . . . 0.0 111.66 -176.909 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 27.8 p 47.11 67.05 0.86 Allowed 'General case' 0 N--CA 1.508 2.434 0 O-C-N 121.408 -0.807 . . . . 0.0 111.202 -175.13 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 34' ' ' ILE . . . . . 1.055 HD12 HG22 ' A' ' 48' ' ' VAL . 46.8 mm -121.36 125.8 74.15 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.964 0 O-C-N 121.642 -0.661 . . . . 0.0 109.236 -176.433 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 11.0 tp -116.57 120.47 38.81 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.746 -0.596 . . . . 0.0 110.468 -170.3 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 57.6 mt-30 -91.02 131.94 36.31 Favored 'General case' 0 N--CA 1.49 1.551 0 N-CA-C 109.061 -0.718 . . . . 0.0 109.061 170.659 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 37' ' ' LEU . . . . . 0.493 HD23 ' HA ' ' A' ' 25' ' ' ILE . 50.6 mt -117.82 123.56 46.23 Favored 'General case' 0 N--CA 1.494 1.761 0 C-N-CA 120.121 -0.632 . . . . 0.0 110.007 175.723 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 38' ' ' ARG . . . . . 0.666 ' HB2' HG21 ' A' ' 26' ' ' THR . 70.3 ttt180 -105.63 105.08 14.95 Favored 'General case' 0 N--CA 1.495 1.788 0 O-C-N 121.821 -0.549 . . . . 0.0 110.144 173.928 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 39' ' ' LEU . . . . . 0.435 HD13 ' HA2' ' A' ' 23' ' ' GLY . 65.2 tp -83.19 157.36 22.76 Favored 'General case' 0 N--CA 1.499 1.979 0 O-C-N 121.623 -0.673 . . . . 0.0 110.518 -176.657 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -67.57 -2.97 7.5 Favored 'General case' 0 N--CA 1.503 2.179 0 O-C-N 121.857 -0.527 . . . . 0.0 112.156 -170.822 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 30.1 m120 -86.25 29.06 0.78 Allowed 'General case' 0 N--CA 1.499 1.983 0 O-C-N 120.987 -1.07 . . . . 0.0 110.822 173.503 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 73.9 m-20 60.39 31.47 20.37 Favored 'General case' 0 N--CA 1.505 2.277 0 O-C-N 121.225 -0.922 . . . . 0.0 110.326 175.468 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 69.9 m -125.91 140.77 52.36 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.483 -0.761 . . . . 0.0 110.05 177.736 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 9.8 t -128.27 147.79 50.61 Favored 'General case' 0 N--CA 1.495 1.809 0 O-C-N 121.681 -0.637 . . . . 0.0 110.018 179.785 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 81.3 tttt -150.19 135.18 17.77 Favored 'General case' 0 N--CA 1.495 1.797 0 O-C-N 121.709 -0.619 . . . . 0.0 110.545 -178.106 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 89.5 p -94.78 121.03 35.95 Favored 'General case' 0 N--CA 1.495 1.806 0 O-C-N 121.798 -0.563 . . . . 0.0 110.142 177.85 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 81.3 mt -129.25 137.29 57.4 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.868 0 O-C-N 121.671 -0.643 . . . . 0.0 109.325 -179.956 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 48' ' ' VAL . . . . . 1.055 HG22 HD12 ' A' ' 34' ' ' ILE . 60.5 t -81.53 127.78 39.28 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.846 0 O-C-N 121.566 -0.709 . . . . 0.0 109.219 179.117 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 49' ' ' THR . . . . . 0.405 ' HA ' ' CD1' ' A' ' 52' ' ' ILE . 44.3 p -58.33 -29.7 66.14 Favored 'General case' 0 N--CA 1.503 2.2 0 O-C-N 121.459 -0.776 . . . . 0.0 111.672 -170.504 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -58.56 -27.23 64.37 Favored 'General case' 0 N--CA 1.5 2.045 0 O-C-N 121.562 -0.711 . . . . 0.0 111.315 -173.261 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 4.6 p30 -82.41 0.86 40.1 Favored 'General case' 0 N--CA 1.497 1.884 0 C-N-CA 119.502 -0.879 . . . . 0.0 111.113 176.932 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 52' ' ' ILE . . . . . 0.564 HG21 HD11 ' A' ' 55' ' ' LEU . 76.1 mt -79.45 132.18 32.6 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.096 0 O-C-N 121.167 -0.958 . . . . 0.0 109.923 175.649 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 23.5 ttmt -92.42 -24.32 18.89 Favored 'General case' 0 N--CA 1.494 1.746 0 C-N-CA 120.427 -0.509 . . . . 0.0 110.22 173.278 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 54' ' ' ASP . . . . . 0.503 ' HA ' HD13 ' B' ' 261' ' ' LEU . 1.6 m-20 -164.08 152.43 13.06 Favored 'General case' 0 N--CA 1.501 2.125 0 O-C-N 121.502 -0.749 . . . . 0.0 110.489 -175.949 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 55' ' ' LEU . . . . . 0.564 HD11 HG21 ' A' ' 52' ' ' ILE . 4.7 mp -132.92 152.35 51.91 Favored 'General case' 0 N--CA 1.495 1.818 0 O-C-N 121.725 -0.609 . . . . 0.0 110.364 178.494 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 19.8 ptp180 -151.84 146.15 25.47 Favored 'General case' 0 N--CA 1.496 1.842 0 O-C-N 121.636 -0.665 . . . . 0.0 109.926 175.081 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 57' ' ' ILE . . . . . 0.529 ' HA ' HG12 ' A' ' 11' ' ' VAL . 57.5 mt -87.09 133.23 30.54 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.871 0 O-C-N 121.483 -0.761 . . . . 0.0 110.0 174.092 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 58' ' ' LEU . . . . . 0.44 HD11 ' HB2' ' A' ' 12' ' ' GLU . 78.1 mt . . . . . 0 N--CA 1.497 1.886 0 O-C-N 121.537 -0.727 . . . . 0.0 110.018 -179.785 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 257' ' ' SER . . . . . . . . . . . . . 33.7 m . . . . . 0 N--CA 1.502 2.17 0 CA-C-O 121.257 0.551 . . . . 0.0 110.487 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' B' B ' 258' ' ' SER . . . . . . . . . . . . . 22.6 t -69.67 -32.82 71.69 Favored 'General case' 0 N--CA 1.498 1.932 0 O-C-N 121.862 -0.524 . . . . 0.0 110.419 -179.401 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 259' ' ' GLN . . . . . . . . . . . . . 99.5 mt-30 -63.22 -37.96 89.29 Favored 'General case' 0 N--CA 1.501 2.082 0 O-C-N 121.57 -0.706 . . . . 0.0 110.634 -178.442 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 260' ' ' LEU . . . . . . . . . . . . . 84.1 mt -69.43 -41.72 75.94 Favored 'General case' 0 N--CA 1.499 1.981 0 O-C-N 121.535 -0.728 . . . . 0.0 110.296 179.915 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 261' ' ' LEU . . . . . 0.503 HD13 ' HA ' ' A' ' 54' ' ' ASP . 32.8 tp -70.26 -40.21 74.53 Favored 'General case' 0 N--CA 1.496 1.872 0 O-C-N 121.572 -0.705 . . . . 0.0 109.915 177.83 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 262' ' ' SER . . . . . . . . . . . . . 86.8 p -63.18 -35.9 81.85 Favored 'General case' 0 N--CA 1.5 2.06 0 O-C-N 121.675 -0.64 . . . . 0.0 110.484 177.374 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 263' ' ' LEU . . . . . . . . . . . . . 25.2 mt . . . . . 0 N--CA 1.499 2.005 0 O-C-N 121.631 -0.668 . . . . 0.0 110.456 179.214 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 74.3 m . . . . . 0 N--CA 1.494 1.768 0 CA-C-O 121.116 0.484 . . . . 0.0 110.533 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 56.7 t -64.67 -27.97 43.76 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.24 0 O-C-N 121.699 -0.626 . . . . 0.0 110.279 179.716 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -55.06 -30.96 60.72 Favored 'General case' 0 N--CA 1.504 2.235 0 O-C-N 121.452 -0.78 . . . . 0.0 110.393 -179.669 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 74.5 m-20 -68.73 -35.26 76.89 Favored 'General case' 0 N--CA 1.498 1.95 0 C-N-CA 120.413 -0.515 . . . . 0.0 109.968 174.658 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 6' ' ' PHE . . . . . 0.509 ' CE1' HD21 ' B' ' 260' ' ' LEU . 95.0 m-85 -98.05 9.86 41.81 Favored 'General case' 0 N--CA 1.498 1.931 0 O-C-N 121.782 -0.574 . . . . 0.0 111.263 179.072 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -67.48 128.48 36.6 Favored 'General case' 0 N--CA 1.5 2.071 0 O-C-N 121.198 -0.939 . . . . 0.0 110.046 179.533 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 8' ' ' GLY . . . . . 0.471 ' O ' HG13 ' A' ' 24' ' ' VAL . . . 81.98 -0.59 88.35 Favored Glycine 0 N--CA 1.495 2.623 0 N-CA-C 110.757 -0.937 . . . . 0.0 110.757 -175.594 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 49.1 m -76.3 137.34 39.82 Favored 'General case' 0 N--CA 1.497 1.904 0 O-C-N 120.958 -1.319 . . . . 0.0 110.469 178.042 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 14.0 t-20 -84.51 119.12 24.8 Favored 'General case' 0 N--CA 1.497 1.886 0 O-C-N 121.683 -0.636 . . . . 0.0 109.774 174.567 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 11' ' ' VAL . . . . . 0.503 HG12 ' HA ' ' A' ' 57' ' ' ILE . 35.8 m -142.12 162.46 19.53 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.808 0 O-C-N 121.847 -0.533 . . . . 0.0 109.636 -179.872 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 12' ' ' GLU . . . . . 0.454 ' HB2' HD11 ' A' ' 58' ' ' LEU . 48.4 tt0 -109.42 128.45 55.14 Favored 'General case' 0 N--CA 1.494 1.765 0 C-N-CA 119.914 -0.714 . . . . 0.0 110.01 178.05 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 13' ' ' VAL . . . . . 0.582 HG22 ' CD2' ' A' ' 55' ' ' LEU . 60.8 t -106.74 127.71 62.04 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.765 0 O-C-N 121.642 -0.661 . . . . 0.0 109.893 -178.882 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 14' ' ' LEU . . . . . 0.422 HD13 ' HG2' ' A' ' 20' ' ' LYS . 27.0 tp -95.83 125.87 40.7 Favored 'General case' 0 N--CA 1.493 1.7 0 N-CA-C 109.14 -0.689 . . . . 0.0 109.14 174.327 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 86.6 mt -95.08 167.33 11.45 Favored 'General case' 0 N--CA 1.496 1.828 0 O-C-N 121.6 -0.687 . . . . 0.0 111.102 -172.561 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 24.2 p30 -58.54 -21.9 53.91 Favored 'General case' 0 N--CA 1.507 2.4 0 O-C-N 121.933 -0.479 . . . . 0.0 111.575 -176.786 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 39.2 p-10 -93.06 23.76 4.12 Favored 'General case' 0 N--CA 1.498 1.936 0 O-C-N 121.6 -0.688 . . . . 0.0 110.878 -176.354 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 10.4 m-20 59.09 27.66 16.7 Favored 'General case' 0 N--CA 1.506 2.367 0 O-C-N 121.483 -0.76 . . . . 0.0 110.611 175.579 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 50.9 m -106.52 142.57 35.96 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.492 -0.755 . . . . 0.0 109.61 172.975 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 20' ' ' LYS . . . . . 0.422 ' HG2' HD13 ' A' ' 14' ' ' LEU . 95.0 mttt -109.66 143.68 39.07 Favored 'General case' 0 N--CA 1.494 1.748 0 O-C-N 121.594 -0.691 . . . . 0.0 110.731 -176.668 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -153.1 156.06 37.96 Favored 'General case' 0 N--CA 1.497 1.907 0 O-C-N 121.752 -0.593 . . . . 0.0 110.018 175.96 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 22' ' ' ARG . . . . . 0.436 ' NH1' HD11 ' A' ' 39' ' ' LEU . 40.5 ptt85 -142.64 153.51 43.51 Favored 'General case' 0 N--CA 1.496 1.862 0 O-C-N 121.515 -0.74 . . . . 0.0 110.482 178.545 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 23' ' ' GLY . . . . . 0.438 ' HA2' HD13 ' A' ' 39' ' ' LEU . . . -171.81 171.17 43.96 Favored Glycine 0 N--CA 1.494 2.517 0 N-CA-C 109.051 -1.62 . . . . 0.0 109.051 -178.965 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 24' ' ' VAL . . . . . 0.471 HG13 ' O ' ' A' ' 8' ' ' GLY . 44.6 t -94.65 127.12 46.88 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.898 0 O-C-N 121.604 -0.939 . . . . 0.0 109.305 176.943 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 25' ' ' ILE . . . . . 0.485 ' HA ' HD23 ' A' ' 37' ' ' LEU . 49.2 mt -61.5 138.31 22.32 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.227 0 O-C-N 121.632 -0.668 . . . . 0.0 110.864 -171.01 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 26' ' ' THR . . . . . 0.673 HG21 ' HB2' ' A' ' 38' ' ' ARG . 12.5 p -121.16 -20.53 6.73 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.875 -0.515 . . . . 0.0 111.485 -179.699 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 1.6 t-20 -165.77 158.58 15.32 Favored 'General case' 0 N--CA 1.504 2.262 0 O-C-N 120.902 -1.124 . . . . 0.0 111.798 176.764 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 66.8 t80 -150.27 123.08 8.68 Favored 'General case' 0 N--CA 1.494 1.761 0 N-CA-C 109.177 -0.675 . . . . 0.0 109.177 173.217 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 17.9 t70 -98.05 130.16 44.87 Favored 'General case' 0 N--CA 1.493 1.689 0 N-CA-C 109.106 -0.702 . . . . 0.0 109.106 -177.849 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 23.2 t -69.63 -51.82 31.5 Favored 'General case' 0 N--CA 1.498 1.963 0 C-N-CA 119.981 -0.688 . . . . 0.0 110.648 -175.985 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 22.1 t -59.94 -41.58 92.13 Favored 'General case' 0 N--CA 1.501 2.099 0 O-C-N 121.624 -0.672 . . . . 0.0 110.938 -174.652 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 91.6 m-20 -104.17 -9.88 18.35 Favored 'General case' 0 N--CA 1.497 1.894 0 O-C-N 121.668 -0.645 . . . . 0.0 111.663 -177.453 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 3.7 m 50.13 67.35 0.93 Allowed 'General case' 0 N--CA 1.508 2.431 0 O-C-N 120.971 -1.08 . . . . 0.0 110.85 -174.43 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 34' ' ' ILE . . . . . 1.103 HD12 HG22 ' A' ' 48' ' ' VAL . 44.6 mm -120.67 125.8 74.5 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.024 0 O-C-N 121.598 -0.688 . . . . 0.0 109.332 -175.827 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 10.8 tp -115.9 119.47 36.05 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.691 -0.631 . . . . 0.0 110.548 -169.699 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 44.5 mt-30 -91.0 132.51 35.94 Favored 'General case' 0 N--CA 1.489 1.504 0 N-CA-C 109.304 -0.628 . . . . 0.0 109.304 171.441 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 37' ' ' LEU . . . . . 0.485 HD23 ' HA ' ' A' ' 25' ' ' ILE . 51.4 mt -117.79 123.54 46.21 Favored 'General case' 0 N--CA 1.495 1.789 0 C-N-CA 120.129 -0.628 . . . . 0.0 110.001 175.81 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 38' ' ' ARG . . . . . 0.673 ' HB2' HG21 ' A' ' 26' ' ' THR . 57.1 ttt85 -105.86 106.18 16.57 Favored 'General case' 0 N--CA 1.496 1.85 0 O-C-N 121.753 -0.592 . . . . 0.0 110.191 173.885 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 39' ' ' LEU . . . . . 0.438 HD13 ' HA2' ' A' ' 23' ' ' GLY . 65.4 tp -83.78 156.76 22.36 Favored 'General case' 0 N--CA 1.499 1.978 0 O-C-N 121.678 -0.639 . . . . 0.0 110.587 -177.138 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -68.19 -3.02 9.23 Favored 'General case' 0 N--CA 1.504 2.226 0 O-C-N 121.903 -0.498 . . . . 0.0 112.178 -170.804 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 91.7 m-20 -86.96 29.1 0.84 Allowed 'General case' 0 N--CA 1.498 1.963 0 O-C-N 121.04 -1.038 . . . . 0.0 110.682 173.84 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 73.1 m-20 60.74 31.67 20.14 Favored 'General case' 0 N--CA 1.505 2.316 0 O-C-N 121.242 -0.911 . . . . 0.0 110.271 175.82 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 73.5 m -125.78 138.33 53.84 Favored 'General case' 0 N--CA 1.494 1.739 0 O-C-N 121.457 -0.777 . . . . 0.0 110.006 177.212 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 9.3 t -128.18 148.88 50.63 Favored 'General case' 0 N--CA 1.497 1.881 0 O-C-N 121.659 -0.651 . . . . 0.0 110.042 179.955 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 45' ' ' LYS . . . . . 0.445 ' HD3' HD11 ' A' ' 47' ' ' ILE . 79.2 tttt -150.37 136.09 18.28 Favored 'General case' 0 N--CA 1.495 1.822 0 O-C-N 121.718 -0.614 . . . . 0.0 110.584 -178.32 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 89.8 p -94.39 121.49 35.98 Favored 'General case' 0 N--CA 1.494 1.769 0 O-C-N 121.718 -0.614 . . . . 0.0 110.073 176.935 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 47' ' ' ILE . . . . . 0.445 HD11 ' HD3' ' A' ' 45' ' ' LYS . 79.7 mt -129.2 135.09 62.71 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.837 0 O-C-N 121.602 -0.686 . . . . 0.0 109.44 -179.424 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 48' ' ' VAL . . . . . 1.103 HG22 HD12 ' A' ' 34' ' ' ILE . 62.1 t -82.31 127.63 39.46 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.929 0 N-CA-C 109.265 -0.643 . . . . 0.0 109.265 179.032 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 57.7 p -58.36 -25.0 61.51 Favored 'General case' 0 N--CA 1.507 2.382 0 O-C-N 121.533 -0.729 . . . . 0.0 111.814 -169.148 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 49.0 tptt -56.87 -26.1 57.98 Favored 'General case' 0 N--CA 1.5 2.061 0 O-C-N 121.414 -0.804 . . . . 0.0 111.069 -177.049 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 5.3 p30 -84.64 5.88 26.27 Favored 'General case' 0 N--CA 1.499 2.009 0 C-N-CA 119.676 -0.809 . . . . 0.0 111.33 176.501 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 98.7 mt -75.32 126.46 36.11 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.107 0 O-C-N 121.184 -0.948 . . . . 0.0 109.988 175.726 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 77.0 tttt -92.91 -29.35 15.96 Favored 'General case' 0 N--CA 1.494 1.768 0 O-C-N 121.803 -0.561 . . . . 0.0 109.887 170.708 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 54' ' ' ASP . . . . . 0.408 ' HA ' HD22 ' B' ' 261' ' ' LEU . 5.4 m-20 -163.63 154.6 16.24 Favored 'General case' 0 N--CA 1.5 2.075 0 O-C-N 121.76 -0.587 . . . . 0.0 110.168 -177.926 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 55' ' ' LEU . . . . . 0.582 ' CD2' HG22 ' A' ' 13' ' ' VAL . 83.9 mt -132.98 150.5 52.16 Favored 'General case' 0 N--CA 1.497 1.899 0 O-C-N 121.71 -0.619 . . . . 0.0 110.424 -179.163 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 4.5 ptm180 -152.66 141.91 21.48 Favored 'General case' 0 N--CA 1.495 1.791 0 O-C-N 121.757 -0.589 . . . . 0.0 109.869 174.83 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 57' ' ' ILE . . . . . 0.503 ' HA ' HG12 ' A' ' 11' ' ' VAL . 69.4 mt -85.19 133.34 29.61 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.883 0 O-C-N 121.453 -0.779 . . . . 0.0 109.864 174.472 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 58' ' ' LEU . . . . . 0.454 HD11 ' HB2' ' A' ' 12' ' ' GLU . 63.9 mt . . . . . 0 N--CA 1.497 1.923 0 O-C-N 121.591 -0.693 . . . . 0.0 110.113 -179.031 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 257' ' ' SER . . . . . . . . . . . . . 69.2 m . . . . . 0 N--CA 1.503 2.186 0 CA-C-O 121.321 0.581 . . . . 0.0 110.48 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' B' B ' 258' ' ' SER . . . . . . . . . . . . . 27.6 m -68.27 -31.43 70.88 Favored 'General case' 0 N--CA 1.499 2.009 0 C-N-CA 120.438 -0.505 . . . . 0.0 110.296 179.186 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 259' ' ' GLN . . . . . . . . . . . . . 58.4 tp60 -63.59 -37.31 86.85 Favored 'General case' 0 N--CA 1.501 2.075 0 O-C-N 121.638 -0.664 . . . . 0.0 110.64 -179.472 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 260' ' ' LEU . . . . . 0.509 HD21 ' CE1' ' A' ' 6' ' ' PHE . 83.2 mt -70.89 -43.86 67.48 Favored 'General case' 0 N--CA 1.499 1.983 0 O-C-N 121.524 -0.735 . . . . 0.0 110.214 179.946 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 261' ' ' LEU . . . . . 0.408 HD22 ' HA ' ' A' ' 54' ' ' ASP . 24.2 tp -69.1 -39.04 79.24 Favored 'General case' 0 N--CA 1.498 1.963 0 O-C-N 121.737 -0.602 . . . . 0.0 109.844 178.023 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 262' ' ' SER . . . . . . . . . . . . . 84.9 p -62.99 -34.78 78.28 Favored 'General case' 0 N--CA 1.499 2.019 0 O-C-N 121.687 -0.633 . . . . 0.0 110.611 177.539 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 263' ' ' LEU . . . . . . . . . . . . . 23.5 mt . . . . . 0 N--CA 1.501 2.105 0 O-C-N 121.58 -0.7 . . . . 0.0 110.357 179.409 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 69.8 m . . . . . 0 N--CA 1.493 1.705 0 CA-C-O 120.978 0.418 . . . . 0.0 110.021 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 3' ' ' VAL . . . . . 0.43 HG12 ' CE1' ' A' ' 7' ' ' TYR . 79.8 t -66.67 -27.81 41.23 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.036 0 O-C-N 121.58 -0.7 . . . . 0.0 110.263 -179.684 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -55.15 -30.83 60.61 Favored 'General case' 0 N--CA 1.505 2.315 0 O-C-N 121.461 -0.774 . . . . 0.0 110.389 -178.925 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 74.6 m-20 -68.76 -30.52 69.14 Favored 'General case' 0 N--CA 1.499 2.025 0 O-C-N 121.813 -0.555 . . . . 0.0 110.223 174.821 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 96.2 m-85 -95.4 10.07 37.69 Favored 'General case' 0 N--CA 1.498 1.953 0 O-C-N 121.645 -0.659 . . . . 0.0 111.512 -178.367 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 7' ' ' TYR . . . . . 0.43 ' CE1' HG12 ' A' ' 3' ' ' VAL . 3.7 m-30 -67.18 137.82 56.53 Favored 'General case' 0 N--CA 1.502 2.16 0 O-C-N 121.131 -0.98 . . . . 0.0 110.106 173.979 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 8' ' ' GLY . . . . . 0.433 ' O ' HG13 ' A' ' 24' ' ' VAL . . . 83.07 -1.08 89.3 Favored Glycine 0 N--CA 1.496 2.694 0 N-CA-C 110.718 -0.953 . . . . 0.0 110.718 -177.352 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 68.9 m -77.2 136.82 38.58 Favored 'General case' 0 N--CA 1.499 1.979 0 O-C-N 121.031 -1.276 . . . . 0.0 110.417 177.747 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 16.1 t-20 -84.16 117.11 23.27 Favored 'General case' 0 N--CA 1.498 1.944 0 O-C-N 121.633 -0.667 . . . . 0.0 109.628 173.4 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 11' ' ' VAL . . . . . 0.522 HG12 ' HA ' ' A' ' 57' ' ' ILE . 35.7 m -142.71 162.7 17.99 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.705 0 N-CA-C 109.387 -0.597 . . . . 0.0 109.387 -178.206 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 12' ' ' GLU . . . . . 0.464 ' HB2' HD11 ' A' ' 58' ' ' LEU . 45.3 tt0 -109.34 130.3 55.5 Favored 'General case' 0 N--CA 1.492 1.661 0 C-N-CA 119.838 -0.745 . . . . 0.0 109.863 176.918 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 60.0 t -106.69 126.67 62.54 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.679 0 O-C-N 121.623 -0.673 . . . . 0.0 109.841 -179.597 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 27.1 tp -95.93 130.22 42.96 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.697 -0.627 . . . . 0.0 109.358 176.512 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 86.3 mt -97.38 160.12 14.51 Favored 'General case' 0 N--CA 1.496 1.875 0 O-C-N 121.59 -0.694 . . . . 0.0 111.067 -174.25 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 24.4 p30 -58.24 -21.87 49.95 Favored 'General case' 0 N--CA 1.506 2.345 0 O-C-N 121.756 -0.59 . . . . 0.0 111.503 -178.477 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 38.3 p-10 -93.14 23.93 4.07 Favored 'General case' 0 N--CA 1.498 1.927 0 O-C-N 121.5 -0.75 . . . . 0.0 110.778 -177.154 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 74.3 m-20 59.42 28.08 17.35 Favored 'General case' 0 N--CA 1.505 2.322 0 O-C-N 121.493 -0.754 . . . . 0.0 110.644 175.8 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 51.0 m -104.04 141.43 36.22 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.57 -0.706 . . . . 0.0 109.516 171.964 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 52.8 mttp -109.69 143.43 39.47 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.593 -0.692 . . . . 0.0 110.553 -176.013 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -153.1 154.6 35.16 Favored 'General case' 0 N--CA 1.497 1.889 0 O-C-N 121.722 -0.612 . . . . 0.0 110.3 176.477 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 31.0 ptt180 -144.07 154.98 43.78 Favored 'General case' 0 N--CA 1.498 1.947 0 O-C-N 121.705 -0.622 . . . . 0.0 110.463 177.573 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 23' ' ' GLY . . . . . 0.469 ' HA2' HD13 ' A' ' 39' ' ' LEU . . . -171.93 171.18 44.0 Favored Glycine 0 N--CA 1.494 2.522 0 N-CA-C 109.237 -1.545 . . . . 0.0 109.237 -178.967 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 24' ' ' VAL . . . . . 0.433 HG13 ' O ' ' A' ' 8' ' ' GLY . 41.0 t -94.5 119.51 42.58 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.926 0 O-C-N 121.596 -0.944 . . . . 0.0 109.02 174.252 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 25' ' ' ILE . . . . . 0.409 HD11 HG21 ' A' ' 11' ' ' VAL . 76.0 mt -63.52 143.75 15.31 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.23 0 CA-C-O 121.304 0.573 . . . . 0.0 110.66 -167.749 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 26' ' ' THR . . . . . 0.711 HG21 ' HG3' ' A' ' 38' ' ' ARG . 2.3 p -121.15 -25.87 5.21 Favored 'General case' 0 N--CA 1.494 1.768 0 O-C-N 121.831 -0.543 . . . . 0.0 111.379 179.934 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 27' ' ' ASN . . . . . 0.555 ' O ' HD12 ' A' ' 35' ' ' LEU . 7.3 t30 -163.94 160.0 21.5 Favored 'General case' 0 N--CA 1.501 2.091 0 O-C-N 120.952 -1.092 . . . . 0.0 111.774 -179.844 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 28' ' ' PHE . . . . . 0.569 ' HE1' HG21 ' A' ' 49' ' ' THR . 91.5 t80 -150.1 128.78 12.37 Favored 'General case' 0 N--CA 1.5 2.028 0 N-CA-C 109.223 -0.658 . . . . 0.0 109.223 170.279 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 20.2 t0 -98.86 130.84 45.29 Favored 'General case' 0 N--CA 1.49 1.559 0 N-CA-C 108.941 -0.763 . . . . 0.0 108.941 179.994 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 88.6 p -70.84 -51.48 26.31 Favored 'General case' 0 N--CA 1.497 1.922 0 C-N-CA 119.98 -0.688 . . . . 0.0 110.686 -175.175 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 6.3 t -61.25 -40.47 94.18 Favored 'General case' 0 N--CA 1.501 2.124 0 O-C-N 121.517 -0.74 . . . . 0.0 110.718 -175.737 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 28.8 m120 -103.27 -9.07 19.83 Favored 'General case' 0 N--CA 1.498 1.941 0 O-C-N 121.738 -0.601 . . . . 0.0 111.615 -176.877 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 28.6 p 46.79 67.13 0.83 Allowed 'General case' 0 N--CA 1.509 2.477 0 O-C-N 121.385 -0.822 . . . . 0.0 111.266 -175.009 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 34' ' ' ILE . . . . . 1.07 HD12 HG22 ' A' ' 48' ' ' VAL . 46.0 mm -122.53 125.83 73.2 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.059 0 N-CA-C 109.138 -0.69 . . . . 0.0 109.138 -176.881 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.555 HD12 ' O ' ' A' ' 27' ' ' ASN . 12.5 tp -115.98 122.25 44.69 Favored 'General case' 0 N--CA 1.495 1.776 0 O-C-N 121.677 -0.639 . . . . 0.0 110.7 -169.888 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 77.9 mt-30 -90.93 142.1 28.13 Favored 'General case' 0 N--CA 1.489 1.524 0 N-CA-C 109.358 -0.608 . . . . 0.0 109.358 171.097 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 6.4 mt -133.53 123.57 25.41 Favored 'General case' 0 N--CA 1.495 1.803 0 O-C-N 121.76 -0.588 . . . . 0.0 109.783 178.846 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 38' ' ' ARG . . . . . 0.711 ' HG3' HG21 ' A' ' 26' ' ' THR . 23.2 mtm180 -102.25 104.83 15.41 Favored 'General case' 0 N--CA 1.496 1.863 0 O-C-N 121.738 -0.601 . . . . 0.0 110.38 173.392 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 39' ' ' LEU . . . . . 0.469 HD13 ' HA2' ' A' ' 23' ' ' GLY . 62.8 tp -84.19 157.33 21.68 Favored 'General case' 0 N--CA 1.497 1.901 0 O-C-N 121.509 -0.744 . . . . 0.0 110.49 -177.946 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -66.43 -2.91 5.09 Favored 'General case' 0 N--CA 1.504 2.227 0 O-C-N 121.911 -0.493 . . . . 0.0 112.126 -171.154 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 91.4 m-20 -84.87 28.98 0.65 Allowed 'General case' 0 N--CA 1.499 1.993 0 O-C-N 121.112 -0.993 . . . . 0.0 110.856 172.267 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 74.4 m-20 59.43 31.17 20.87 Favored 'General case' 0 N--CA 1.504 2.272 0 O-C-N 121.108 -0.995 . . . . 0.0 110.433 174.148 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 50.8 m -126.26 137.76 53.55 Favored 'General case' 0 N--CA 1.496 1.847 0 O-C-N 121.498 -0.751 . . . . 0.0 110.517 178.99 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 10.0 t -102.36 151.11 22.65 Favored 'General case' 0 N--CA 1.497 1.882 0 O-C-N 121.864 -0.523 . . . . 0.0 110.105 174.629 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 69.5 mttt -149.04 123.79 9.87 Favored 'General case' 0 N--CA 1.496 1.87 0 O-C-N 121.574 -0.704 . . . . 0.0 110.741 178.939 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 92.6 p -97.45 118.52 34.11 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.792 -0.568 . . . . 0.0 110.122 177.551 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 82.6 mt -129.34 140.1 50.03 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.842 0 O-C-N 121.675 -0.641 . . . . 0.0 109.369 179.665 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 48' ' ' VAL . . . . . 1.07 HG22 HD12 ' A' ' 34' ' ' ILE . 58.1 t -81.85 127.65 39.42 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.863 0 C-N-CA 119.981 -0.688 . . . . 0.0 109.164 178.694 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 49' ' ' THR . . . . . 0.569 HG21 ' HE1' ' A' ' 28' ' ' PHE . 38.7 p -60.42 -27.18 67.27 Favored 'General case' 0 N--CA 1.502 2.128 0 O-C-N 121.62 -0.675 . . . . 0.0 111.926 -171.005 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 50.3 mmtt -58.58 -25.03 62.13 Favored 'General case' 0 N--CA 1.501 2.122 0 O-C-N 121.531 -0.731 . . . . 0.0 111.363 -173.776 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 6.4 p30 -82.44 -1.16 49.3 Favored 'General case' 0 N--CA 1.498 1.967 0 C-N-CA 119.635 -0.826 . . . . 0.0 111.084 176.41 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 52' ' ' ILE . . . . . 0.624 HG21 HD11 ' A' ' 55' ' ' LEU . 75.3 mt -79.66 133.92 28.74 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.102 0 O-C-N 121.185 -0.947 . . . . 0.0 110.131 177.317 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 47.2 tptt -92.38 -27.51 17.48 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.854 -0.529 . . . . 0.0 109.928 171.412 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 54' ' ' ASP . . . . . 0.489 ' HA ' HD13 ' B' ' 261' ' ' LEU . 1.5 m-20 -164.34 155.5 15.53 Favored 'General case' 0 N--CA 1.502 2.17 0 O-C-N 121.684 -0.635 . . . . 0.0 110.47 -176.211 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 55' ' ' LEU . . . . . 0.624 HD11 HG21 ' A' ' 52' ' ' ILE . 4.7 mp -132.91 155.36 49.2 Favored 'General case' 0 N--CA 1.497 1.88 0 O-C-N 121.877 -0.514 . . . . 0.0 110.175 178.191 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 19.6 ptp180 -151.6 148.93 28.57 Favored 'General case' 0 N--CA 1.497 1.891 0 O-C-N 121.693 -0.629 . . . . 0.0 109.976 175.801 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 57' ' ' ILE . . . . . 0.522 ' HA ' HG12 ' A' ' 11' ' ' VAL . 67.5 mt -86.01 133.33 29.91 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.871 0 C-N-CA 119.944 -0.702 . . . . 0.0 109.868 172.808 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 58' ' ' LEU . . . . . 0.464 HD11 ' HB2' ' A' ' 12' ' ' GLU . 72.7 mt . . . . . 0 N--CA 1.498 1.928 0 O-C-N 121.613 -0.68 . . . . 0.0 110.045 -178.299 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 257' ' ' SER . . . . . . . . . . . . . 22.0 m . . . . . 0 N--CA 1.503 2.185 0 CA-C-O 121.207 0.527 . . . . 0.0 110.361 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' B' B ' 258' ' ' SER . . . . . . . . . . . . . 23.8 m -69.33 -34.28 74.41 Favored 'General case' 0 N--CA 1.498 1.95 0 C-N-CA 120.402 -0.519 . . . . 0.0 110.176 179.303 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 259' ' ' GLN . . . . . . . . . . . . . 78.2 mt-30 -64.66 -34.47 78.36 Favored 'General case' 0 N--CA 1.5 2.058 0 O-C-N 121.606 -0.684 . . . . 0.0 110.407 -179.931 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 260' ' ' LEU . . . . . 0.492 ' HA ' HD12 ' B' ' 263' ' ' LEU . 77.9 mt -66.57 -41.57 88.39 Favored 'General case' 0 N--CA 1.5 2.028 0 O-C-N 121.716 -0.615 . . . . 0.0 110.223 179.371 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 261' ' ' LEU . . . . . 0.571 HD13 HD12 ' A' ' 55' ' ' LEU . 33.5 tp -70.03 -35.67 74.49 Favored 'General case' 0 N--CA 1.498 1.973 0 C-N-CA 120.132 -0.627 . . . . 0.0 109.798 176.997 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 262' ' ' SER . . . . . . . . . . . . . 23.2 m -62.47 -37.68 86.89 Favored 'General case' 0 N--CA 1.5 2.067 0 O-C-N 121.683 -0.636 . . . . 0.0 110.468 177.241 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 263' ' ' LEU . . . . . 0.492 HD12 ' HA ' ' B' ' 260' ' ' LEU . 21.6 mt . . . . . 0 N--CA 1.5 2.067 0 O-C-N 121.718 -0.613 . . . . 0.0 110.292 179.195 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 63.5 m . . . . . 0 N--CA 1.495 1.79 0 CA-C-O 121.02 0.438 . . . . 0.0 110.076 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 3' ' ' VAL . . . . . 0.429 HG12 ' CE1' ' A' ' 7' ' ' TYR . 74.6 t -66.77 -27.71 40.79 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.014 0 O-C-N 121.65 -0.656 . . . . 0.0 110.099 179.798 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -55.12 -30.94 60.79 Favored 'General case' 0 N--CA 1.504 2.228 0 O-C-N 121.434 -0.791 . . . . 0.0 110.369 -179.854 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -68.76 -30.88 69.57 Favored 'General case' 0 N--CA 1.499 1.991 0 O-C-N 121.783 -0.573 . . . . 0.0 110.24 174.676 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 91.1 m-85 -95.81 10.11 38.21 Favored 'General case' 0 N--CA 1.497 1.895 0 O-C-N 121.584 -0.697 . . . . 0.0 111.637 -178.0 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 7' ' ' TYR . . . . . 0.429 ' CE1' HG12 ' A' ' 3' ' ' VAL . 3.1 m-30 -67.35 133.36 49.48 Favored 'General case' 0 N--CA 1.502 2.174 0 O-C-N 121.088 -1.007 . . . . 0.0 110.043 173.801 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 82.38 1.88 90.51 Favored Glycine 0 N--CA 1.496 2.644 0 N-CA-C 110.625 -0.99 . . . . 0.0 110.625 -176.854 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 52.8 m -77.42 137.13 38.52 Favored 'General case' 0 N--CA 1.498 1.955 0 O-C-N 121.111 -1.229 . . . . 0.0 110.476 176.365 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 10' ' ' ASN . . . . . 0.754 ' CG ' HG22 ' A' ' 24' ' ' VAL . 2.6 m-20 -85.24 121.85 28.57 Favored 'General case' 0 N--CA 1.499 1.981 0 O-C-N 121.606 -0.684 . . . . 0.0 109.506 173.739 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 11' ' ' VAL . . . . . 0.483 HG12 ' HA ' ' A' ' 57' ' ' ILE . 30.9 m -144.0 161.08 15.77 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.774 0 C-N-CA 120.151 -0.62 . . . . 0.0 109.885 -179.403 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 12' ' ' GLU . . . . . 0.417 ' HB2' HD11 ' A' ' 58' ' ' LEU . 48.1 tt0 -109.33 147.23 33.03 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.737 -0.602 . . . . 0.0 109.6 177.124 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 13' ' ' VAL . . . . . 0.697 HG22 ' CD2' ' A' ' 55' ' ' LEU . 60.1 t -135.74 126.96 44.37 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.825 0 O-C-N 121.559 -0.713 . . . . 0.0 109.924 -173.758 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 14' ' ' LEU . . . . . 0.447 HD13 ' HG2' ' A' ' 20' ' ' LYS . 26.3 tp -95.91 125.6 40.58 Favored 'General case' 0 N--CA 1.492 1.665 0 N-CA-C 109.192 -0.67 . . . . 0.0 109.192 173.955 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 87.5 mt -93.12 170.51 9.59 Favored 'General case' 0 N--CA 1.497 1.889 0 O-C-N 121.67 -0.644 . . . . 0.0 110.951 -174.372 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 24.7 p30 -57.19 -21.55 34.15 Favored 'General case' 0 N--CA 1.505 2.309 0 O-C-N 121.738 -0.601 . . . . 0.0 111.575 -178.213 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 53.1 p-10 -91.6 22.04 4.31 Favored 'General case' 0 N--CA 1.499 1.975 0 O-C-N 121.571 -0.706 . . . . 0.0 110.933 -177.989 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 74.4 m-20 58.9 27.92 16.85 Favored 'General case' 0 N--CA 1.506 2.331 0 O-C-N 121.433 -0.792 . . . . 0.0 110.714 175.399 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 50.7 m -108.98 145.84 34.85 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.494 -0.754 . . . . 0.0 109.674 173.128 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 20' ' ' LYS . . . . . 0.447 ' HG2' HD13 ' A' ' 14' ' ' LEU . 80.3 mttt -109.68 140.03 44.02 Favored 'General case' 0 N--CA 1.495 1.777 0 O-C-N 121.57 -0.706 . . . . 0.0 110.481 -177.342 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -153.14 137.83 16.95 Favored 'General case' 0 N--CA 1.497 1.878 0 O-C-N 121.785 -0.572 . . . . 0.0 110.178 177.008 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 9.7 ptp180 -124.37 158.59 32.32 Favored 'General case' 0 N--CA 1.497 1.899 0 O-C-N 121.575 -0.703 . . . . 0.0 110.197 -179.219 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 23' ' ' GLY . . . . . 0.526 ' HA2' HD13 ' A' ' 39' ' ' LEU . . . -171.82 171.24 44.01 Favored Glycine 0 N--CA 1.493 2.447 0 N-CA-C 109.087 -1.605 . . . . 0.0 109.087 -178.337 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 24' ' ' VAL . . . . . 0.754 HG22 ' CG ' ' A' ' 10' ' ' ASN . 20.0 t -94.69 122.15 45.9 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.878 0 O-C-N 121.626 -0.926 . . . . 0.0 109.162 175.803 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 25' ' ' ILE . . . . . 0.432 ' HA ' HD23 ' A' ' 37' ' ' LEU . 87.9 mt -63.05 141.39 18.18 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.272 0 O-C-N 121.508 -0.745 . . . . 0.0 110.351 -171.988 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 26' ' ' THR . . . . . 0.606 HG21 ' HB2' ' A' ' 38' ' ' ARG . 13.7 p -121.11 -26.04 5.19 Favored 'General case' 0 N--CA 1.495 1.785 0 O-C-N 121.728 -0.607 . . . . 0.0 111.304 -179.906 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 26.9 t30 -162.87 160.24 24.78 Favored 'General case' 0 N--CA 1.5 2.062 0 O-C-N 120.965 -1.084 . . . . 0.0 111.789 179.936 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 28' ' ' PHE . . . . . 0.486 ' HE1' HG21 ' A' ' 49' ' ' THR . 87.8 t80 -150.09 127.1 11.18 Favored 'General case' 0 N--CA 1.498 1.96 0 N-CA-C 109.468 -0.568 . . . . 0.0 109.468 169.804 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 21.7 t70 -97.89 127.73 44.03 Favored 'General case' 0 N--CA 1.493 1.681 0 N-CA-C 109.111 -0.7 . . . . 0.0 109.111 -178.675 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 88.3 p -65.82 -44.62 85.03 Favored 'General case' 0 N--CA 1.499 1.985 0 O-C-N 121.607 -0.683 . . . . 0.0 110.755 -174.745 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 22.4 t -58.86 -48.1 82.57 Favored 'General case' 0 N--CA 1.502 2.158 0 O-C-N 121.446 -0.784 . . . . 0.0 111.002 -173.372 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 91.4 m-20 -107.03 -2.66 20.87 Favored 'General case' 0 N--CA 1.498 1.963 0 O-C-N 121.616 -0.678 . . . . 0.0 111.62 -178.932 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 3.4 m 49.2 67.24 0.91 Allowed 'General case' 0 N--CA 1.507 2.416 0 O-C-N 121.058 -1.026 . . . . 0.0 110.903 -174.027 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 34' ' ' ILE . . . . . 1.064 HD12 HG22 ' A' ' 48' ' ' VAL . 44.8 mm -116.22 125.83 73.45 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.025 0 O-C-N 121.512 -0.743 . . . . 0.0 109.162 -175.656 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 8.1 tp -115.83 121.53 42.69 Favored 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.636 -0.665 . . . . 0.0 110.569 -167.805 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 98.5 mt-30 -91.0 133.16 35.52 Favored 'General case' 0 N--CA 1.489 1.515 0 N-CA-C 109.351 -0.611 . . . . 0.0 109.351 172.392 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 37' ' ' LEU . . . . . 0.432 HD23 ' HA ' ' A' ' 25' ' ' ILE . 19.2 mt -117.84 123.58 46.25 Favored 'General case' 0 N--CA 1.495 1.793 0 C-N-CA 120.294 -0.562 . . . . 0.0 110.086 175.579 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 38' ' ' ARG . . . . . 0.606 ' HB2' HG21 ' A' ' 26' ' ' THR . 56.3 ttt85 -103.86 104.93 14.99 Favored 'General case' 0 N--CA 1.496 1.843 0 O-C-N 121.803 -0.561 . . . . 0.0 110.125 173.632 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 39' ' ' LEU . . . . . 0.526 HD13 ' HA2' ' A' ' 23' ' ' GLY . 61.1 tp -84.38 155.66 22.2 Favored 'General case' 0 N--CA 1.498 1.938 0 O-C-N 121.577 -0.702 . . . . 0.0 110.639 -176.647 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -68.3 -2.93 9.32 Favored 'General case' 0 N--CA 1.502 2.141 0 O-C-N 121.865 -0.522 . . . . 0.0 112.213 -170.548 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 7.0 m120 -86.7 28.16 0.91 Allowed 'General case' 0 N--CA 1.497 1.925 0 O-C-N 121.039 -1.038 . . . . 0.0 110.954 174.551 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 13.4 t0 64.9 28.77 12.64 Favored 'General case' 0 N--CA 1.505 2.298 0 O-C-N 121.205 -0.934 . . . . 0.0 110.388 175.528 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 66.5 m -125.92 138.03 53.75 Favored 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.437 -0.79 . . . . 0.0 110.113 178.633 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 9.8 t -128.29 146.78 50.65 Favored 'General case' 0 N--CA 1.495 1.813 0 O-C-N 121.702 -0.624 . . . . 0.0 109.928 178.197 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 46.3 mtmt -150.18 141.84 23.6 Favored 'General case' 0 N--CA 1.497 1.894 0 C-N-CA 120.129 -0.628 . . . . 0.0 110.655 -177.812 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 89.8 p -95.84 121.95 38.11 Favored 'General case' 0 N--CA 1.495 1.799 0 O-C-N 121.839 -0.538 . . . . 0.0 110.089 176.771 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 83.1 mt -129.32 135.8 60.92 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.789 0 O-C-N 121.616 -0.677 . . . . 0.0 109.349 -179.76 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 48' ' ' VAL . . . . . 1.064 HG22 HD12 ' A' ' 34' ' ' ILE . 65.4 t -81.84 127.69 39.38 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.861 0 O-C-N 121.577 -0.702 . . . . 0.0 109.224 179.755 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 49' ' ' THR . . . . . 0.486 HG21 ' HE1' ' A' ' 28' ' ' PHE . 37.5 p -58.7 -24.87 62.21 Favored 'General case' 0 N--CA 1.505 2.298 0 O-C-N 121.547 -0.721 . . . . 0.0 111.915 -169.959 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 33.5 tttp -56.46 -23.14 36.98 Favored 'General case' 0 N--CA 1.503 2.214 0 O-C-N 121.485 -0.759 . . . . 0.0 111.09 -177.141 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 51.7 p30 -83.05 0.73 43.55 Favored 'General case' 0 N--CA 1.5 2.029 0 C-N-CA 119.762 -0.775 . . . . 0.0 111.24 176.199 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 98.8 mt -75.81 126.79 36.92 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.038 0 O-C-N 121.193 -0.942 . . . . 0.0 109.955 177.829 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 79.6 tttt -91.28 -29.5 17.13 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.829 -0.545 . . . . 0.0 109.849 171.165 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 5.4 m-20 -164.15 157.3 17.9 Favored 'General case' 0 N--CA 1.5 2.063 0 O-C-N 121.768 -0.582 . . . . 0.0 110.093 -178.585 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 55' ' ' LEU . . . . . 0.697 ' CD2' HG22 ' A' ' 13' ' ' VAL . 84.6 mt -133.01 151.24 52.09 Favored 'General case' 0 N--CA 1.497 1.894 0 O-C-N 121.674 -0.641 . . . . 0.0 110.576 -179.525 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 6.2 ptm180 -152.63 136.87 16.56 Favored 'General case' 0 N--CA 1.495 1.798 0 O-C-N 121.833 -0.542 . . . . 0.0 109.732 174.818 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 57' ' ' ILE . . . . . 0.483 ' HA ' HG12 ' A' ' 11' ' ' VAL . 64.6 mt -83.51 133.17 29.74 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.846 0 O-C-N 121.522 -0.736 . . . . 0.0 109.81 176.212 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 58' ' ' LEU . . . . . 0.417 HD11 ' HB2' ' A' ' 12' ' ' GLU . 22.6 mt . . . . . 0 N--CA 1.497 1.915 0 O-C-N 121.633 -0.667 . . . . 0.0 109.964 -179.301 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 257' ' ' SER . . . . . . . . . . . . . 54.6 p . . . . . 0 N--CA 1.503 2.199 0 CA-C-O 121.285 0.564 . . . . 0.0 110.462 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' B' B ' 258' ' ' SER . . . . . . . . . . . . . 23.8 m -70.21 -31.95 69.62 Favored 'General case' 0 N--CA 1.498 1.955 0 C-N-CA 120.383 -0.527 . . . . 0.0 110.47 -179.335 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 259' ' ' GLN . . . . . . . . . . . . . 98.6 mt-30 -63.66 -40.84 97.85 Favored 'General case' 0 N--CA 1.501 2.109 0 O-C-N 121.511 -0.743 . . . . 0.0 110.542 -178.536 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 260' ' ' LEU . . . . . . . . . . . . . 84.2 mt -72.96 -41.63 64.21 Favored 'General case' 0 N--CA 1.498 1.955 0 O-C-N 121.635 -0.666 . . . . 0.0 110.295 -179.587 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 261' ' ' LEU . . . . . . . . . . . . . 20.7 tp -69.75 -38.46 76.82 Favored 'General case' 0 N--CA 1.497 1.909 0 O-C-N 121.655 -0.653 . . . . 0.0 109.884 178.857 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 262' ' ' SER . . . . . . . . . . . . . 88.8 p -63.32 -35.5 80.58 Favored 'General case' 0 N--CA 1.499 1.987 0 O-C-N 121.71 -0.619 . . . . 0.0 110.674 177.263 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 263' ' ' LEU . . . . . . . . . . . . . 26.7 mt . . . . . 0 N--CA 1.501 2.098 0 O-C-N 121.564 -0.71 . . . . 0.0 110.366 -179.734 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 70.0 m . . . . . 0 N--CA 1.496 1.833 0 CA-C-O 121.035 0.445 . . . . 0.0 110.245 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 3' ' ' VAL . . . . . 0.416 HG21 ' CZ ' ' A' ' 28' ' ' PHE . 49.9 t -65.74 -27.92 42.68 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.198 0 O-C-N 121.654 -0.654 . . . . 0.0 110.138 179.595 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -55.58 -31.99 62.68 Favored 'General case' 0 N--CA 1.501 2.123 0 O-C-N 121.394 -0.816 . . . . 0.0 110.334 -179.838 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 74.2 m-20 -68.65 -35.38 77.18 Favored 'General case' 0 N--CA 1.498 1.937 0 O-C-N 121.809 -0.557 . . . . 0.0 109.956 175.387 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 6' ' ' PHE . . . . . 0.411 ' CE1' HD21 ' B' ' 260' ' ' LEU . 97.6 m-85 -97.9 10.06 41.18 Favored 'General case' 0 N--CA 1.498 1.965 0 O-C-N 121.746 -0.596 . . . . 0.0 111.226 178.812 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -67.49 126.95 30.91 Favored 'General case' 0 N--CA 1.501 2.095 0 O-C-N 121.241 -0.912 . . . . 0.0 110.052 178.752 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 81.95 2.11 90.47 Favored Glycine 0 N--CA 1.497 2.716 0 N-CA-C 110.695 -0.962 . . . . 0.0 110.695 -176.938 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 59.6 p -77.86 142.66 38.37 Favored 'General case' 0 N--CA 1.497 1.924 0 O-C-N 121.061 -1.258 . . . . 0.0 110.065 175.31 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 10' ' ' ASN . . . . . 0.628 ' OD1' HG22 ' A' ' 24' ' ' VAL . 5.2 m-20 -85.27 117.53 24.26 Favored 'General case' 0 N--CA 1.5 2.028 0 N-CA-C 109.064 -0.717 . . . . 0.0 109.064 176.303 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 11' ' ' VAL . . . . . 0.443 HG12 ' HA ' ' A' ' 57' ' ' ILE . 29.8 m -142.21 158.88 20.08 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.89 0 C-N-CA 120.164 -0.614 . . . . 0.0 109.983 -179.152 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 12' ' ' GLU . . . . . 0.583 ' HB2' HD11 ' A' ' 58' ' ' LEU . 46.4 tt0 -109.4 129.53 55.54 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.619 -0.676 . . . . 0.0 110.107 178.772 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 13' ' ' VAL . . . . . 0.545 HG22 ' CD2' ' A' ' 55' ' ' LEU . 58.9 t -106.68 127.59 62.04 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.733 0 O-C-N 121.589 -0.695 . . . . 0.0 109.961 -178.917 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 14' ' ' LEU . . . . . 0.506 HD13 ' HG2' ' A' ' 20' ' ' LYS . 28.3 tp -95.84 127.67 42.06 Favored 'General case' 0 N--CA 1.493 1.689 0 N-CA-C 109.096 -0.705 . . . . 0.0 109.096 173.947 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 87.9 mt -96.47 169.26 10.03 Favored 'General case' 0 N--CA 1.495 1.814 0 O-C-N 121.567 -0.708 . . . . 0.0 111.168 -172.793 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 24.2 p30 -57.59 -22.14 43.21 Favored 'General case' 0 N--CA 1.507 2.398 0 O-C-N 121.94 -0.475 . . . . 0.0 111.636 -177.123 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 44.6 p-10 -92.53 22.83 4.36 Favored 'General case' 0 N--CA 1.498 1.943 0 O-C-N 121.522 -0.736 . . . . 0.0 110.905 -176.995 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 74.5 m-20 58.56 27.5 15.77 Favored 'General case' 0 N--CA 1.505 2.312 0 O-C-N 121.465 -0.772 . . . . 0.0 110.637 176.078 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 48.0 m -106.29 143.6 34.18 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.519 -0.738 . . . . 0.0 109.597 172.859 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 20' ' ' LYS . . . . . 0.506 ' HG2' HD13 ' A' ' 14' ' ' LEU . 66.5 mttt -109.73 148.86 30.66 Favored 'General case' 0 N--CA 1.494 1.749 0 O-C-N 121.579 -0.701 . . . . 0.0 110.556 -176.229 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -153.07 154.21 34.41 Favored 'General case' 0 N--CA 1.496 1.834 0 O-C-N 121.729 -0.607 . . . . 0.0 110.105 176.066 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 22' ' ' ARG . . . . . 0.402 ' O ' HD22 ' A' ' 39' ' ' LEU . 30.8 ptt180 -138.69 151.17 46.94 Favored 'General case' 0 N--CA 1.497 1.913 0 O-C-N 121.597 -0.689 . . . . 0.0 110.466 179.341 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 23' ' ' GLY . . . . . 0.433 ' HA2' HD13 ' A' ' 39' ' ' LEU . . . -171.9 171.27 44.04 Favored Glycine 0 N--CA 1.492 2.394 0 N-CA-C 108.956 -1.658 . . . . 0.0 108.956 -178.71 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 24' ' ' VAL . . . . . 0.628 HG22 ' OD1' ' A' ' 10' ' ' ASN . 30.3 t -94.56 124.85 47.21 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.815 0 O-C-N 121.571 -0.958 . . . . 0.0 109.125 175.498 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 25' ' ' ILE . . . . . 0.492 ' HA ' HD23 ' A' ' 37' ' ' LEU . 51.0 mt -61.87 134.77 27.07 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.171 0 O-C-N 121.428 -0.795 . . . . 0.0 110.834 -171.839 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 26' ' ' THR . . . . . 0.737 HG21 ' HB2' ' A' ' 38' ' ' ARG . 11.0 p -121.21 -16.94 7.84 Favored 'General case' 0 N--CA 1.494 1.765 0 O-C-N 121.916 -0.49 . . . . 0.0 111.61 -177.844 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 27' ' ' ASN . . . . . 0.424 ' O ' HD12 ' A' ' 35' ' ' LEU . 4.8 t-20 -166.09 157.38 13.49 Favored 'General case' 0 N--CA 1.504 2.251 0 O-C-N 120.927 -1.108 . . . . 0.0 111.75 175.61 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 28' ' ' PHE . . . . . 0.416 ' CZ ' HG21 ' A' ' 3' ' ' VAL . 72.0 t80 -150.28 122.15 8.15 Favored 'General case' 0 N--CA 1.496 1.855 0 N-CA-C 109.225 -0.657 . . . . 0.0 109.225 173.459 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 26.6 t0 -99.12 130.45 45.44 Favored 'General case' 0 N--CA 1.491 1.614 0 N-CA-C 109.139 -0.689 . . . . 0.0 109.139 -178.022 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 19.3 m -70.55 -51.88 25.53 Favored 'General case' 0 N--CA 1.497 1.916 0 C-N-CA 120.0 -0.68 . . . . 0.0 110.54 -176.081 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 31.5 m -60.71 -40.79 93.6 Favored 'General case' 0 N--CA 1.501 2.116 0 O-C-N 121.617 -0.677 . . . . 0.0 110.847 -174.813 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 91.6 m-20 -103.85 -9.97 18.57 Favored 'General case' 0 N--CA 1.497 1.914 0 O-C-N 121.678 -0.639 . . . . 0.0 111.616 -177.579 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 15.0 m 49.83 67.26 0.93 Allowed 'General case' 0 N--CA 1.508 2.468 0 O-C-N 121.142 -0.974 . . . . 0.0 110.899 -174.665 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 34' ' ' ILE . . . . . 1.042 HD12 HG22 ' A' ' 48' ' ' VAL . 43.9 mm -120.8 125.93 74.64 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.997 0 O-C-N 121.623 -0.673 . . . . 0.0 109.26 -175.645 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.424 HD12 ' O ' ' A' ' 27' ' ' ASN . 14.8 tp -115.93 118.89 34.22 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.691 -0.63 . . . . 0.0 110.451 -170.659 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 78.4 mt-30 -90.96 132.75 35.77 Favored 'General case' 0 N--CA 1.489 1.517 0 N-CA-C 109.21 -0.663 . . . . 0.0 109.21 171.863 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 37' ' ' LEU . . . . . 0.492 HD23 ' HA ' ' A' ' 25' ' ' ILE . 56.7 mt -117.77 123.57 46.32 Favored 'General case' 0 N--CA 1.493 1.693 0 C-N-CA 120.214 -0.594 . . . . 0.0 109.946 175.435 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 38' ' ' ARG . . . . . 0.737 ' HB2' HG21 ' A' ' 26' ' ' THR . 74.2 ttt-85 -104.27 104.87 14.84 Favored 'General case' 0 N--CA 1.496 1.835 0 O-C-N 121.716 -0.615 . . . . 0.0 109.97 173.643 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 39' ' ' LEU . . . . . 0.433 HD13 ' HA2' ' A' ' 23' ' ' GLY . 63.7 tp -85.01 156.76 20.98 Favored 'General case' 0 N--CA 1.498 1.926 0 O-C-N 121.622 -0.674 . . . . 0.0 110.607 -176.339 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -66.82 -3.0 5.79 Favored 'General case' 0 N--CA 1.502 2.168 0 O-C-N 121.927 -0.483 . . . . 0.0 112.203 -170.954 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 91.6 m-20 -86.01 28.94 0.76 Allowed 'General case' 0 N--CA 1.498 1.946 0 O-C-N 120.97 -1.081 . . . . 0.0 110.765 172.364 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 10.2 m-20 59.34 31.4 21.1 Favored 'General case' 0 N--CA 1.504 2.243 0 O-C-N 121.244 -0.91 . . . . 0.0 110.419 174.372 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 66.2 m -124.64 137.83 54.35 Favored 'General case' 0 N--CA 1.496 1.865 0 O-C-N 121.486 -0.759 . . . . 0.0 110.439 178.877 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 8.5 t -103.93 151.13 23.53 Favored 'General case' 0 N--CA 1.498 1.933 0 O-C-N 121.816 -0.553 . . . . 0.0 110.262 176.32 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 39.0 ttmt -149.81 119.15 6.85 Favored 'General case' 0 N--CA 1.495 1.819 0 O-C-N 121.616 -0.677 . . . . 0.0 110.365 178.224 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 88.6 p -94.93 121.4 36.49 Favored 'General case' 0 N--CA 1.495 1.811 0 O-C-N 121.781 -0.575 . . . . 0.0 110.264 179.936 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 81.7 mt -129.28 135.14 62.5 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.853 0 O-C-N 121.686 -0.634 . . . . 0.0 109.342 179.572 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 48' ' ' VAL . . . . . 1.042 HG22 HD12 ' A' ' 34' ' ' ILE . 67.6 t -81.61 127.63 39.42 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.862 0 N-CA-C 109.069 -0.715 . . . . 0.0 109.069 177.35 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 59.6 p -58.28 -24.85 60.82 Favored 'General case' 0 N--CA 1.503 2.2 0 O-C-N 121.492 -0.755 . . . . 0.0 111.855 -168.337 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 19.0 tptm -56.89 -26.65 59.4 Favored 'General case' 0 N--CA 1.501 2.118 0 O-C-N 121.531 -0.731 . . . . 0.0 111.024 -177.12 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 4.9 p30 -85.1 6.85 23.81 Favored 'General case' 0 N--CA 1.498 1.958 0 C-N-CA 119.748 -0.781 . . . . 0.0 111.42 176.562 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 98.4 mt -75.34 124.25 32.86 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.115 0 O-C-N 121.171 -0.956 . . . . 0.0 109.849 175.704 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 23.2 tptp -92.06 -29.11 16.74 Favored 'General case' 0 N--CA 1.494 1.774 0 O-C-N 121.801 -0.562 . . . . 0.0 109.879 171.081 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 5.2 m-20 -163.62 155.08 16.76 Favored 'General case' 0 N--CA 1.5 2.052 0 O-C-N 121.813 -0.554 . . . . 0.0 110.11 -178.145 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 55' ' ' LEU . . . . . 0.545 ' CD2' HG22 ' A' ' 13' ' ' VAL . 85.1 mt -132.99 149.65 52.22 Favored 'General case' 0 N--CA 1.497 1.903 0 O-C-N 121.736 -0.603 . . . . 0.0 110.432 -179.04 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 7.7 ptm180 -151.74 141.59 21.98 Favored 'General case' 0 N--CA 1.494 1.757 0 O-C-N 121.706 -0.621 . . . . 0.0 109.925 175.861 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 57' ' ' ILE . . . . . 0.443 ' HA ' HG12 ' A' ' 11' ' ' VAL . 69.5 mt -85.65 133.13 30.27 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.881 0 O-C-N 121.482 -0.762 . . . . 0.0 109.776 173.78 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 58' ' ' LEU . . . . . 0.583 HD11 ' HB2' ' A' ' 12' ' ' GLU . 79.2 mt . . . . . 0 N--CA 1.496 1.869 0 O-C-N 121.616 -0.677 . . . . 0.0 110.07 178.611 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 257' ' ' SER . . . . . . . . . . . . . 32.2 t . . . . . 0 N--CA 1.505 2.28 0 CA-C-O 121.255 0.55 . . . . 0.0 110.327 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' B' B ' 258' ' ' SER . . . . . . . . . . . . . 24.1 m -68.01 -31.39 71.05 Favored 'General case' 0 N--CA 1.497 1.919 0 C-N-CA 120.513 -0.475 . . . . 0.0 110.225 178.87 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 259' ' ' GLN . . . . . . . . . . . . . 48.7 tt0 -63.26 -37.12 86.01 Favored 'General case' 0 N--CA 1.5 2.027 0 O-C-N 121.647 -0.658 . . . . 0.0 110.37 178.714 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 260' ' ' LEU . . . . . 0.493 ' HA ' HD12 ' B' ' 263' ' ' LEU . 82.1 mt -64.18 -43.75 94.14 Favored 'General case' 0 N--CA 1.501 2.079 0 O-C-N 121.628 -0.67 . . . . 0.0 110.248 179.184 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 261' ' ' LEU . . . . . . . . . . . . . 17.5 tp -70.69 -38.36 73.68 Favored 'General case' 0 N--CA 1.497 1.915 0 O-C-N 121.662 -0.649 . . . . 0.0 109.733 175.919 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 262' ' ' SER . . . . . . . . . . . . . 23.1 t -62.38 -35.56 79.56 Favored 'General case' 0 N--CA 1.501 2.093 0 O-C-N 121.681 -0.637 . . . . 0.0 110.52 176.639 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 263' ' ' LEU . . . . . 0.493 HD12 ' HA ' ' B' ' 260' ' ' LEU . 18.3 mt . . . . . 0 N--CA 1.501 2.101 0 O-C-N 121.689 -0.632 . . . . 0.0 110.254 179.679 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 69.7 m . . . . . 0 N--CA 1.494 1.725 0 CA-C-O 120.969 0.414 . . . . 0.0 110.146 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 3' ' ' VAL . . . . . 0.428 HG12 ' CE1' ' A' ' 7' ' ' TYR . 61.3 t -65.92 -27.86 42.3 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.111 0 O-C-N 121.707 -0.621 . . . . 0.0 110.241 -178.798 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -55.19 -30.84 60.73 Favored 'General case' 0 N--CA 1.504 2.255 0 O-C-N 121.4 -0.813 . . . . 0.0 110.44 -178.64 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 74.4 m-20 -68.77 -30.98 69.69 Favored 'General case' 0 N--CA 1.5 2.032 0 C-N-CA 120.33 -0.548 . . . . 0.0 110.252 174.854 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 6' ' ' PHE . . . . . 0.404 ' CE1' HD21 ' B' ' 260' ' ' LEU . 96.7 m-85 -96.09 10.04 38.89 Favored 'General case' 0 N--CA 1.497 1.889 0 O-C-N 121.653 -0.655 . . . . 0.0 111.512 -178.168 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 7' ' ' TYR . . . . . 0.428 ' CE1' HG12 ' A' ' 3' ' ' VAL . 3.3 m-30 -67.24 137.53 56.23 Favored 'General case' 0 N--CA 1.501 2.105 0 O-C-N 121.093 -1.004 . . . . 0.0 110.014 174.189 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 8' ' ' GLY . . . . . 0.416 ' O ' HG13 ' A' ' 24' ' ' VAL . . . 82.72 -0.64 89.3 Favored Glycine 0 N--CA 1.498 2.796 0 N-CA-C 110.704 -0.959 . . . . 0.0 110.704 -176.294 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 31.8 t -77.02 133.96 38.96 Favored 'General case' 0 N--CA 1.498 1.937 0 O-C-N 121.113 -1.228 . . . . 0.0 110.488 178.928 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 13.6 t-20 -83.13 120.53 25.89 Favored 'General case' 0 N--CA 1.497 1.887 0 O-C-N 121.694 -0.628 . . . . 0.0 109.526 173.399 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 11' ' ' VAL . . . . . 0.538 HG12 ' HA ' ' A' ' 57' ' ' ILE . 35.2 m -143.15 165.42 15.45 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.734 0 N-CA-C 109.527 -0.546 . . . . 0.0 109.527 -178.329 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 12' ' ' GLU . . . . . 0.446 ' HB2' HD11 ' A' ' 58' ' ' LEU . 47.0 tt0 -109.35 126.38 53.34 Favored 'General case' 0 N--CA 1.494 1.729 0 C-N-CA 119.897 -0.721 . . . . 0.0 109.752 176.54 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 13' ' ' VAL . . . . . 0.608 HG22 ' CD2' ' A' ' 55' ' ' LEU . 54.1 t -106.79 125.1 62.77 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.745 0 O-C-N 121.614 -0.679 . . . . 0.0 109.891 -178.098 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 25.0 tp -95.94 128.59 42.97 Favored 'General case' 0 N--CA 1.494 1.734 0 N-CA-C 109.326 -0.62 . . . . 0.0 109.326 174.838 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 87.6 mt -96.68 169.5 9.83 Favored 'General case' 0 N--CA 1.496 1.837 0 O-C-N 121.677 -0.64 . . . . 0.0 111.004 -173.846 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 24.3 p30 -57.71 -22.2 44.94 Favored 'General case' 0 N--CA 1.505 2.307 0 O-C-N 121.701 -0.625 . . . . 0.0 111.615 -176.984 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 43.7 p-10 -93.05 23.16 4.44 Favored 'General case' 0 N--CA 1.497 1.902 0 O-C-N 121.523 -0.736 . . . . 0.0 110.867 -177.001 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 74.4 m-20 58.72 27.54 16.06 Favored 'General case' 0 N--CA 1.506 2.344 0 O-C-N 121.435 -0.79 . . . . 0.0 110.594 176.155 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 51.0 m -106.86 146.06 31.42 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.502 -0.749 . . . . 0.0 109.563 173.109 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 48.6 mttm -109.6 143.74 38.89 Favored 'General case' 0 N--CA 1.495 1.776 0 O-C-N 121.599 -0.688 . . . . 0.0 110.63 -176.599 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -153.07 123.64 7.23 Favored 'General case' 0 N--CA 1.497 1.876 0 O-C-N 121.778 -0.576 . . . . 0.0 110.048 176.575 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 22' ' ' ARG . . . . . 0.532 ' O ' HD13 ' A' ' 39' ' ' LEU . 8.9 ptp85 -118.32 147.61 43.31 Favored 'General case' 0 N--CA 1.498 1.96 0 O-C-N 121.615 -0.678 . . . . 0.0 110.375 -176.483 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -171.79 171.44 44.1 Favored Glycine 0 N--CA 1.495 2.63 0 N-CA-C 108.975 -1.65 . . . . 0.0 108.975 -176.148 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 24' ' ' VAL . . . . . 0.416 HG13 ' O ' ' A' ' 8' ' ' GLY . 47.2 t -94.58 119.41 42.53 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.925 0 O-C-N 121.433 -1.039 . . . . 0.0 109.355 -177.462 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 25' ' ' ILE . . . . . 0.413 ' HA ' HD23 ' A' ' 37' ' ' LEU . 74.9 mt -64.25 143.58 15.55 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.155 0 O-C-N 121.7 -0.625 . . . . 0.0 110.449 -171.975 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 26' ' ' THR . . . . . 0.794 HG21 ' HG3' ' A' ' 38' ' ' ARG . 20.7 p -121.3 -27.31 4.88 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.785 -0.572 . . . . 0.0 111.233 179.176 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 27' ' ' ASN . . . . . 0.538 ' O ' HD12 ' A' ' 35' ' ' LEU . 26.9 t30 -161.39 160.91 30.06 Favored 'General case' 0 N--CA 1.501 2.078 0 C-N-CA 118.95 -1.1 . . . . 0.0 111.814 -178.854 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 28' ' ' PHE . . . . . 0.444 ' CE1' HG21 ' A' ' 49' ' ' THR . 69.5 t80 -150.02 128.37 12.14 Favored 'General case' 0 N--CA 1.496 1.86 0 N-CA-C 109.301 -0.629 . . . . 0.0 109.301 169.107 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 17.9 t70 -100.2 130.56 46.34 Favored 'General case' 0 N--CA 1.492 1.659 0 N-CA-C 109.04 -0.726 . . . . 0.0 109.04 -178.351 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 87.1 p -68.87 -48.59 63.03 Favored 'General case' 0 N--CA 1.498 1.963 0 C-N-CA 120.016 -0.674 . . . . 0.0 110.649 -175.925 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 23.0 m -59.76 -43.77 94.15 Favored 'General case' 0 N--CA 1.502 2.16 0 O-C-N 121.636 -0.665 . . . . 0.0 110.907 -174.221 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 91.5 m-20 -104.24 -8.66 19.18 Favored 'General case' 0 N--CA 1.497 1.919 0 O-C-N 121.687 -0.633 . . . . 0.0 111.619 -178.252 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 24.8 m 49.71 67.22 0.93 Allowed 'General case' 0 N--CA 1.508 2.442 0 O-C-N 121.131 -0.98 . . . . 0.0 110.929 -174.403 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 34' ' ' ILE . . . . . 0.986 HD12 HG22 ' A' ' 48' ' ' VAL . 42.6 mm -122.52 126.1 73.6 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.028 0 O-C-N 121.635 -0.666 . . . . 0.0 109.356 -175.45 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.538 HD12 ' O ' ' A' ' 27' ' ' ASN . 12.3 tp -115.78 120.47 39.41 Favored 'General case' 0 N--CA 1.494 1.739 0 O-C-N 121.699 -0.626 . . . . 0.0 110.589 -169.464 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 99.0 mt-30 -91.08 132.96 35.71 Favored 'General case' 0 N--CA 1.49 1.538 0 N-CA-C 109.517 -0.549 . . . . 0.0 109.517 174.506 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 37' ' ' LEU . . . . . 0.413 HD23 ' HA ' ' A' ' 25' ' ' ILE . 15.5 mt -117.95 123.84 46.76 Favored 'General case' 0 N--CA 1.495 1.811 0 O-C-N 121.902 -0.498 . . . . 0.0 109.964 176.034 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 38' ' ' ARG . . . . . 0.794 ' HG3' HG21 ' A' ' 26' ' ' THR . 11.6 mtt85 -96.83 106.91 19.31 Favored 'General case' 0 N--CA 1.498 1.934 0 O-C-N 121.646 -0.659 . . . . 0.0 109.924 175.792 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 39' ' ' LEU . . . . . 0.532 HD13 ' O ' ' A' ' 22' ' ' ARG . 16.8 tp -84.67 152.48 23.75 Favored 'General case' 0 N--CA 1.495 1.777 0 C-N-CA 120.24 -0.584 . . . . 0.0 110.813 -174.807 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -66.8 -5.44 12.19 Favored 'General case' 0 N--CA 1.502 2.146 0 O-C-N 121.941 -0.474 . . . . 0.0 112.041 -171.658 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 91.6 m-20 -86.99 28.09 0.95 Allowed 'General case' 0 N--CA 1.499 2.001 0 O-C-N 121.115 -0.991 . . . . 0.0 110.879 174.547 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 8.5 t70 62.91 29.27 16.55 Favored 'General case' 0 N--CA 1.505 2.278 0 O-C-N 120.981 -1.074 . . . . 0.0 110.462 175.769 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 50.1 m -124.5 137.86 54.39 Favored 'General case' 0 N--CA 1.496 1.838 0 O-C-N 121.401 -0.812 . . . . 0.0 110.49 -179.438 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 9.8 t -97.7 150.99 20.59 Favored 'General case' 0 N--CA 1.497 1.911 0 O-C-N 121.818 -0.552 . . . . 0.0 110.194 175.47 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 41.3 tttp -149.3 119.13 7.07 Favored 'General case' 0 N--CA 1.495 1.786 0 O-C-N 121.546 -0.721 . . . . 0.0 110.313 178.679 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 90.2 p -95.61 122.27 38.18 Favored 'General case' 0 N--CA 1.494 1.769 0 O-C-N 121.701 -0.625 . . . . 0.0 110.194 179.005 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 82.3 mt -129.21 134.38 64.0 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.924 0 O-C-N 121.717 -0.614 . . . . 0.0 109.423 179.396 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 48' ' ' VAL . . . . . 0.986 HG22 HD12 ' A' ' 34' ' ' ILE . 49.1 t -82.62 127.88 39.24 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.941 0 O-C-N 121.66 -0.65 . . . . 0.0 109.321 179.14 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 49' ' ' THR . . . . . 0.444 HG21 ' CE1' ' A' ' 28' ' ' PHE . 33.9 p -58.53 -24.98 61.93 Favored 'General case' 0 N--CA 1.505 2.285 0 O-C-N 121.649 -0.657 . . . . 0.0 112.332 -166.013 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 24.6 pttm -56.34 -22.59 31.87 Favored 'General case' 0 N--CA 1.505 2.278 0 O-C-N 121.488 -0.757 . . . . 0.0 111.239 -175.779 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 9.9 p30 -82.51 -0.53 46.98 Favored 'General case' 0 N--CA 1.5 2.042 0 O-C-N 121.563 -0.711 . . . . 0.0 111.199 176.253 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 94.1 mt -77.0 126.96 38.06 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.069 0 O-C-N 121.176 -0.953 . . . . 0.0 110.012 177.585 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 41.1 tttp -92.02 -29.84 16.38 Favored 'General case' 0 N--CA 1.494 1.765 0 O-C-N 121.809 -0.557 . . . . 0.0 109.822 170.592 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 5.3 m-20 -164.24 156.97 17.31 Favored 'General case' 0 N--CA 1.5 2.026 0 O-C-N 121.717 -0.614 . . . . 0.0 110.058 -177.923 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 55' ' ' LEU . . . . . 0.608 ' CD2' HG22 ' A' ' 13' ' ' VAL . 74.4 mt -132.9 148.73 52.29 Favored 'General case' 0 N--CA 1.497 1.902 0 O-C-N 121.721 -0.612 . . . . 0.0 110.429 -179.287 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 7.0 ptm180 -151.06 141.53 22.5 Favored 'General case' 0 N--CA 1.496 1.863 0 O-C-N 121.694 -0.629 . . . . 0.0 109.868 175.634 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 57' ' ' ILE . . . . . 0.538 ' HA ' HG12 ' A' ' 11' ' ' VAL . 59.1 mt -85.74 133.36 29.74 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.888 0 O-C-N 121.47 -0.769 . . . . 0.0 110.012 176.205 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 58' ' ' LEU . . . . . 0.456 HD11 ' HB2' ' A' ' 22' ' ' ARG . 20.8 mt . . . . . 0 N--CA 1.498 1.962 0 O-C-N 121.606 -0.684 . . . . 0.0 109.942 -179.202 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 257' ' ' SER . . . . . 0.463 ' HA ' HD12 ' B' ' 260' ' ' LEU . 58.4 m . . . . . 0 N--CA 1.502 2.173 0 CA-C-O 121.359 0.6 . . . . 0.0 110.465 . . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 258' ' ' SER . . . . . . . . . . . . . 25.4 m -67.75 -33.19 74.36 Favored 'General case' 0 N--CA 1.498 1.936 0 O-C-N 121.827 -0.545 . . . . 0.0 110.204 -179.684 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 259' ' ' GLN . . . . . . . . . . . . . 98.4 mt-30 -64.76 -33.51 76.15 Favored 'General case' 0 N--CA 1.5 2.05 0 O-C-N 121.632 -0.668 . . . . 0.0 110.323 178.883 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 260' ' ' LEU . . . . . 0.51 ' HA ' HD12 ' B' ' 263' ' ' LEU . 82.2 mt -65.38 -40.05 93.01 Favored 'General case' 0 N--CA 1.5 2.071 0 O-C-N 121.636 -0.665 . . . . 0.0 110.181 178.808 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 261' ' ' LEU . . . . . . . . . . . . . 25.5 tp -69.15 -39.93 78.5 Favored 'General case' 0 N--CA 1.499 2.015 0 O-C-N 121.671 -0.643 . . . . 0.0 109.862 176.634 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 262' ' ' SER . . . . . . . . . . . . . 22.7 m -62.55 -37.14 84.98 Favored 'General case' 0 N--CA 1.502 2.136 0 O-C-N 121.74 -0.6 . . . . 0.0 110.493 177.853 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 263' ' ' LEU . . . . . 0.51 HD12 ' HA ' ' B' ' 260' ' ' LEU . 30.2 mt . . . . . 0 N--CA 1.501 2.085 0 O-C-N 121.649 -0.657 . . . . 0.0 110.315 179.46 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 70.4 m . . . . . 0 N--CA 1.493 1.715 0 CA-C-O 120.935 0.398 . . . . 0.0 110.179 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 3' ' ' VAL . . . . . 0.443 HG12 ' CE1' ' A' ' 7' ' ' TYR . 63.2 t -66.35 -27.85 41.75 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.093 0 O-C-N 121.644 -0.66 . . . . 0.0 110.188 -179.467 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -55.06 -30.98 60.75 Favored 'General case' 0 N--CA 1.505 2.275 0 O-C-N 121.394 -0.816 . . . . 0.0 110.439 -179.214 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 74.3 m-20 -68.57 -30.8 69.65 Favored 'General case' 0 N--CA 1.499 1.996 0 O-C-N 121.81 -0.556 . . . . 0.0 110.226 174.776 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 96.7 m-85 -95.8 10.15 38.06 Favored 'General case' 0 N--CA 1.496 1.859 0 O-C-N 121.574 -0.704 . . . . 0.0 111.524 -178.589 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 7' ' ' TYR . . . . . 0.443 ' CE1' HG12 ' A' ' 3' ' ' VAL . 4.0 m-30 -67.34 139.43 57.22 Favored 'General case' 0 N--CA 1.504 2.228 0 O-C-N 121.211 -0.931 . . . . 0.0 109.964 174.123 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 82.06 3.14 90.67 Favored Glycine 0 N--CA 1.497 2.727 0 N-CA-C 110.56 -1.016 . . . . 0.0 110.56 -176.595 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 73.9 m -78.12 135.74 37.74 Favored 'General case' 0 N--CA 1.498 1.929 0 O-C-N 121.114 -1.227 . . . . 0.0 110.524 175.943 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 14.0 t-20 -83.92 117.43 23.34 Favored 'General case' 0 N--CA 1.497 1.91 0 O-C-N 121.6 -0.687 . . . . 0.0 109.588 172.169 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 11' ' ' VAL . . . . . 0.546 HG12 ' HA ' ' A' ' 57' ' ' ILE . 35.4 m -142.29 164.39 17.9 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.691 0 N-CA-C 109.319 -0.622 . . . . 0.0 109.319 -179.275 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 12' ' ' GLU . . . . . 0.438 ' HB2' HD21 ' A' ' 58' ' ' LEU . 44.8 tt0 -109.36 129.04 55.54 Favored 'General case' 0 N--CA 1.492 1.666 0 C-N-CA 119.739 -0.785 . . . . 0.0 109.914 177.453 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 13' ' ' VAL . . . . . 0.551 HG22 ' CD2' ' A' ' 55' ' ' LEU . 58.3 t -106.74 125.14 62.69 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.697 0 O-C-N 121.575 -0.703 . . . . 0.0 109.873 -179.566 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 30.2 tp -95.85 128.43 42.72 Favored 'General case' 0 N--CA 1.494 1.728 0 N-CA-C 109.272 -0.64 . . . . 0.0 109.272 175.124 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 84.8 mt -98.28 166.31 11.45 Favored 'General case' 0 N--CA 1.496 1.846 0 O-C-N 121.683 -0.636 . . . . 0.0 111.047 -173.304 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 24.3 p30 -58.86 -21.66 57.55 Favored 'General case' 0 N--CA 1.504 2.271 0 O-C-N 121.769 -0.582 . . . . 0.0 111.64 -176.833 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 43.5 p-10 -92.64 23.4 4.09 Favored 'General case' 0 N--CA 1.498 1.953 0 O-C-N 121.547 -0.72 . . . . 0.0 110.905 -175.725 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 74.3 m-20 58.5 27.1 15.12 Favored 'General case' 0 N--CA 1.506 2.339 0 O-C-N 121.406 -0.809 . . . . 0.0 110.65 176.306 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 51.1 m -106.51 145.85 31.32 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.587 -0.696 . . . . 0.0 109.55 172.531 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 49.7 mttp -109.7 150.26 28.55 Favored 'General case' 0 N--CA 1.494 1.759 0 O-C-N 121.625 -0.672 . . . . 0.0 110.573 -175.531 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -152.97 150.37 29.16 Favored 'General case' 0 N--CA 1.496 1.861 0 O-C-N 121.682 -0.636 . . . . 0.0 110.111 176.05 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 22' ' ' ARG . . . . . 0.515 ' O ' HD13 ' A' ' 39' ' ' LEU . 5.8 ptm180 -144.06 140.26 29.4 Favored 'General case' 0 N--CA 1.498 1.934 0 O-C-N 121.614 -0.679 . . . . 0.0 110.509 179.407 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -171.8 171.4 44.09 Favored Glycine 0 N--CA 1.496 2.678 0 N-CA-C 109.085 -1.606 . . . . 0.0 109.085 -176.051 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 60.4 t -94.59 121.57 45.31 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.91 0 O-C-N 121.511 -0.993 . . . . 0.0 109.357 -177.338 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 25' ' ' ILE . . . . . 0.665 ' HA ' HD23 ' A' ' 37' ' ' LEU . 91.9 mt -65.09 144.04 15.19 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.066 0 O-C-N 121.636 -0.665 . . . . 0.0 110.65 -171.332 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 26' ' ' THR . . . . . 0.611 HG21 ' HB2' ' A' ' 38' ' ' ARG . 7.0 p -121.23 -27.56 4.86 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.78 -0.575 . . . . 0.0 111.133 178.807 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 27' ' ' ASN . . . . . 0.5 ' O ' HD12 ' A' ' 35' ' ' LEU . 8.0 t30 -161.56 160.94 29.59 Favored 'General case' 0 N--CA 1.5 2.044 0 C-N-CA 118.985 -1.086 . . . . 0.0 111.904 -178.547 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 28' ' ' PHE . . . . . 0.577 ' HE1' HG21 ' A' ' 49' ' ' THR . 84.5 t80 -150.15 125.09 9.9 Favored 'General case' 0 N--CA 1.498 1.934 0 N-CA-C 108.87 -0.789 . . . . 0.0 108.87 170.366 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 18.0 t70 -99.44 130.31 45.69 Favored 'General case' 0 N--CA 1.491 1.591 0 N-CA-C 108.986 -0.746 . . . . 0.0 108.986 -176.449 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 20.1 m -69.75 -50.88 39.11 Favored 'General case' 0 N--CA 1.498 1.935 0 C-N-CA 120.004 -0.678 . . . . 0.0 110.449 -177.142 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 23.2 m -59.88 -41.95 92.71 Favored 'General case' 0 N--CA 1.501 2.104 0 O-C-N 121.597 -0.689 . . . . 0.0 110.781 -174.771 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 29.7 m120 -103.93 -10.13 18.38 Favored 'General case' 0 N--CA 1.497 1.915 0 O-C-N 121.676 -0.64 . . . . 0.0 111.644 -177.766 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 1.8 m 49.94 67.31 0.93 Allowed 'General case' 0 N--CA 1.508 2.442 0 O-C-N 121.046 -1.034 . . . . 0.0 111.037 -175.003 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 34' ' ' ILE . . . . . 1.107 HD12 HG22 ' A' ' 48' ' ' VAL . 47.7 mm -126.26 127.39 70.66 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.089 0 O-C-N 121.51 -0.744 . . . . 0.0 109.46 -175.864 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.5 HD12 ' O ' ' A' ' 27' ' ' ASN . 11.2 tp -115.89 120.59 39.7 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.742 -0.599 . . . . 0.0 110.511 -170.832 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 58.6 mt-30 -91.55 134.59 34.53 Favored 'General case' 0 N--CA 1.492 1.65 0 N-CA-C 109.481 -0.563 . . . . 0.0 109.481 174.639 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 37' ' ' LEU . . . . . 0.665 HD23 ' HA ' ' A' ' 25' ' ' ILE . 89.4 mt -117.87 123.94 47.11 Favored 'General case' 0 N--CA 1.497 1.895 0 C-N-CA 120.406 -0.518 . . . . 0.0 109.929 174.641 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 38' ' ' ARG . . . . . 0.611 ' HB2' HG21 ' A' ' 26' ' ' THR . 57.7 ttt85 -96.34 107.21 19.54 Favored 'General case' 0 N--CA 1.497 1.914 0 O-C-N 121.596 -0.69 . . . . 0.0 109.736 175.79 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 39' ' ' LEU . . . . . 0.515 HD13 ' O ' ' A' ' 22' ' ' ARG . 18.4 tp -85.36 153.58 22.44 Favored 'General case' 0 N--CA 1.495 1.811 0 O-C-N 121.693 -0.629 . . . . 0.0 111.085 -173.65 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -62.99 -9.76 11.24 Favored 'General case' 0 N--CA 1.503 2.186 0 O-C-N 122.031 -0.418 . . . . 0.0 112.045 -170.475 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 53.6 p-10 -85.12 28.94 0.68 Allowed 'General case' 0 N--CA 1.499 2.011 0 O-C-N 121.024 -1.048 . . . . 0.0 111.049 175.064 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 74.4 m-20 57.95 29.59 17.88 Favored 'General case' 0 N--CA 1.504 2.252 0 O-C-N 121.112 -0.992 . . . . 0.0 110.404 176.619 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 28.2 m -119.71 137.9 53.63 Favored 'General case' 0 N--CA 1.496 1.852 0 O-C-N 121.518 -0.739 . . . . 0.0 110.306 178.604 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 9.8 t -97.86 150.07 21.69 Favored 'General case' 0 N--CA 1.495 1.79 0 O-C-N 121.728 -0.608 . . . . 0.0 110.327 176.608 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 19.9 mtpp -148.93 122.25 9.01 Favored 'General case' 0 N--CA 1.495 1.815 0 O-C-N 121.714 -0.616 . . . . 0.0 110.423 178.207 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 90.6 p -96.37 123.79 40.14 Favored 'General case' 0 N--CA 1.496 1.85 0 O-C-N 121.815 -0.553 . . . . 0.0 110.202 179.802 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 82.0 mt -129.28 134.23 64.18 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.858 0 O-C-N 121.673 -0.642 . . . . 0.0 109.269 179.111 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 48' ' ' VAL . . . . . 1.107 HG22 HD12 ' A' ' 34' ' ' ILE . 57.8 t -81.93 127.61 39.46 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.9 0 C-N-CA 120.036 -0.666 . . . . 0.0 109.306 179.989 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 49' ' ' THR . . . . . 0.577 HG21 ' HE1' ' A' ' 28' ' ' PHE . 39.3 p -59.91 -24.79 64.6 Favored 'General case' 0 N--CA 1.504 2.241 0 O-C-N 121.582 -0.698 . . . . 0.0 112.054 -170.415 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 32.3 ttpt -56.25 -23.29 35.12 Favored 'General case' 0 N--CA 1.503 2.214 0 O-C-N 121.43 -0.794 . . . . 0.0 111.138 -177.037 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 48.5 p30 -84.16 1.95 41.94 Favored 'General case' 0 N--CA 1.498 1.933 0 O-C-N 121.463 -0.773 . . . . 0.0 111.342 176.61 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 97.4 mt -75.55 127.84 37.09 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.145 0 O-C-N 121.154 -0.966 . . . . 0.0 110.084 178.66 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 52.3 tttm -92.6 -30.4 15.64 Favored 'General case' 0 N--CA 1.494 1.77 0 O-C-N 121.843 -0.536 . . . . 0.0 109.687 169.379 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 5.1 m-20 -163.9 158.04 19.39 Favored 'General case' 0 N--CA 1.5 2.038 0 O-C-N 121.785 -0.572 . . . . 0.0 109.994 -178.304 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 55' ' ' LEU . . . . . 0.551 ' CD2' HG22 ' A' ' 13' ' ' VAL . 83.4 mt -132.94 149.59 52.23 Favored 'General case' 0 N--CA 1.496 1.863 0 O-C-N 121.656 -0.653 . . . . 0.0 110.38 -179.201 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 20.1 ptp180 -151.51 144.84 24.76 Favored 'General case' 0 N--CA 1.497 1.895 0 O-C-N 121.705 -0.622 . . . . 0.0 110.16 175.813 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 57' ' ' ILE . . . . . 0.546 ' HA ' HG12 ' A' ' 11' ' ' VAL . 66.4 mt -86.59 133.41 29.91 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.88 0 O-C-N 121.661 -0.649 . . . . 0.0 110.042 174.221 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 58' ' ' LEU . . . . . 0.448 HD11 ' HB2' ' A' ' 22' ' ' ARG . 16.6 mt . . . . . 0 N--CA 1.498 1.935 0 O-C-N 121.64 -0.662 . . . . 0.0 109.894 -179.092 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 257' ' ' SER . . . . . . . . . . . . . 59.2 m . . . . . 0 N--CA 1.502 2.157 0 CA-C-O 121.232 0.539 . . . . 0.0 110.594 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' B' B ' 258' ' ' SER . . . . . . . . . . . . . 68.9 p -69.93 -31.86 69.83 Favored 'General case' 0 N--CA 1.498 1.96 0 C-N-CA 120.248 -0.581 . . . . 0.0 110.302 -178.983 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 259' ' ' GLN . . . . . . . . . . . . . 98.8 mt-30 -64.61 -37.02 86.13 Favored 'General case' 0 N--CA 1.501 2.081 0 O-C-N 121.54 -0.725 . . . . 0.0 110.39 -179.888 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 260' ' ' LEU . . . . . 0.491 ' HA ' HD12 ' B' ' 263' ' ' LEU . 47.1 mt -66.24 -42.22 88.92 Favored 'General case' 0 N--CA 1.501 2.075 0 O-C-N 121.699 -0.625 . . . . 0.0 110.199 179.637 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 261' ' ' LEU . . . . . . . . . . . . . 21.5 tp -70.57 -38.05 74.05 Favored 'General case' 0 N--CA 1.497 1.887 0 O-C-N 121.704 -0.623 . . . . 0.0 109.762 176.561 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 262' ' ' SER . . . . . . . . . . . . . 66.6 m -62.51 -36.04 81.3 Favored 'General case' 0 N--CA 1.501 2.124 0 O-C-N 121.733 -0.604 . . . . 0.0 110.444 176.724 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 263' ' ' LEU . . . . . 0.491 HD12 ' HA ' ' B' ' 260' ' ' LEU . 22.5 mt . . . . . 0 N--CA 1.501 2.098 0 O-C-N 121.669 -0.644 . . . . 0.0 110.241 179.803 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 75.5 m . . . . . 0 N--CA 1.494 1.758 0 CA-C-O 120.985 0.421 . . . . 0.0 110.222 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 58.1 t -65.78 -27.98 42.79 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.176 0 O-C-N 121.721 -0.612 . . . . 0.0 110.326 -179.146 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -55.63 -32.45 63.17 Favored 'General case' 0 N--CA 1.504 2.24 0 O-C-N 121.427 -0.796 . . . . 0.0 110.424 -178.319 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -68.7 -34.4 75.58 Favored 'General case' 0 N--CA 1.498 1.937 0 C-N-CA 120.389 -0.524 . . . . 0.0 109.971 174.79 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 6' ' ' PHE . . . . . 0.447 ' CE2' HD11 ' B' ' 260' ' ' LEU . 96.2 m-85 -97.37 10.21 40.25 Favored 'General case' 0 N--CA 1.498 1.958 0 O-C-N 121.767 -0.583 . . . . 0.0 111.166 178.798 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -67.43 128.88 38.06 Favored 'General case' 0 N--CA 1.5 2.071 0 O-C-N 121.247 -0.908 . . . . 0.0 110.006 -179.832 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 8' ' ' GLY . . . . . 0.466 ' O ' HG13 ' A' ' 24' ' ' VAL . . . 82.77 -0.82 89.23 Favored Glycine 0 N--CA 1.497 2.723 0 N-CA-C 110.839 -0.904 . . . . 0.0 110.839 -176.463 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 57.7 p -76.37 138.7 40.59 Favored 'General case' 0 N--CA 1.497 1.918 0 O-C-N 121.07 -1.253 . . . . 0.0 110.335 177.171 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 11.3 t-20 -84.55 119.17 24.87 Favored 'General case' 0 N--CA 1.496 1.844 0 O-C-N 121.666 -0.646 . . . . 0.0 109.784 174.154 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 11' ' ' VAL . . . . . 0.529 HG12 ' HA ' ' A' ' 57' ' ' ILE . 35.1 m -141.75 163.99 19.38 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.717 0 O-C-N 121.737 -0.602 . . . . 0.0 109.427 -179.41 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 37.7 tt0 -109.37 130.15 55.51 Favored 'General case' 0 N--CA 1.492 1.649 0 C-N-CA 119.855 -0.738 . . . . 0.0 109.996 177.574 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 13' ' ' VAL . . . . . 0.534 HG22 ' CD2' ' A' ' 55' ' ' LEU . 58.4 t -106.78 127.35 62.39 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.692 0 O-C-N 121.551 -0.718 . . . . 0.0 109.827 -179.799 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 29.4 tp -95.81 125.85 40.66 Favored 'General case' 0 N--CA 1.494 1.769 0 N-CA-C 109.102 -0.703 . . . . 0.0 109.102 174.344 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 85.0 mt -97.07 166.79 11.42 Favored 'General case' 0 N--CA 1.495 1.792 0 O-C-N 121.624 -0.672 . . . . 0.0 111.293 -171.968 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 24.4 p30 -58.0 -21.49 45.08 Favored 'General case' 0 N--CA 1.507 2.382 0 O-C-N 121.83 -0.544 . . . . 0.0 111.569 -177.296 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 43.5 p-10 -93.54 27.1 2.74 Favored 'General case' 0 N--CA 1.497 1.887 0 O-C-N 121.537 -0.727 . . . . 0.0 110.539 -178.135 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 1.1 p30 53.08 27.28 5.6 Favored 'General case' 0 N--CA 1.506 2.345 0 CA-C-O 121.173 0.511 . . . . 0.0 111.042 172.249 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 51.1 m -107.62 147.33 30.79 Favored 'General case' 0 N--CA 1.491 1.585 0 N-CA-C 109.149 -0.685 . . . . 0.0 109.149 171.026 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 49.6 mttp -109.62 147.81 32.4 Favored 'General case' 0 N--CA 1.495 1.784 0 O-C-N 121.595 -0.691 . . . . 0.0 110.62 -174.744 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -153.02 156.61 39.13 Favored 'General case' 0 N--CA 1.496 1.826 0 O-C-N 121.742 -0.599 . . . . 0.0 110.129 176.18 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 22' ' ' ARG . . . . . 0.406 ' O ' HD22 ' A' ' 39' ' ' LEU . 30.8 ptt180 -144.07 152.84 41.52 Favored 'General case' 0 N--CA 1.496 1.838 0 O-C-N 121.679 -0.638 . . . . 0.0 110.416 178.464 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 23' ' ' GLY . . . . . 0.451 ' HA2' HD13 ' A' ' 39' ' ' LEU . . . -171.9 171.07 43.93 Favored Glycine 0 N--CA 1.493 2.453 0 N-CA-C 109.184 -1.566 . . . . 0.0 109.184 179.597 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 24' ' ' VAL . . . . . 0.466 HG13 ' O ' ' A' ' 8' ' ' GLY . 45.4 t -94.57 126.31 47.02 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.925 0 O-C-N 121.643 -0.916 . . . . 0.0 109.178 175.498 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 25' ' ' ILE . . . . . 0.475 ' HA ' HD23 ' A' ' 37' ' ' LEU . 52.7 mt -62.86 138.36 22.97 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.147 0 O-C-N 121.589 -0.694 . . . . 0.0 111.012 -170.806 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 26' ' ' THR . . . . . 0.622 HG21 ' HG3' ' A' ' 38' ' ' ARG . 18.1 p -121.25 -19.09 7.19 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.861 -0.524 . . . . 0.0 111.563 179.501 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 27' ' ' ASN . . . . . 0.445 ' O ' HD12 ' A' ' 35' ' ' LEU . 2.2 t-20 -165.26 157.94 15.87 Favored 'General case' 0 N--CA 1.504 2.263 0 O-C-N 120.949 -1.095 . . . . 0.0 111.732 175.329 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 28' ' ' PHE . . . . . 0.435 ' HE1' HG21 ' A' ' 49' ' ' THR . 64.3 t80 -150.29 121.11 7.58 Favored 'General case' 0 N--CA 1.495 1.79 0 N-CA-C 109.246 -0.65 . . . . 0.0 109.246 173.683 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 17.8 t70 -98.28 130.42 44.98 Favored 'General case' 0 N--CA 1.492 1.645 0 N-CA-C 109.114 -0.699 . . . . 0.0 109.114 -176.708 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 23.2 t -70.22 -52.32 24.07 Favored 'General case' 0 N--CA 1.497 1.91 0 C-N-CA 119.977 -0.689 . . . . 0.0 110.618 -176.653 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 22.5 m -60.42 -40.69 91.91 Favored 'General case' 0 N--CA 1.502 2.171 0 O-C-N 121.654 -0.654 . . . . 0.0 110.798 -174.993 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 29.8 m120 -104.0 -10.09 18.35 Favored 'General case' 0 N--CA 1.497 1.914 0 O-C-N 121.578 -0.701 . . . . 0.0 111.601 -177.266 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 7.7 m 49.54 67.22 0.93 Allowed 'General case' 0 N--CA 1.508 2.441 0 O-C-N 121.114 -0.991 . . . . 0.0 110.886 -174.606 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 34' ' ' ILE . . . . . 1.028 HD12 HG22 ' A' ' 48' ' ' VAL . 44.7 mm -121.41 125.9 74.23 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.001 0 O-C-N 121.603 -0.686 . . . . 0.0 109.329 -175.886 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.445 HD12 ' O ' ' A' ' 27' ' ' ASN . 15.8 tp -116.19 118.91 34.12 Favored 'General case' 0 N--CA 1.494 1.743 0 O-C-N 121.617 -0.677 . . . . 0.0 110.537 -171.088 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 92.1 mt-30 -91.35 131.24 36.97 Favored 'General case' 0 N--CA 1.491 1.624 0 N-CA-C 109.391 -0.596 . . . . 0.0 109.391 171.299 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 37' ' ' LEU . . . . . 0.475 HD23 ' HA ' ' A' ' 25' ' ' ILE . 44.6 mt -117.81 123.54 46.2 Favored 'General case' 0 N--CA 1.494 1.764 0 O-C-N 121.752 -0.592 . . . . 0.0 110.15 176.41 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 38' ' ' ARG . . . . . 0.622 ' HG3' HG21 ' A' ' 26' ' ' THR . 66.0 mtt-85 -103.18 106.59 17.14 Favored 'General case' 0 N--CA 1.498 1.942 0 O-C-N 121.688 -0.632 . . . . 0.0 110.246 171.583 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 39' ' ' LEU . . . . . 0.451 HD13 ' HA2' ' A' ' 23' ' ' GLY . 56.9 tp -83.53 151.76 25.24 Favored 'General case' 0 N--CA 1.497 1.925 0 O-C-N 121.527 -0.733 . . . . 0.0 110.488 -178.256 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -68.69 -2.95 10.37 Favored 'General case' 0 N--CA 1.503 2.202 0 O-C-N 121.722 -0.611 . . . . 0.0 112.172 -170.641 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 91.4 m-20 -87.89 28.83 0.98 Allowed 'General case' 0 N--CA 1.498 1.938 0 O-C-N 121.033 -1.042 . . . . 0.0 110.74 174.769 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 6.3 t70 64.99 28.8 12.46 Favored 'General case' 0 N--CA 1.506 2.326 0 O-C-N 121.205 -0.934 . . . . 0.0 110.397 175.771 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 67.2 m -123.97 139.72 53.67 Favored 'General case' 0 N--CA 1.495 1.777 0 O-C-N 121.449 -0.782 . . . . 0.0 110.035 177.869 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 7.6 t -128.16 147.1 50.54 Favored 'General case' 0 N--CA 1.496 1.861 0 O-C-N 121.736 -0.603 . . . . 0.0 109.939 179.486 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 45' ' ' LYS . . . . . 0.544 ' HE3' HD11 ' A' ' 47' ' ' ILE . 21.8 ttpt -152.25 132.4 13.54 Favored 'General case' 0 N--CA 1.496 1.869 0 C-N-CA 120.1 -0.64 . . . . 0.0 110.686 -177.526 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 86.9 p -95.27 124.33 39.25 Favored 'General case' 0 N--CA 1.495 1.779 0 O-C-N 121.75 -0.594 . . . . 0.0 110.108 177.574 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 47' ' ' ILE . . . . . 0.544 HD11 ' HE3' ' A' ' 45' ' ' LYS . 77.8 mt -129.25 134.94 62.97 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.855 0 O-C-N 121.651 -0.655 . . . . 0.0 109.333 179.724 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 48' ' ' VAL . . . . . 1.028 HG22 HD12 ' A' ' 34' ' ' ILE . 64.2 t -81.78 127.67 39.39 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.916 0 N-CA-C 109.074 -0.713 . . . . 0.0 109.074 177.646 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 49' ' ' THR . . . . . 0.435 HG21 ' HE1' ' A' ' 28' ' ' PHE . 61.0 p -58.03 -24.96 60.41 Favored 'General case' 0 N--CA 1.506 2.365 0 O-C-N 121.49 -0.756 . . . . 0.0 111.872 -167.763 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 33.5 tttp -56.65 -24.8 50.95 Favored 'General case' 0 N--CA 1.503 2.196 0 O-C-N 121.444 -0.785 . . . . 0.0 111.014 -177.228 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 46.3 p30 -84.06 3.28 35.31 Favored 'General case' 0 N--CA 1.499 1.992 0 C-N-CA 119.725 -0.79 . . . . 0.0 111.363 176.691 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 52' ' ' ILE . . . . . 0.427 HG21 HD11 ' A' ' 55' ' ' LEU . 98.9 mt -75.2 124.38 32.94 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.104 0 O-C-N 121.185 -0.947 . . . . 0.0 109.926 177.976 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 74.7 tttt -93.26 -28.59 16.15 Favored 'General case' 0 N--CA 1.495 1.786 0 O-C-N 121.81 -0.556 . . . . 0.0 109.959 171.227 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 5.0 m-20 -163.3 153.58 15.89 Favored 'General case' 0 N--CA 1.499 2.02 0 O-C-N 121.707 -0.62 . . . . 0.0 110.068 -178.094 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 55' ' ' LEU . . . . . 0.534 ' CD2' HG22 ' A' ' 13' ' ' VAL . 83.8 mt -132.96 148.8 52.27 Favored 'General case' 0 N--CA 1.497 1.902 0 O-C-N 121.681 -0.637 . . . . 0.0 110.512 -178.535 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 20.2 ptp180 -151.97 145.19 24.66 Favored 'General case' 0 N--CA 1.495 1.799 0 O-C-N 121.7 -0.625 . . . . 0.0 110.123 175.152 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 57' ' ' ILE . . . . . 0.529 ' HA ' HG12 ' A' ' 11' ' ' VAL . 67.1 mt -85.84 133.48 29.5 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.822 0 O-C-N 121.539 -0.726 . . . . 0.0 109.765 172.405 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 58' ' ' LEU . . . . . 0.402 HD11 ' HB2' ' A' ' 22' ' ' ARG . 30.5 mt . . . . . 0 N--CA 1.497 1.898 0 O-C-N 121.446 -0.784 . . . . 0.0 109.802 -177.215 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 257' ' ' SER . . . . . . . . . . . . . 50.0 m . . . . . 0 N--CA 1.503 2.224 0 CA-C-O 121.268 0.556 . . . . 0.0 110.518 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' B' B ' 258' ' ' SER . . . . . . . . . . . . . 23.4 t -68.23 -33.04 73.66 Favored 'General case' 0 N--CA 1.499 2.0 0 C-N-CA 120.463 -0.495 . . . . 0.0 110.242 -179.814 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 259' ' ' GLN . . . . . . . . . . . . . 78.3 mt-30 -64.65 -34.91 79.4 Favored 'General case' 0 N--CA 1.5 2.031 0 O-C-N 121.665 -0.647 . . . . 0.0 110.37 179.717 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 260' ' ' LEU . . . . . 0.525 ' HA ' HD12 ' B' ' 263' ' ' LEU . 85.7 mt -65.66 -42.6 91.17 Favored 'General case' 0 N--CA 1.501 2.082 0 O-C-N 121.728 -0.608 . . . . 0.0 110.259 179.288 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 261' ' ' LEU . . . . . . . . . . . . . 22.5 tp -69.79 -36.91 76.1 Favored 'General case' 0 N--CA 1.498 1.943 0 C-N-CA 120.175 -0.61 . . . . 0.0 109.73 176.391 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 262' ' ' SER . . . . . . . . . . . . . 22.8 t -62.33 -36.4 82.08 Favored 'General case' 0 N--CA 1.5 2.07 0 O-C-N 121.756 -0.59 . . . . 0.0 110.516 177.198 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 263' ' ' LEU . . . . . 0.525 HD12 ' HA ' ' B' ' 260' ' ' LEU . 18.2 mt . . . . . 0 N--CA 1.501 2.076 0 O-C-N 121.654 -0.654 . . . . 0.0 110.154 179.764 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 70.3 m . . . . . 0 N--CA 1.494 1.733 0 CA-C-O 120.936 0.398 . . . . 0.0 110.124 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 3' ' ' VAL . . . . . 0.453 HG12 ' CE1' ' A' ' 7' ' ' TYR . 65.7 t -66.33 -27.81 41.64 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.131 0 O-C-N 121.792 -0.568 . . . . 0.0 110.249 -179.771 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -55.14 -30.94 60.85 Favored 'General case' 0 N--CA 1.505 2.292 0 O-C-N 121.462 -0.774 . . . . 0.0 110.449 -178.671 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 9.7 m-20 -68.66 -30.87 69.66 Favored 'General case' 0 N--CA 1.499 2.024 0 O-C-N 121.88 -0.513 . . . . 0.0 110.24 174.789 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 96.5 m-85 -95.84 10.1 38.28 Favored 'General case' 0 N--CA 1.497 1.921 0 O-C-N 121.679 -0.638 . . . . 0.0 111.449 -178.398 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 7' ' ' TYR . . . . . 0.453 ' CE1' HG12 ' A' ' 3' ' ' VAL . 3.7 m-30 -67.16 141.81 57.24 Favored 'General case' 0 N--CA 1.501 2.105 0 O-C-N 121.147 -0.971 . . . . 0.0 110.112 174.966 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 8' ' ' GLY . . . . . 0.431 ' O ' HG13 ' A' ' 24' ' ' VAL . . . 82.95 -1.39 88.66 Favored Glycine 0 N--CA 1.498 2.776 0 N-CA-C 110.745 -0.942 . . . . 0.0 110.745 -177.056 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 9' ' ' SER . . . . . 0.521 ' OG ' HD12 ' A' ' 25' ' ' ILE . 88.5 p -77.34 141.01 40.09 Favored 'General case' 0 N--CA 1.498 1.972 0 O-C-N 121.125 -1.221 . . . . 0.0 110.509 -179.454 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 10' ' ' ASN . . . . . 0.679 ' CG ' HG22 ' A' ' 24' ' ' VAL . 2.5 m120 -85.16 118.53 24.78 Favored 'General case' 0 N--CA 1.498 1.943 0 O-C-N 121.669 -0.644 . . . . 0.0 109.646 174.323 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 11' ' ' VAL . . . . . 0.668 HG21 HD11 ' A' ' 25' ' ' ILE . 35.8 m -143.12 160.94 17.6 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.796 0 O-C-N 121.732 -0.605 . . . . 0.0 109.76 -178.746 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 12' ' ' GLU . . . . . 0.588 ' HB2' HD11 ' A' ' 58' ' ' LEU . 44.6 tt0 -109.43 125.36 52.34 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.575 -0.703 . . . . 0.0 110.16 178.142 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 13' ' ' VAL . . . . . 0.591 HG22 ' CD2' ' A' ' 55' ' ' LEU . 59.6 t -106.87 123.17 61.74 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.839 0 O-C-N 121.565 -0.709 . . . . 0.0 109.946 -177.629 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 14' ' ' LEU . . . . . 0.438 HD13 ' HD3' ' A' ' 20' ' ' LYS . 27.6 tp -96.2 128.95 43.58 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.726 -0.609 . . . . 0.0 109.636 175.222 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 82.8 mt -99.04 167.16 10.9 Favored 'General case' 0 N--CA 1.497 1.922 0 O-C-N 121.609 -0.682 . . . . 0.0 110.97 -171.799 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 9.5 p30 -57.77 -22.11 45.23 Favored 'General case' 0 N--CA 1.505 2.294 0 O-C-N 121.76 -0.587 . . . . 0.0 111.39 -179.961 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 24.6 p30 -90.03 21.3 3.75 Favored 'General case' 0 N--CA 1.5 2.063 0 O-C-N 121.59 -0.694 . . . . 0.0 111.163 -177.721 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 74.4 m-20 59.87 28.8 18.35 Favored 'General case' 0 N--CA 1.506 2.36 0 O-C-N 121.339 -0.851 . . . . 0.0 110.813 172.675 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 18.0 m -111.66 133.94 53.57 Favored 'General case' 0 N--CA 1.494 1.769 0 O-C-N 121.494 -0.754 . . . . 0.0 109.573 170.617 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 20' ' ' LYS . . . . . 0.438 ' HD3' HD13 ' A' ' 14' ' ' LEU . 5.3 ttpm? -109.84 142.15 41.52 Favored 'General case' 0 N--CA 1.494 1.731 0 O-C-N 121.647 -0.658 . . . . 0.0 110.523 -177.114 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -152.99 160.27 43.0 Favored 'General case' 0 N--CA 1.496 1.828 0 O-C-N 121.773 -0.579 . . . . 0.0 110.09 179.562 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 22' ' ' ARG . . . . . 0.496 ' O ' HD13 ' A' ' 39' ' ' LEU . 30.9 ptt180 -140.28 148.57 41.63 Favored 'General case' 0 N--CA 1.497 1.916 0 O-C-N 121.622 -0.674 . . . . 0.0 110.8 -178.844 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -171.71 171.44 44.08 Favored Glycine 0 N--CA 1.495 2.617 0 N-CA-C 108.701 -1.759 . . . . 0.0 108.701 -176.332 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 24' ' ' VAL . . . . . 0.679 HG22 ' CG ' ' A' ' 10' ' ' ASN . 39.0 t -94.6 118.84 41.6 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.925 0 O-C-N 121.462 -1.022 . . . . 0.0 109.314 -175.913 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 25' ' ' ILE . . . . . 0.668 HD11 HG21 ' A' ' 11' ' ' VAL . 95.3 mt -63.95 143.41 15.7 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.142 0 O-C-N 121.665 -0.647 . . . . 0.0 110.333 -172.073 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 26' ' ' THR . . . . . 0.623 HG21 ' HB2' ' A' ' 38' ' ' ARG . 7.5 p -121.25 -27.01 4.95 Favored 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.721 -0.612 . . . . 0.0 111.336 -179.887 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 27' ' ' ASN . . . . . 0.528 ' O ' HD12 ' A' ' 35' ' ' LEU . 27.2 t30 -162.03 160.67 27.84 Favored 'General case' 0 N--CA 1.499 1.991 0 C-N-CA 119.002 -1.079 . . . . 0.0 111.814 -179.109 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 28' ' ' PHE . . . . . 0.553 ' HE1' HG21 ' A' ' 49' ' ' THR . 83.3 t80 -150.19 126.73 10.86 Favored 'General case' 0 N--CA 1.497 1.901 0 N-CA-C 108.964 -0.754 . . . . 0.0 108.964 170.599 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 21.3 t70 -99.73 130.51 45.95 Favored 'General case' 0 N--CA 1.491 1.597 0 N-CA-C 108.955 -0.757 . . . . 0.0 108.955 -177.431 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 20.1 m -70.31 -51.68 28.4 Favored 'General case' 0 N--CA 1.498 1.946 0 C-N-CA 119.999 -0.681 . . . . 0.0 110.394 -176.9 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 23.1 m -60.07 -41.25 92.02 Favored 'General case' 0 N--CA 1.502 2.17 0 O-C-N 121.619 -0.676 . . . . 0.0 110.829 -174.967 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 29.8 m120 -103.91 -10.14 18.4 Favored 'General case' 0 N--CA 1.496 1.87 0 O-C-N 121.624 -0.673 . . . . 0.0 111.613 -177.662 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 1.8 m 49.91 67.34 0.92 Allowed 'General case' 0 N--CA 1.509 2.51 0 O-C-N 121.098 -1.001 . . . . 0.0 111.07 -175.776 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 34' ' ' ILE . . . . . 1.128 HD12 HG22 ' A' ' 48' ' ' VAL . 47.4 mm -126.69 127.03 69.76 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.167 0 O-C-N 121.597 -0.689 . . . . 0.0 109.479 -176.066 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.528 HD12 ' O ' ' A' ' 27' ' ' ASN . 11.7 tp -115.88 121.61 42.87 Favored 'General case' 0 N--CA 1.494 1.765 0 O-C-N 121.708 -0.62 . . . . 0.0 110.521 -170.432 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 79.5 mt-30 -91.61 134.19 34.9 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.829 -0.544 . . . . 0.0 109.539 173.83 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 37' ' ' LEU . . . . . 0.409 HD23 ' HA ' ' A' ' 25' ' ' ILE . 13.9 mt -117.82 123.81 46.83 Favored 'General case' 0 N--CA 1.493 1.725 0 O-C-N 121.798 -0.564 . . . . 0.0 109.989 174.52 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 38' ' ' ARG . . . . . 0.623 ' HB2' HG21 ' A' ' 26' ' ' THR . 56.6 ttt85 -98.42 107.69 20.2 Favored 'General case' 0 N--CA 1.497 1.878 0 O-C-N 121.63 -0.669 . . . . 0.0 109.756 175.986 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 39' ' ' LEU . . . . . 0.496 HD13 ' O ' ' A' ' 22' ' ' ARG . 18.9 tp -85.1 150.75 24.63 Favored 'General case' 0 N--CA 1.495 1.797 0 O-C-N 121.697 -0.627 . . . . 0.0 110.993 -173.933 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -63.15 -9.17 9.83 Favored 'General case' 0 N--CA 1.503 2.184 0 O-C-N 121.922 -0.486 . . . . 0.0 111.962 -173.223 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 37.7 t30 -85.01 29.08 0.66 Allowed 'General case' 0 N--CA 1.499 2.018 0 O-C-N 121.146 -0.971 . . . . 0.0 110.952 174.202 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 74.4 m-20 59.67 31.81 21.1 Favored 'General case' 0 N--CA 1.504 2.27 0 O-C-N 121.257 -0.902 . . . . 0.0 110.428 174.176 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 48.9 m -123.92 137.78 54.58 Favored 'General case' 0 N--CA 1.496 1.859 0 O-C-N 121.394 -0.816 . . . . 0.0 110.374 178.836 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 9.0 t -97.55 150.21 21.35 Favored 'General case' 0 N--CA 1.497 1.906 0 O-C-N 121.735 -0.603 . . . . 0.0 110.212 176.244 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 42.1 tttp -149.81 119.16 6.85 Favored 'General case' 0 N--CA 1.496 1.861 0 O-C-N 121.662 -0.649 . . . . 0.0 110.255 178.466 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 90.3 p -96.07 122.63 39.12 Favored 'General case' 0 N--CA 1.495 1.807 0 O-C-N 121.676 -0.64 . . . . 0.0 110.21 178.431 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 82.5 mt -129.27 135.68 61.24 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.845 0 O-C-N 121.565 -0.709 . . . . 0.0 109.328 179.835 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 48' ' ' VAL . . . . . 1.128 HG22 HD12 ' A' ' 34' ' ' ILE . 58.7 t -81.95 127.57 39.5 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.902 0 O-C-N 121.531 -0.731 . . . . 0.0 109.232 179.56 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 49' ' ' THR . . . . . 0.553 HG21 ' HE1' ' A' ' 28' ' ' PHE . 37.4 p -59.41 -24.81 63.78 Favored 'General case' 0 N--CA 1.504 2.273 0 O-C-N 121.659 -0.651 . . . . 0.0 112.055 -170.101 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 73.5 tttt -56.23 -22.78 31.62 Favored 'General case' 0 N--CA 1.503 2.183 0 O-C-N 121.401 -0.812 . . . . 0.0 111.1 -177.161 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 51.4 p30 -83.8 0.92 45.42 Favored 'General case' 0 N--CA 1.499 1.985 0 O-C-N 121.443 -0.786 . . . . 0.0 111.358 176.369 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 96.3 mt -75.99 127.76 37.36 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.089 0 O-C-N 121.162 -0.961 . . . . 0.0 110.084 178.72 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 75.0 tttt -91.76 -32.39 15.41 Favored 'General case' 0 N--CA 1.493 1.711 0 N-CA-C 109.443 -0.577 . . . . 0.0 109.443 169.901 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -161.47 157.29 24.79 Favored 'General case' 0 N--CA 1.497 1.898 0 O-C-N 121.723 -0.611 . . . . 0.0 109.815 -177.037 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 55' ' ' LEU . . . . . 0.591 ' CD2' HG22 ' A' ' 13' ' ' VAL . 85.2 mt -132.92 148.55 52.28 Favored 'General case' 0 N--CA 1.497 1.904 0 O-C-N 121.65 -0.656 . . . . 0.0 110.462 -179.851 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 6.5 ptm180 -150.76 139.6 20.85 Favored 'General case' 0 N--CA 1.495 1.782 0 O-C-N 121.765 -0.584 . . . . 0.0 109.94 176.335 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 57' ' ' ILE . . . . . 0.471 ' HA ' HG12 ' A' ' 11' ' ' VAL . 67.7 mt -84.98 133.26 29.73 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.872 0 O-C-N 121.522 -0.736 . . . . 0.0 109.671 174.079 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 58' ' ' LEU . . . . . 0.588 HD11 ' HB2' ' A' ' 12' ' ' GLU . 45.1 mt . . . . . 0 N--CA 1.498 1.952 0 O-C-N 121.566 -0.709 . . . . 0.0 110.255 -178.462 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 257' ' ' SER . . . . . . . . . . . . . 6.6 t . . . . . 0 N--CA 1.503 2.198 0 CA-C-O 121.324 0.583 . . . . 0.0 110.421 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' B' B ' 258' ' ' SER . . . . . . . . . . . . . 24.8 m -68.09 -32.53 72.91 Favored 'General case' 0 N--CA 1.497 1.908 0 O-C-N 121.864 -0.522 . . . . 0.0 110.239 179.983 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 259' ' ' GLN . . . . . . . . . . . . . 78.1 mt-30 -64.64 -35.03 79.71 Favored 'General case' 0 N--CA 1.5 2.028 0 O-C-N 121.593 -0.692 . . . . 0.0 110.367 179.782 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 260' ' ' LEU . . . . . 0.544 ' HA ' HD12 ' B' ' 263' ' ' LEU . 51.4 mt -65.52 -43.4 90.17 Favored 'General case' 0 N--CA 1.501 2.082 0 O-C-N 121.67 -0.644 . . . . 0.0 110.281 179.045 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 261' ' ' LEU . . . . . . . . . . . . . 21.5 tp -71.05 -36.94 72.5 Favored 'General case' 0 N--CA 1.498 1.932 0 C-N-CA 120.088 -0.645 . . . . 0.0 109.586 174.97 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 262' ' ' SER . . . . . . . . . . . . . 22.6 t -62.25 -35.69 79.73 Favored 'General case' 0 N--CA 1.501 2.09 0 O-C-N 121.714 -0.616 . . . . 0.0 110.438 175.893 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 263' ' ' LEU . . . . . 0.544 HD12 ' HA ' ' B' ' 260' ' ' LEU . 16.2 mt . . . . . 0 N--CA 1.5 2.068 0 O-C-N 121.683 -0.635 . . . . 0.0 110.242 179.433 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 66.2 m . . . . . 0 N--CA 1.495 1.786 0 CA-C-O 121.046 0.451 . . . . 0.0 110.181 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 3' ' ' VAL . . . . . 0.472 HG12 ' CE1' ' A' ' 7' ' ' TYR . 69.5 t -66.46 -27.82 41.51 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.048 0 O-C-N 121.652 -0.655 . . . . 0.0 110.254 -179.265 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -55.17 -31.27 61.23 Favored 'General case' 0 N--CA 1.504 2.273 0 O-C-N 121.499 -0.751 . . . . 0.0 110.42 -178.891 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 74.5 m-20 -68.63 -31.33 70.4 Favored 'General case' 0 N--CA 1.499 1.99 0 O-C-N 121.883 -0.511 . . . . 0.0 110.131 174.714 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 87.4 m-85 -95.59 10.05 38.07 Favored 'General case' 0 N--CA 1.497 1.887 0 O-C-N 121.641 -0.662 . . . . 0.0 111.398 -179.573 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 7' ' ' TYR . . . . . 0.472 ' CE1' HG12 ' A' ' 3' ' ' VAL . 3.1 m-30 -67.24 144.05 56.16 Favored 'General case' 0 N--CA 1.502 2.128 0 O-C-N 121.154 -0.966 . . . . 0.0 110.042 175.52 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 8' ' ' GLY . . . . . 0.429 ' O ' HG13 ' A' ' 24' ' ' VAL . . . 82.06 0.71 89.88 Favored Glycine 0 N--CA 1.497 2.717 0 N-CA-C 110.483 -1.047 . . . . 0.0 110.483 -175.766 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 9' ' ' SER . . . . . 0.478 ' OG ' HD12 ' A' ' 25' ' ' ILE . 89.2 p -77.75 141.04 39.52 Favored 'General case' 0 N--CA 1.497 1.889 0 O-C-N 121.079 -1.248 . . . . 0.0 110.514 -178.851 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 10' ' ' ASN . . . . . 0.699 ' CG ' HG22 ' A' ' 24' ' ' VAL . 2.6 m120 -85.08 120.2 26.32 Favored 'General case' 0 N--CA 1.497 1.92 0 O-C-N 121.665 -0.647 . . . . 0.0 109.495 173.532 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 11' ' ' VAL . . . . . 0.71 HG21 HD11 ' A' ' 25' ' ' ILE . 35.5 m -143.5 162.93 16.21 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.78 0 O-C-N 121.715 -0.616 . . . . 0.0 109.566 -178.838 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 12' ' ' GLU . . . . . 0.463 ' HB2' HD11 ' A' ' 58' ' ' LEU . 33.3 tt0 -109.4 127.87 54.7 Favored 'General case' 0 N--CA 1.494 1.729 0 C-N-CA 119.896 -0.722 . . . . 0.0 109.952 177.539 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 13' ' ' VAL . . . . . 0.592 HG22 ' CD2' ' A' ' 55' ' ' LEU . 60.5 t -106.92 124.1 62.4 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.863 0 O-C-N 121.673 -0.642 . . . . 0.0 109.808 -179.67 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 15.4 tp -96.03 125.96 40.94 Favored 'General case' 0 N--CA 1.494 1.749 0 O-C-N 121.761 -0.587 . . . . 0.0 109.47 175.144 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 83.1 mt -97.44 163.17 12.99 Favored 'General case' 0 N--CA 1.498 1.937 0 O-C-N 121.553 -0.717 . . . . 0.0 111.054 -172.594 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 24.9 p30 -59.21 -21.64 59.81 Favored 'General case' 0 N--CA 1.505 2.294 0 O-C-N 121.722 -0.611 . . . . 0.0 111.489 -177.961 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 25.5 p30 -92.19 23.52 3.79 Favored 'General case' 0 N--CA 1.498 1.959 0 O-C-N 121.532 -0.73 . . . . 0.0 110.977 -176.571 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 74.4 m-20 60.18 28.63 18.22 Favored 'General case' 0 N--CA 1.504 2.265 0 O-C-N 121.414 -0.804 . . . . 0.0 110.836 173.07 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 43.2 m -107.99 134.94 50.18 Favored 'General case' 0 N--CA 1.495 1.793 0 O-C-N 121.491 -0.755 . . . . 0.0 109.567 170.395 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 37.4 ttmt -109.64 137.73 47.04 Favored 'General case' 0 N--CA 1.494 1.761 0 O-C-N 121.756 -0.59 . . . . 0.0 110.345 -176.137 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -153.05 158.86 42.58 Favored 'General case' 0 N--CA 1.496 1.836 0 O-C-N 121.686 -0.634 . . . . 0.0 110.498 -179.782 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 22' ' ' ARG . . . . . 0.49 ' O ' HD13 ' A' ' 39' ' ' LEU . 42.9 ptt85 -144.02 150.88 38.92 Favored 'General case' 0 N--CA 1.496 1.836 0 O-C-N 121.683 -0.635 . . . . 0.0 110.5 178.838 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -171.64 171.42 44.06 Favored Glycine 0 N--CA 1.494 2.535 0 N-CA-C 108.872 -1.691 . . . . 0.0 108.872 -174.493 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 24' ' ' VAL . . . . . 0.699 HG22 ' CG ' ' A' ' 10' ' ' ASN . 38.5 t -94.49 117.17 37.58 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.933 0 O-C-N 121.522 -0.987 . . . . 0.0 109.402 -176.519 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 25' ' ' ILE . . . . . 0.71 HD11 HG21 ' A' ' 11' ' ' VAL . 92.0 mt -63.93 143.16 15.94 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.154 0 O-C-N 121.642 -0.661 . . . . 0.0 110.397 -172.157 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 26' ' ' THR . . . . . 0.607 HG21 ' HB2' ' A' ' 38' ' ' ARG . 7.8 p -121.21 -26.76 5.01 Favored 'General case' 0 N--CA 1.495 1.785 0 O-C-N 121.685 -0.634 . . . . 0.0 111.245 -179.669 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 7.6 t30 -161.94 156.9 23.01 Favored 'General case' 0 N--CA 1.5 2.051 0 C-N-CA 118.88 -1.128 . . . . 0.0 111.726 -178.17 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 28' ' ' PHE . . . . . 0.528 ' CE1' HG21 ' A' ' 49' ' ' THR . 62.8 t80 -150.07 123.56 9.07 Favored 'General case' 0 N--CA 1.498 1.949 0 N-CA-C 109.373 -0.602 . . . . 0.0 109.373 170.433 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 17.8 t70 -99.3 127.06 45.26 Favored 'General case' 0 N--CA 1.492 1.638 0 N-CA-C 109.162 -0.681 . . . . 0.0 109.162 -178.541 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 22.6 t -64.68 -43.53 93.23 Favored 'General case' 0 N--CA 1.5 2.044 0 O-C-N 121.72 -0.612 . . . . 0.0 110.907 -174.709 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 21.1 m -59.7 -48.09 83.06 Favored 'General case' 0 N--CA 1.502 2.166 0 O-C-N 121.539 -0.726 . . . . 0.0 110.984 -173.444 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 91.5 m-20 -106.99 -0.31 23.15 Favored 'General case' 0 N--CA 1.498 1.966 0 O-C-N 121.613 -0.679 . . . . 0.0 111.675 -179.364 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 45.2 p 45.26 67.02 0.78 Allowed 'General case' 0 N--CA 1.507 2.391 0 O-C-N 121.494 -0.754 . . . . 0.0 111.212 -174.986 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 34' ' ' ILE . . . . . 0.976 HD12 HG22 ' A' ' 48' ' ' VAL . 41.3 mm -114.48 125.86 71.88 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.963 0 O-C-N 121.629 -0.669 . . . . 0.0 109.213 -176.047 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 10.2 tp -115.75 118.84 34.16 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.604 -0.685 . . . . 0.0 110.416 -169.554 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 99.3 mt-30 -91.38 133.13 35.72 Favored 'General case' 0 N--CA 1.49 1.528 0 N-CA-C 109.381 -0.6 . . . . 0.0 109.381 173.731 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 14.6 mt -117.88 123.8 46.76 Favored 'General case' 0 N--CA 1.494 1.753 0 O-C-N 121.837 -0.539 . . . . 0.0 109.945 175.107 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 38' ' ' ARG . . . . . 0.607 ' HB2' HG21 ' A' ' 26' ' ' THR . 72.5 ttt180 -97.36 105.01 17.08 Favored 'General case' 0 N--CA 1.495 1.813 0 O-C-N 121.672 -0.643 . . . . 0.0 109.783 176.001 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 39' ' ' LEU . . . . . 0.49 HD13 ' O ' ' A' ' 22' ' ' ARG . 22.0 tp -85.16 154.3 22.1 Favored 'General case' 0 N--CA 1.494 1.765 0 O-C-N 121.716 -0.615 . . . . 0.0 111.075 -173.624 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -65.54 -6.48 10.94 Favored 'General case' 0 N--CA 1.503 2.179 0 O-C-N 121.955 -0.466 . . . . 0.0 112.149 -169.961 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 49.4 p-10 -86.17 29.15 0.76 Allowed 'General case' 0 N--CA 1.5 2.064 0 O-C-N 121.12 -0.987 . . . . 0.0 110.873 174.199 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 74.3 m-20 57.65 29.68 17.66 Favored 'General case' 0 N--CA 1.504 2.24 0 O-C-N 121.252 -0.905 . . . . 0.0 110.36 177.126 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 37.8 m -120.62 137.87 54.2 Favored 'General case' 0 N--CA 1.496 1.852 0 O-C-N 121.458 -0.776 . . . . 0.0 110.397 178.996 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 9.7 t -97.47 150.99 20.45 Favored 'General case' 0 N--CA 1.497 1.878 0 O-C-N 121.76 -0.588 . . . . 0.0 110.222 176.46 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 40.9 tttp -148.61 119.14 7.42 Favored 'General case' 0 N--CA 1.497 1.886 0 O-C-N 121.591 -0.693 . . . . 0.0 110.269 178.05 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 91.0 p -96.59 122.12 39.16 Favored 'General case' 0 N--CA 1.494 1.736 0 O-C-N 121.635 -0.666 . . . . 0.0 110.284 179.027 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 82.8 mt -129.32 133.94 64.65 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.909 0 O-C-N 121.628 -0.67 . . . . 0.0 109.422 178.974 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 48' ' ' VAL . . . . . 0.976 HG22 HD12 ' A' ' 34' ' ' ILE . 60.3 t -82.0 127.9 39.2 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.959 0 C-N-CA 120.103 -0.639 . . . . 0.0 109.404 179.41 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 49' ' ' THR . . . . . 0.528 HG21 ' CE1' ' A' ' 28' ' ' PHE . 37.5 p -57.86 -24.83 59.35 Favored 'General case' 0 N--CA 1.505 2.3 0 O-C-N 121.734 -0.604 . . . . 0.0 112.281 -165.869 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 16.6 pttp -56.14 -22.47 28.74 Favored 'General case' 0 N--CA 1.506 2.337 0 O-C-N 121.515 -0.741 . . . . 0.0 111.238 -176.016 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 10.3 p30 -82.01 -1.06 47.0 Favored 'General case' 0 N--CA 1.5 2.046 0 C-N-CA 119.889 -0.724 . . . . 0.0 111.194 176.398 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 89.6 mt -77.37 130.24 36.48 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.082 0 O-C-N 121.223 -0.923 . . . . 0.0 110.129 177.812 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 40.4 tttp -91.53 -31.73 15.83 Favored 'General case' 0 N--CA 1.494 1.766 0 O-C-N 121.772 -0.58 . . . . 0.0 109.496 168.778 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 5.3 m-20 -164.27 159.64 20.19 Favored 'General case' 0 N--CA 1.5 2.052 0 O-C-N 121.832 -0.542 . . . . 0.0 110.063 -177.869 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 55' ' ' LEU . . . . . 0.592 ' CD2' HG22 ' A' ' 13' ' ' VAL . 83.1 mt -132.99 150.21 52.18 Favored 'General case' 0 N--CA 1.495 1.802 0 O-C-N 121.752 -0.592 . . . . 0.0 110.395 -179.44 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 19.9 ptp180 -150.39 141.39 22.96 Favored 'General case' 0 N--CA 1.495 1.803 0 O-C-N 121.7 -0.625 . . . . 0.0 109.998 175.336 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 57' ' ' ILE . . . . . 0.507 ' HA ' HG12 ' A' ' 11' ' ' VAL . 67.0 mt -85.15 133.21 29.89 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.822 0 O-C-N 121.541 -0.724 . . . . 0.0 109.884 173.702 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 58' ' ' LEU . . . . . 0.463 HD11 ' HB2' ' A' ' 12' ' ' GLU . 25.2 mt . . . . . 0 N--CA 1.497 1.901 0 O-C-N 121.652 -0.655 . . . . 0.0 110.095 -179.337 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 257' ' ' SER . . . . . . . . . . . . . 44.9 t . . . . . 0 N--CA 1.502 2.16 0 CA-C-O 121.264 0.554 . . . . 0.0 110.563 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' B' B ' 258' ' ' SER . . . . . . . . . . . . . 83.9 p -69.54 -30.76 68.66 Favored 'General case' 0 N--CA 1.498 1.945 0 C-N-CA 120.359 -0.536 . . . . 0.0 110.295 -178.724 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 259' ' ' GLN . . . . . . . . . . . . . 46.4 tt0 -63.25 -37.81 88.7 Favored 'General case' 0 N--CA 1.501 2.091 0 O-C-N 121.614 -0.679 . . . . 0.0 110.378 179.373 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 260' ' ' LEU . . . . . 0.504 ' HA ' HD12 ' B' ' 263' ' ' LEU . 83.3 mt -66.09 -42.45 89.28 Favored 'General case' 0 N--CA 1.5 2.041 0 O-C-N 121.67 -0.644 . . . . 0.0 110.249 179.627 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 261' ' ' LEU . . . . . 0.436 HD12 HD12 ' A' ' 55' ' ' LEU . 22.5 tp -70.32 -38.14 74.84 Favored 'General case' 0 N--CA 1.497 1.921 0 O-C-N 121.679 -0.638 . . . . 0.0 109.772 176.292 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 262' ' ' SER . . . . . . . . . . . . . 69.7 m -62.51 -35.87 80.75 Favored 'General case' 0 N--CA 1.501 2.097 0 O-C-N 121.767 -0.583 . . . . 0.0 110.533 176.916 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 263' ' ' LEU . . . . . 0.504 HD12 ' HA ' ' B' ' 260' ' ' LEU . 21.4 mt . . . . . 0 N--CA 1.501 2.116 0 O-C-N 121.602 -0.686 . . . . 0.0 110.235 -179.822 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 68.4 m . . . . . 0 N--CA 1.495 1.782 0 CA-C-O 121.049 0.452 . . . . 0.0 110.256 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 3' ' ' VAL . . . . . 0.437 HG12 ' CE1' ' A' ' 7' ' ' TYR . 67.3 t -66.45 -27.78 41.4 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.085 0 O-C-N 121.676 -0.64 . . . . 0.0 110.379 -178.98 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -54.91 -30.67 58.9 Favored 'General case' 0 N--CA 1.505 2.296 0 O-C-N 121.451 -0.781 . . . . 0.0 110.538 -177.906 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 74.5 m-20 -69.01 -30.55 68.95 Favored 'General case' 0 N--CA 1.499 1.982 0 O-C-N 121.827 -0.546 . . . . 0.0 110.321 175.018 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 97.2 m-85 -95.49 10.12 37.64 Favored 'General case' 0 N--CA 1.497 1.898 0 O-C-N 121.628 -0.67 . . . . 0.0 111.512 -178.208 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 7' ' ' TYR . . . . . 0.437 ' CE1' HG12 ' A' ' 3' ' ' VAL . 3.8 m-30 -67.18 140.25 57.46 Favored 'General case' 0 N--CA 1.502 2.156 0 O-C-N 121.158 -0.964 . . . . 0.0 110.134 174.735 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 83.15 -2.04 87.66 Favored Glycine 0 N--CA 1.498 2.79 0 N-CA-C 110.67 -0.972 . . . . 0.0 110.67 -176.118 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 67.1 m -75.31 140.95 43.43 Favored 'General case' 0 N--CA 1.497 1.902 0 O-C-N 121.11 -1.229 . . . . 0.0 110.554 -179.536 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 10' ' ' ASN . . . . . 0.695 ' OD1' HG22 ' A' ' 24' ' ' VAL . 4.3 m-80 -85.63 117.82 24.76 Favored 'General case' 0 N--CA 1.497 1.893 0 N-CA-C 109.492 -0.558 . . . . 0.0 109.492 173.525 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 11' ' ' VAL . . . . . 0.48 HG12 ' HA ' ' A' ' 57' ' ' ILE . 35.3 m -142.55 162.32 18.52 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.889 0 O-C-N 121.675 -0.641 . . . . 0.0 109.746 179.591 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 12' ' ' GLU . . . . . 0.617 ' HB2' HD11 ' A' ' 58' ' ' LEU . 45.3 tt0 -109.41 129.98 55.52 Favored 'General case' 0 N--CA 1.492 1.65 0 C-N-CA 119.851 -0.74 . . . . 0.0 109.887 176.069 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 13' ' ' VAL . . . . . 0.566 HG22 ' CD2' ' A' ' 55' ' ' LEU . 60.3 t -106.74 125.58 62.67 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.714 0 O-C-N 121.725 -0.61 . . . . 0.0 109.831 179.731 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 14' ' ' LEU . . . . . 0.473 HD13 ' HG2' ' A' ' 20' ' ' LYS . 28.6 tp -95.82 126.28 40.97 Favored 'General case' 0 N--CA 1.493 1.707 0 N-CA-C 109.128 -0.693 . . . . 0.0 109.128 175.225 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 87.1 mt -95.85 168.05 10.88 Favored 'General case' 0 N--CA 1.496 1.839 0 O-C-N 121.689 -0.632 . . . . 0.0 111.087 -172.989 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 24.3 p30 -58.15 -21.86 48.77 Favored 'General case' 0 N--CA 1.507 2.39 0 O-C-N 121.835 -0.54 . . . . 0.0 111.583 -176.896 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 44.0 p-10 -92.2 22.79 4.19 Favored 'General case' 0 N--CA 1.498 1.973 0 O-C-N 121.561 -0.712 . . . . 0.0 110.968 -176.636 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 74.3 m-20 58.75 27.52 16.08 Favored 'General case' 0 N--CA 1.505 2.298 0 O-C-N 121.364 -0.835 . . . . 0.0 110.662 175.77 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 51.1 m -106.86 142.01 37.17 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.473 -0.767 . . . . 0.0 109.568 172.645 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 20' ' ' LYS . . . . . 0.473 ' HG2' HD13 ' A' ' 14' ' ' LEU . 94.6 mttt -109.62 146.42 34.78 Favored 'General case' 0 N--CA 1.496 1.83 0 O-C-N 121.611 -0.681 . . . . 0.0 110.646 -176.183 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -153.11 151.16 29.86 Favored 'General case' 0 N--CA 1.497 1.877 0 O-C-N 121.825 -0.547 . . . . 0.0 109.991 175.277 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 22' ' ' ARG . . . . . 0.489 ' O ' HD13 ' A' ' 39' ' ' LEU . 31.0 ptt180 -140.02 146.17 38.69 Favored 'General case' 0 N--CA 1.499 2.001 0 O-C-N 121.568 -0.707 . . . . 0.0 110.654 -179.853 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -171.77 171.49 44.13 Favored Glycine 0 N--CA 1.495 2.609 0 N-CA-C 108.768 -1.733 . . . . 0.0 108.768 -174.378 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 24' ' ' VAL . . . . . 0.695 HG22 ' OD1' ' A' ' 10' ' ' ASN . 25.2 t -94.55 120.1 43.48 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.907 0 O-C-N 121.49 -1.006 . . . . 0.0 109.34 -176.119 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 25' ' ' ILE . . . . . 0.458 HD11 HG21 ' A' ' 11' ' ' VAL . 87.2 mt -63.45 143.33 15.72 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.24 0 O-C-N 121.479 -0.763 . . . . 0.0 110.462 -172.729 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 26' ' ' THR . . . . . 0.624 HG21 ' HB2' ' A' ' 38' ' ' ARG . 6.7 p -121.15 -28.73 4.67 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.671 -0.643 . . . . 0.0 111.329 179.079 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 26.9 t30 -161.97 158.78 25.67 Favored 'General case' 0 N--CA 1.499 2.004 0 O-C-N 120.985 -1.072 . . . . 0.0 111.661 -177.095 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 28' ' ' PHE . . . . . 0.519 ' HE1' HG21 ' A' ' 49' ' ' THR . 84.3 t80 -150.08 126.86 11.03 Favored 'General case' 0 N--CA 1.497 1.882 0 N-CA-C 109.132 -0.692 . . . . 0.0 109.132 170.78 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 21.3 t70 -100.53 130.92 46.67 Favored 'General case' 0 N--CA 1.491 1.581 0 N-CA-C 109.04 -0.726 . . . . 0.0 109.04 -176.772 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 20.9 m -69.29 -49.99 50.87 Favored 'General case' 0 N--CA 1.498 1.946 0 C-N-CA 120.062 -0.655 . . . . 0.0 110.504 -176.679 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 22.6 m -59.76 -42.72 93.88 Favored 'General case' 0 N--CA 1.502 2.135 0 O-C-N 121.648 -0.658 . . . . 0.0 110.84 -174.478 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 29.6 m120 -103.71 -10.1 18.61 Favored 'General case' 0 N--CA 1.496 1.873 0 O-C-N 121.667 -0.646 . . . . 0.0 111.553 -178.069 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 1.8 m 49.88 67.38 0.91 Allowed 'General case' 0 N--CA 1.507 2.424 0 O-C-N 121.103 -0.998 . . . . 0.0 110.87 -174.795 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 34' ' ' ILE . . . . . 1.106 HD12 HG22 ' A' ' 48' ' ' VAL . 47.4 mm -125.43 126.86 71.25 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.006 0 O-C-N 121.557 -0.715 . . . . 0.0 109.469 -176.061 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.422 HD12 ' HB2' ' A' ' 28' ' ' PHE . 6.7 tp -115.85 120.03 37.93 Favored 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.678 -0.639 . . . . 0.0 110.335 -169.237 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 99.5 mt-30 -90.98 134.68 34.29 Favored 'General case' 0 N--CA 1.492 1.63 0 C-N-CA 120.268 -0.573 . . . . 0.0 109.477 175.386 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 37' ' ' LEU . . . . . 0.442 HD23 ' HA ' ' A' ' 25' ' ' ILE . 17.2 mt -117.82 123.87 46.98 Favored 'General case' 0 N--CA 1.495 1.781 0 O-C-N 121.854 -0.529 . . . . 0.0 110.023 174.818 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 38' ' ' ARG . . . . . 0.624 ' HB2' HG21 ' A' ' 26' ' ' THR . 74.9 ttt-85 -97.26 108.5 21.25 Favored 'General case' 0 N--CA 1.497 1.88 0 O-C-N 121.756 -0.59 . . . . 0.0 109.778 175.215 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 39' ' ' LEU . . . . . 0.489 HD13 ' O ' ' A' ' 22' ' ' ARG . 17.8 tp -85.28 151.67 23.88 Favored 'General case' 0 N--CA 1.495 1.797 0 O-C-N 121.703 -0.623 . . . . 0.0 110.981 -174.206 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -62.99 -9.25 9.31 Favored 'General case' 0 N--CA 1.503 2.193 0 O-C-N 121.965 -0.459 . . . . 0.0 111.895 -172.668 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 30.1 m120 -85.38 29.05 0.69 Allowed 'General case' 0 N--CA 1.499 1.981 0 O-C-N 121.086 -1.009 . . . . 0.0 110.95 174.33 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 74.4 m-20 59.33 31.15 20.92 Favored 'General case' 0 N--CA 1.505 2.302 0 O-C-N 121.136 -0.978 . . . . 0.0 110.366 174.378 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 48.7 m -122.81 137.93 54.79 Favored 'General case' 0 N--CA 1.495 1.795 0 O-C-N 121.42 -0.8 . . . . 0.0 110.395 179.121 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 9.0 t -97.19 149.41 22.04 Favored 'General case' 0 N--CA 1.498 1.949 0 O-C-N 121.814 -0.554 . . . . 0.0 110.233 176.77 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 74.7 tttt -149.89 119.2 6.83 Favored 'General case' 0 N--CA 1.494 1.755 0 O-C-N 121.602 -0.687 . . . . 0.0 110.255 178.515 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 88.7 p -95.0 123.97 38.78 Favored 'General case' 0 N--CA 1.496 1.828 0 O-C-N 121.694 -0.629 . . . . 0.0 110.175 179.214 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 82.4 mt -129.32 134.47 63.71 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.9 0 N-CA-C 109.246 -0.649 . . . . 0.0 109.246 -179.967 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 48' ' ' VAL . . . . . 1.106 HG22 HD12 ' A' ' 34' ' ' ILE . 63.1 t -82.11 127.59 39.49 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.891 0 O-C-N 121.574 -0.704 . . . . 0.0 109.268 179.668 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 49' ' ' THR . . . . . 0.519 HG21 ' HE1' ' A' ' 28' ' ' PHE . 38.6 p -59.97 -24.93 64.82 Favored 'General case' 0 N--CA 1.503 2.216 0 O-C-N 121.592 -0.692 . . . . 0.0 112.065 -171.141 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 80.8 mttt -56.82 -25.29 55.65 Favored 'General case' 0 N--CA 1.502 2.174 0 O-C-N 121.445 -0.784 . . . . 0.0 111.03 -176.405 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 6.3 p30 -84.62 5.2 28.91 Favored 'General case' 0 N--CA 1.498 1.947 0 C-N-CA 119.726 -0.79 . . . . 0.0 111.441 176.318 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 98.6 mt -75.56 127.94 37.12 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.146 0 O-C-N 121.136 -0.977 . . . . 0.0 109.92 175.972 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 40.0 tttp -91.92 -32.76 15.15 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.782 -0.573 . . . . 0.0 109.528 168.942 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -161.46 156.82 24.12 Favored 'General case' 0 N--CA 1.499 1.977 0 O-C-N 121.76 -0.587 . . . . 0.0 109.958 -176.936 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 55' ' ' LEU . . . . . 0.566 ' CD2' HG22 ' A' ' 13' ' ' VAL . 86.2 mt -133.05 150.09 52.14 Favored 'General case' 0 N--CA 1.497 1.922 0 O-C-N 121.639 -0.663 . . . . 0.0 110.517 -179.425 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 20.1 ptp180 -151.86 142.85 23.09 Favored 'General case' 0 N--CA 1.495 1.81 0 O-C-N 121.741 -0.599 . . . . 0.0 110.065 175.518 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 57' ' ' ILE . . . . . 0.48 ' HA ' HG12 ' A' ' 11' ' ' VAL . 66.5 mt -86.49 133.19 30.41 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.912 0 O-C-N 121.558 -0.714 . . . . 0.0 109.835 173.428 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 58' ' ' LEU . . . . . 0.617 HD11 ' HB2' ' A' ' 12' ' ' GLU . 50.8 mt . . . . . 0 N--CA 1.497 1.924 0 O-C-N 121.583 -0.698 . . . . 0.0 110.091 179.41 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 257' ' ' SER . . . . . . . . . . . . . 43.2 t . . . . . 0 N--CA 1.503 2.195 0 CA-C-O 121.258 0.552 . . . . 0.0 110.499 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' B' B ' 258' ' ' SER . . . . . . . . . . . . . 25.2 m -68.89 -30.87 69.45 Favored 'General case' 0 N--CA 1.498 1.968 0 C-N-CA 120.436 -0.506 . . . . 0.0 110.389 -179.769 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 259' ' ' GLN . . . . . . . . . . . . . 48.9 tt0 -63.56 -39.98 95.81 Favored 'General case' 0 N--CA 1.501 2.108 0 O-C-N 121.589 -0.694 . . . . 0.0 110.43 -179.903 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 260' ' ' LEU . . . . . 0.513 ' HA ' HD12 ' B' ' 263' ' ' LEU . 83.7 mt -67.37 -43.53 81.18 Favored 'General case' 0 N--CA 1.5 2.055 0 O-C-N 121.609 -0.682 . . . . 0.0 110.247 -179.661 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 261' ' ' LEU . . . . . . . . . . . . . 17.1 tp -70.38 -36.77 74.33 Favored 'General case' 0 N--CA 1.498 1.962 0 O-C-N 121.634 -0.666 . . . . 0.0 109.629 177.078 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 262' ' ' SER . . . . . . . . . . . . . 22.8 t -62.79 -35.84 81.2 Favored 'General case' 0 N--CA 1.501 2.076 0 O-C-N 121.776 -0.578 . . . . 0.0 110.565 176.671 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 263' ' ' LEU . . . . . 0.513 HD12 ' HA ' ' B' ' 260' ' ' LEU . 19.9 mt . . . . . 0 N--CA 1.501 2.078 0 O-C-N 121.598 -0.689 . . . . 0.0 110.247 -179.331 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 65.5 m . . . . . 0 N--CA 1.494 1.77 0 CA-C-O 120.956 0.408 . . . . 0.0 109.976 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 3' ' ' VAL . . . . . 0.466 HG12 ' CE1' ' A' ' 7' ' ' TYR . 69.3 t -66.81 -27.82 41.09 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.082 0 O-C-N 121.596 -0.69 . . . . 0.0 110.097 179.823 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -55.21 -30.62 60.33 Favored 'General case' 0 N--CA 1.504 2.25 0 O-C-N 121.401 -0.812 . . . . 0.0 110.313 179.711 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -68.17 -31.48 71.06 Favored 'General case' 0 N--CA 1.498 1.948 0 O-C-N 121.847 -0.533 . . . . 0.0 110.151 174.533 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 88.2 m-85 -95.73 9.53 40.08 Favored 'General case' 0 N--CA 1.497 1.888 0 O-C-N 121.711 -0.618 . . . . 0.0 111.342 179.869 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 7' ' ' TYR . . . . . 0.466 ' CE1' HG12 ' A' ' 3' ' ' VAL . 3.5 m-30 -67.3 142.15 56.94 Favored 'General case' 0 N--CA 1.501 2.123 0 O-C-N 121.181 -0.949 . . . . 0.0 110.113 174.324 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 8' ' ' GLY . . . . . 0.425 ' O ' HG13 ' A' ' 24' ' ' VAL . . . 82.45 -0.2 89.32 Favored Glycine 0 N--CA 1.498 2.769 0 N-CA-C 110.648 -0.981 . . . . 0.0 110.648 -176.746 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 9' ' ' SER . . . . . 0.554 ' OG ' HD12 ' A' ' 25' ' ' ILE . 84.5 p -77.4 137.37 38.68 Favored 'General case' 0 N--CA 1.497 1.909 0 O-C-N 121.081 -1.247 . . . . 0.0 110.478 179.32 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 12.1 t-20 -84.05 119.09 24.54 Favored 'General case' 0 N--CA 1.497 1.923 0 O-C-N 121.644 -0.66 . . . . 0.0 109.45 172.944 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 11' ' ' VAL . . . . . 0.576 HG12 ' HA ' ' A' ' 57' ' ' ILE . 35.6 m -142.64 164.0 17.39 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.63 0 O-C-N 121.829 -0.545 . . . . 0.0 109.541 -179.166 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 12' ' ' GLU . . . . . 0.434 ' HB2' HD11 ' A' ' 58' ' ' LEU . 35.6 tt0 -109.32 129.13 55.53 Favored 'General case' 0 N--CA 1.493 1.687 0 C-N-CA 119.929 -0.708 . . . . 0.0 109.916 177.183 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 13' ' ' VAL . . . . . 0.46 HG22 HD23 ' A' ' 55' ' ' LEU . 61.4 t -106.69 127.92 61.78 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.713 0 O-C-N 121.581 -0.7 . . . . 0.0 109.818 179.763 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 29.9 tp -95.94 128.33 42.74 Favored 'General case' 0 N--CA 1.493 1.718 0 N-CA-C 109.26 -0.644 . . . . 0.0 109.26 176.511 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 86.1 mt -95.02 160.94 14.34 Favored 'General case' 0 N--CA 1.495 1.813 0 O-C-N 121.615 -0.678 . . . . 0.0 111.015 -173.687 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 24.3 p30 -58.05 -21.87 47.56 Favored 'General case' 0 N--CA 1.506 2.343 0 O-C-N 121.819 -0.55 . . . . 0.0 111.571 -178.166 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 38.3 p-10 -93.28 24.02 4.1 Favored 'General case' 0 N--CA 1.497 1.923 0 O-C-N 121.507 -0.745 . . . . 0.0 110.782 -177.378 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 74.2 m-20 59.24 27.88 17.04 Favored 'General case' 0 N--CA 1.505 2.311 0 O-C-N 121.437 -0.789 . . . . 0.0 110.661 175.812 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 50.8 m -103.65 142.3 34.55 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.551 -0.718 . . . . 0.0 109.517 172.182 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 96.5 mttt -109.6 142.75 40.28 Favored 'General case' 0 N--CA 1.494 1.77 0 O-C-N 121.633 -0.667 . . . . 0.0 110.581 -175.806 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -153.07 152.82 31.77 Favored 'General case' 0 N--CA 1.497 1.897 0 O-C-N 121.725 -0.609 . . . . 0.0 110.304 176.376 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 22' ' ' ARG . . . . . 0.508 ' O ' HD13 ' A' ' 39' ' ' LEU . 32.9 ptt180 -144.08 149.13 36.11 Favored 'General case' 0 N--CA 1.498 1.951 0 O-C-N 121.691 -0.631 . . . . 0.0 110.519 177.574 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -171.77 171.46 44.11 Favored Glycine 0 N--CA 1.496 2.656 0 N-CA-C 108.954 -1.658 . . . . 0.0 108.954 -176.365 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 24' ' ' VAL . . . . . 0.425 HG13 ' O ' ' A' ' 8' ' ' GLY . 46.7 t -94.62 119.32 42.44 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.909 0 O-C-N 121.444 -1.033 . . . . 0.0 109.298 -177.27 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 25' ' ' ILE . . . . . 0.644 ' HA ' HD23 ' A' ' 37' ' ' LEU . 95.8 mt -64.39 143.59 15.56 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.179 0 O-C-N 121.69 -0.631 . . . . 0.0 110.601 -171.312 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 26' ' ' THR . . . . . 0.603 HG21 ' HB2' ' A' ' 38' ' ' ARG . 7.9 p -121.17 -26.91 5.0 Favored 'General case' 0 N--CA 1.494 1.758 0 O-C-N 121.779 -0.575 . . . . 0.0 111.258 178.988 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 27' ' ' ASN . . . . . 0.478 ' O ' HD12 ' A' ' 35' ' ' LEU . 6.4 t30 -161.9 159.25 26.5 Favored 'General case' 0 N--CA 1.499 2.02 0 C-N-CA 118.969 -1.092 . . . . 0.0 111.671 -179.08 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 28' ' ' PHE . . . . . 0.523 ' HE1' HG21 ' A' ' 49' ' ' THR . 75.6 t80 -150.13 125.93 10.42 Favored 'General case' 0 N--CA 1.497 1.876 0 N-CA-C 109.089 -0.708 . . . . 0.0 109.089 170.478 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 17.9 t70 -99.64 130.61 45.88 Favored 'General case' 0 N--CA 1.491 1.605 0 N-CA-C 108.981 -0.748 . . . . 0.0 108.981 -177.395 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 34.7 m -69.64 -50.94 39.46 Favored 'General case' 0 N--CA 1.498 1.944 0 C-N-CA 120.01 -0.676 . . . . 0.0 110.534 -176.349 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 5.4 t -59.58 -42.74 93.21 Favored 'General case' 0 N--CA 1.502 2.138 0 O-C-N 121.477 -0.764 . . . . 0.0 110.791 -174.818 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 28.6 m120 -103.27 -10.06 19.03 Favored 'General case' 0 N--CA 1.497 1.893 0 O-C-N 121.573 -0.705 . . . . 0.0 111.446 -177.416 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 1.8 m 49.72 67.29 0.92 Allowed 'General case' 0 N--CA 1.507 2.407 0 O-C-N 121.054 -1.029 . . . . 0.0 111.08 -175.202 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 34' ' ' ILE . . . . . 1.13 HD12 HG22 ' A' ' 48' ' ' VAL . 47.6 mm -124.91 126.19 70.9 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.092 0 O-C-N 121.595 -0.691 . . . . 0.0 109.438 -175.899 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.478 HD12 ' O ' ' A' ' 27' ' ' ASN . 11.5 tp -115.86 121.07 41.28 Favored 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.596 -0.69 . . . . 0.0 110.622 -169.897 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 58.1 mt-30 -91.78 133.83 35.28 Favored 'General case' 0 N--CA 1.491 1.618 0 N-CA-C 109.435 -0.58 . . . . 0.0 109.435 173.49 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 37' ' ' LEU . . . . . 0.644 HD23 ' HA ' ' A' ' 25' ' ' ILE . 90.5 mt -117.96 123.8 46.66 Favored 'General case' 0 N--CA 1.497 1.884 0 O-C-N 121.801 -0.562 . . . . 0.0 109.921 174.963 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 38' ' ' ARG . . . . . 0.603 ' HB2' HG21 ' A' ' 26' ' ' THR . 64.9 ttt180 -96.07 105.06 17.05 Favored 'General case' 0 N--CA 1.497 1.877 0 O-C-N 121.682 -0.636 . . . . 0.0 109.777 175.99 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 39' ' ' LEU . . . . . 0.508 HD13 ' O ' ' A' ' 22' ' ' ARG . 20.1 tp -85.0 155.31 21.62 Favored 'General case' 0 N--CA 1.495 1.791 0 O-C-N 121.701 -0.624 . . . . 0.0 110.951 -173.692 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -68.63 -2.99 10.31 Favored 'General case' 0 N--CA 1.503 2.178 0 O-C-N 121.943 -0.473 . . . . 0.0 112.203 -169.494 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 43.3 p-10 -86.91 25.78 1.25 Allowed 'General case' 0 N--CA 1.499 1.994 0 O-C-N 121.004 -1.06 . . . . 0.0 110.853 173.637 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 7.8 t70 61.74 28.07 17.25 Favored 'General case' 0 N--CA 1.504 2.267 0 O-C-N 121.115 -0.991 . . . . 0.0 110.484 178.717 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 36.7 m -120.54 137.93 54.13 Favored 'General case' 0 N--CA 1.496 1.87 0 O-C-N 121.396 -0.815 . . . . 0.0 110.431 -179.893 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 8.7 t -97.86 151.01 20.67 Favored 'General case' 0 N--CA 1.496 1.864 0 O-C-N 121.719 -0.613 . . . . 0.0 110.172 175.98 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 70.3 tttt -149.44 119.13 7.0 Favored 'General case' 0 N--CA 1.496 1.847 0 O-C-N 121.612 -0.68 . . . . 0.0 110.27 178.762 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 88.4 p -95.71 122.8 38.88 Favored 'General case' 0 N--CA 1.495 1.801 0 O-C-N 121.713 -0.617 . . . . 0.0 110.208 179.057 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 81.7 mt -129.39 136.48 59.27 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.813 0 O-C-N 121.584 -0.697 . . . . 0.0 109.385 179.64 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 48' ' ' VAL . . . . . 1.13 HG22 HD12 ' A' ' 34' ' ' ILE . 57.8 t -81.8 127.53 39.52 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.896 0 N-CA-C 109.1 -0.704 . . . . 0.0 109.1 178.276 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 49' ' ' THR . . . . . 0.523 HG21 ' HE1' ' A' ' 28' ' ' PHE . 42.2 p -59.49 -25.74 64.7 Favored 'General case' 0 N--CA 1.504 2.229 0 O-C-N 121.558 -0.714 . . . . 0.0 112.071 -169.029 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 19.2 tptm -57.93 -23.39 53.3 Favored 'General case' 0 N--CA 1.502 2.154 0 O-C-N 121.512 -0.742 . . . . 0.0 111.346 -174.95 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 9.8 p30 -80.95 -4.32 54.61 Favored 'General case' 0 N--CA 1.499 2.02 0 C-N-CA 119.734 -0.786 . . . . 0.0 110.993 176.135 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 52' ' ' ILE . . . . . 0.794 HG21 HD11 ' A' ' 55' ' ' LEU . 85.5 mt -80.57 135.58 24.98 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.056 0 O-C-N 121.209 -0.932 . . . . 0.0 110.127 178.329 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 62.0 tttt -91.32 -30.66 16.45 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.84 -0.537 . . . . 0.0 109.62 169.567 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 54' ' ' ASP . . . . . 0.404 ' HA ' HD13 ' B' ' 261' ' ' LEU . 1.7 m-20 -165.31 159.97 17.78 Favored 'General case' 0 N--CA 1.502 2.156 0 O-C-N 121.833 -0.542 . . . . 0.0 110.505 -176.53 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 55' ' ' LEU . . . . . 0.794 HD11 HG21 ' A' ' 52' ' ' ILE . 4.4 mp -132.96 157.37 45.34 Favored 'General case' 0 N--CA 1.496 1.845 0 O-C-N 121.726 -0.609 . . . . 0.0 110.227 177.179 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 7.9 ptm180 -150.61 146.58 26.61 Favored 'General case' 0 N--CA 1.495 1.813 0 O-C-N 121.634 -0.666 . . . . 0.0 109.672 174.538 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 57' ' ' ILE . . . . . 0.576 ' HA ' HG12 ' A' ' 11' ' ' VAL . 55.9 mt -86.04 133.31 29.96 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.876 0 O-C-N 121.508 -0.745 . . . . 0.0 109.952 175.49 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 58' ' ' LEU . . . . . 0.434 HD11 ' HB2' ' A' ' 12' ' ' GLU . 79.2 mt . . . . . 0 N--CA 1.498 1.942 0 O-C-N 121.589 -0.695 . . . . 0.0 110.076 -178.932 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 257' ' ' SER . . . . . . . . . . . . . 24.2 m . . . . . 0 N--CA 1.503 2.204 0 CA-C-O 121.181 0.515 . . . . 0.0 110.521 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' B' B ' 258' ' ' SER . . . . . . . . . . . . . 22.7 t -69.46 -38.25 77.66 Favored 'General case' 0 N--CA 1.498 1.925 0 C-N-CA 120.481 -0.487 . . . . 0.0 110.317 -179.04 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 259' ' ' GLN . . . . . . . . . . . . . 88.7 mm-40 -64.73 -35.44 81.07 Favored 'General case' 0 N--CA 1.501 2.087 0 O-C-N 121.6 -0.687 . . . . 0.0 110.407 -179.748 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 260' ' ' LEU . . . . . . . . . . . . . 83.6 mt -67.56 -38.62 84.38 Favored 'General case' 0 N--CA 1.498 1.971 0 O-C-N 121.639 -0.663 . . . . 0.0 110.27 179.269 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 261' ' ' LEU . . . . . 0.61 HD13 HD12 ' A' ' 55' ' ' LEU . 47.9 tp -67.99 -39.89 83.19 Favored 'General case' 0 N--CA 1.498 1.957 0 O-C-N 121.57 -0.706 . . . . 0.0 109.994 178.668 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 262' ' ' SER . . . . . . . . . . . . . 21.0 m -63.18 -40.65 98.14 Favored 'General case' 0 N--CA 1.5 2.072 0 O-C-N 121.695 -0.628 . . . . 0.0 110.488 177.323 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 263' ' ' LEU . . . . . . . . . . . . . 51.5 mt . . . . . 0 N--CA 1.501 2.083 0 O-C-N 121.715 -0.615 . . . . 0.0 110.23 179.327 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 70.5 m . . . . . 0 N--CA 1.494 1.768 0 CA-C-O 120.945 0.402 . . . . 0.0 110.067 . . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 3' ' ' VAL . . . . . 0.43 HG11 ' CB ' ' A' ' 28' ' ' PHE . 51.0 t -64.7 -28.33 44.56 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.207 0 O-C-N 121.625 -0.672 . . . . 0.0 110.245 -179.283 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -56.09 -32.55 64.26 Favored 'General case' 0 N--CA 1.503 2.215 0 O-C-N 121.479 -0.763 . . . . 0.0 110.35 179.609 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 9.7 m-20 -68.8 -35.63 77.25 Favored 'General case' 0 N--CA 1.498 1.958 0 O-C-N 121.862 -0.524 . . . . 0.0 109.932 175.725 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 6' ' ' PHE . . . . . 0.402 ' CD1' HD21 ' B' ' 260' ' ' LEU . 97.0 m-85 -97.94 10.08 41.17 Favored 'General case' 0 N--CA 1.497 1.891 0 O-C-N 121.723 -0.611 . . . . 0.0 111.24 178.904 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -67.51 128.2 35.56 Favored 'General case' 0 N--CA 1.5 2.047 0 O-C-N 121.294 -0.879 . . . . 0.0 109.927 179.134 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 8' ' ' GLY . . . . . 0.466 ' O ' HG13 ' A' ' 24' ' ' VAL . . . 82.27 -0.33 88.99 Favored Glycine 0 N--CA 1.496 2.694 0 N-CA-C 110.616 -0.994 . . . . 0.0 110.616 -174.976 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 32.0 t -77.17 137.69 39.03 Favored 'General case' 0 N--CA 1.498 1.93 0 O-C-N 121.144 -1.21 . . . . 0.0 110.432 177.599 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 14.6 t-20 -83.96 119.23 24.65 Favored 'General case' 0 N--CA 1.498 1.953 0 O-C-N 121.671 -0.643 . . . . 0.0 109.782 174.642 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 11' ' ' VAL . . . . . 0.521 HG12 ' HA ' ' A' ' 57' ' ' ILE . 34.6 m -143.01 161.83 17.54 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.811 0 N-CA-C 109.567 -0.531 . . . . 0.0 109.567 -179.854 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 12' ' ' GLU . . . . . 0.451 ' HB2' HD11 ' A' ' 58' ' ' LEU . 35.4 tt0 -109.41 129.59 55.54 Favored 'General case' 0 N--CA 1.493 1.685 0 C-N-CA 119.87 -0.732 . . . . 0.0 110.126 178.448 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 13' ' ' VAL . . . . . 0.562 HG22 ' CD2' ' A' ' 55' ' ' LEU . 58.9 t -106.74 127.65 62.08 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.772 0 O-C-N 121.68 -0.638 . . . . 0.0 109.827 -179.402 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 28.5 tp -95.86 126.05 40.85 Favored 'General case' 0 N--CA 1.494 1.746 0 N-CA-C 109.077 -0.712 . . . . 0.0 109.077 174.485 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 86.7 mt -96.01 166.93 11.53 Favored 'General case' 0 N--CA 1.495 1.794 0 C-N-CA 120.087 -0.645 . . . . 0.0 111.166 -172.496 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 24.1 p30 -58.4 -21.82 51.82 Favored 'General case' 0 N--CA 1.505 2.323 0 O-C-N 121.82 -0.55 . . . . 0.0 111.668 -177.029 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 42.5 p-10 -92.73 23.45 4.11 Favored 'General case' 0 N--CA 1.498 1.966 0 O-C-N 121.576 -0.703 . . . . 0.0 110.811 -176.041 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 74.4 m-20 58.85 27.29 15.93 Favored 'General case' 0 N--CA 1.507 2.379 0 O-C-N 121.558 -0.714 . . . . 0.0 110.608 175.805 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 50.5 m -106.96 145.44 32.25 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.526 -0.734 . . . . 0.0 109.575 172.831 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 98.1 mttt -109.61 147.72 32.55 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.59 -0.694 . . . . 0.0 110.571 -176.345 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -153.08 153.97 33.91 Favored 'General case' 0 N--CA 1.497 1.911 0 O-C-N 121.796 -0.565 . . . . 0.0 110.254 176.204 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 33.0 ptt180 -142.69 150.35 40.04 Favored 'General case' 0 N--CA 1.496 1.842 0 O-C-N 121.648 -0.658 . . . . 0.0 110.308 178.364 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 23' ' ' GLY . . . . . 0.425 ' HA2' HD13 ' A' ' 39' ' ' LEU . . . -171.9 171.17 43.98 Favored Glycine 0 N--CA 1.492 2.429 0 N-CA-C 109.167 -1.573 . . . . 0.0 109.167 -179.871 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 24' ' ' VAL . . . . . 0.466 HG13 ' O ' ' A' ' 8' ' ' GLY . 45.2 t -94.61 126.65 46.99 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.88 0 O-C-N 121.7 -0.882 . . . . 0.0 109.237 176.363 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 25' ' ' ILE . . . . . 0.468 ' HA ' HD23 ' A' ' 37' ' ' LEU . 47.7 mt -61.73 138.0 22.94 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.249 0 O-C-N 121.57 -0.706 . . . . 0.0 110.854 -170.373 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 26' ' ' THR . . . . . 0.671 HG21 ' HB2' ' A' ' 38' ' ' ARG . 13.2 p -121.24 -19.65 7.0 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.9 -0.5 . . . . 0.0 111.515 -179.937 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 1.5 t-20 -165.98 158.18 14.47 Favored 'General case' 0 N--CA 1.504 2.25 0 O-C-N 120.826 -1.172 . . . . 0.0 111.922 176.221 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 28' ' ' PHE . . . . . 0.43 ' CB ' HG11 ' A' ' 3' ' ' VAL . 65.0 t80 -150.3 120.7 7.37 Favored 'General case' 0 N--CA 1.495 1.818 0 N-CA-C 109.166 -0.679 . . . . 0.0 109.166 173.431 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 17.9 t70 -97.81 127.42 43.75 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.593 -0.692 . . . . 0.0 109.212 -177.713 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 22.1 m -66.41 -46.53 76.24 Favored 'General case' 0 N--CA 1.499 2.0 0 O-C-N 121.524 -0.735 . . . . 0.0 110.772 -175.174 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 21.1 m -58.92 -47.36 85.3 Favored 'General case' 0 N--CA 1.502 2.174 0 O-C-N 121.602 -0.686 . . . . 0.0 110.957 -173.796 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 92.4 m-20 -106.29 -3.22 21.45 Favored 'General case' 0 N--CA 1.497 1.889 0 O-C-N 121.536 -0.727 . . . . 0.0 111.711 -178.188 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 15.3 m 49.14 67.15 0.92 Allowed 'General case' 0 N--CA 1.507 2.419 0 O-C-N 121.049 -1.032 . . . . 0.0 110.907 -174.314 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 34' ' ' ILE . . . . . 1.067 HD12 HG22 ' A' ' 48' ' ' VAL . 43.7 mm -114.64 125.78 72.04 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.936 0 O-C-N 121.545 -0.722 . . . . 0.0 109.21 -175.55 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 14.5 tp -115.98 119.03 34.6 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.609 -0.682 . . . . 0.0 110.47 -169.858 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 44.6 mt-30 -91.04 131.94 36.32 Favored 'General case' 0 N--CA 1.491 1.593 0 N-CA-C 109.182 -0.673 . . . . 0.0 109.182 170.838 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 37' ' ' LEU . . . . . 0.468 HD23 ' HA ' ' A' ' 25' ' ' ILE . 49.4 mt -117.73 123.49 46.17 Favored 'General case' 0 N--CA 1.493 1.707 0 C-N-CA 120.177 -0.609 . . . . 0.0 110.041 175.926 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 38' ' ' ARG . . . . . 0.671 ' HB2' HG21 ' A' ' 26' ' ' THR . 57.2 ttt85 -105.0 104.95 14.78 Favored 'General case' 0 N--CA 1.495 1.782 0 O-C-N 121.77 -0.582 . . . . 0.0 110.076 173.877 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 39' ' ' LEU . . . . . 0.425 HD13 ' HA2' ' A' ' 23' ' ' GLY . 65.3 tp -83.29 157.23 22.71 Favored 'General case' 0 N--CA 1.497 1.923 0 O-C-N 121.626 -0.671 . . . . 0.0 110.669 -176.344 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -67.89 -2.94 8.28 Favored 'General case' 0 N--CA 1.503 2.193 0 O-C-N 121.823 -0.548 . . . . 0.0 112.208 -170.819 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 29.9 m120 -86.63 29.21 0.8 Allowed 'General case' 0 N--CA 1.498 1.971 0 O-C-N 121.05 -1.031 . . . . 0.0 110.789 173.591 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 73.7 m-20 60.33 31.47 20.42 Favored 'General case' 0 N--CA 1.506 2.334 0 O-C-N 121.164 -0.96 . . . . 0.0 110.258 175.699 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 68.1 m -126.05 144.72 50.61 Favored 'General case' 0 N--CA 1.494 1.755 0 O-C-N 121.477 -0.765 . . . . 0.0 110.112 177.873 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 9.8 t -128.17 147.82 50.58 Favored 'General case' 0 N--CA 1.496 1.828 0 O-C-N 121.653 -0.654 . . . . 0.0 109.919 179.604 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 45' ' ' LYS . . . . . 0.778 ' HE2' HD11 ' A' ' 47' ' ' ILE . 6.0 ttpm? -150.38 130.04 13.15 Favored 'General case' 0 N--CA 1.495 1.82 0 O-C-N 121.716 -0.615 . . . . 0.0 110.505 -177.369 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 88.5 p -95.89 123.47 39.49 Favored 'General case' 0 N--CA 1.494 1.77 0 O-C-N 121.683 -0.635 . . . . 0.0 110.396 179.748 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 47' ' ' ILE . . . . . 0.778 HD11 ' HE2' ' A' ' 45' ' ' LYS . 80.6 mt -129.31 138.25 54.86 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.889 0 N-CA-C 109.19 -0.67 . . . . 0.0 109.19 177.647 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 48' ' ' VAL . . . . . 1.067 HG22 HD12 ' A' ' 34' ' ' ILE . 67.9 t -82.05 127.65 39.43 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.876 0 O-C-N 121.6 -0.687 . . . . 0.0 109.183 177.766 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 47.3 p -58.13 -24.92 60.59 Favored 'General case' 0 N--CA 1.505 2.283 0 O-C-N 121.539 -0.726 . . . . 0.0 111.964 -169.142 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 31.5 tttp -56.92 -26.87 60.17 Favored 'General case' 0 N--CA 1.502 2.131 0 O-C-N 121.529 -0.732 . . . . 0.0 110.963 -177.08 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 4.7 p30 -85.21 7.37 22.23 Favored 'General case' 0 N--CA 1.499 1.99 0 C-N-CA 119.677 -0.809 . . . . 0.0 111.353 176.538 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 98.2 mt -75.04 125.59 34.78 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.111 0 O-C-N 121.119 -0.988 . . . . 0.0 109.878 175.186 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 50.4 tttm -92.16 -31.34 15.52 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.812 -0.555 . . . . 0.0 109.718 170.68 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 54' ' ' ASP . . . . . 0.405 ' HA ' HD22 ' B' ' 261' ' ' LEU . 1.0 OUTLIER -161.11 153.38 20.17 Favored 'General case' 0 N--CA 1.499 1.991 0 O-C-N 121.699 -0.626 . . . . 0.0 110.072 -176.418 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 55' ' ' LEU . . . . . 0.562 ' CD2' HG22 ' A' ' 13' ' ' VAL . 85.2 mt -132.92 149.92 52.2 Favored 'General case' 0 N--CA 1.497 1.925 0 O-C-N 121.745 -0.597 . . . . 0.0 110.523 -179.311 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 4.9 ptm180 -152.27 140.86 20.79 Favored 'General case' 0 N--CA 1.496 1.869 0 O-C-N 121.783 -0.573 . . . . 0.0 109.856 175.118 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 57' ' ' ILE . . . . . 0.521 ' HA ' HG12 ' A' ' 11' ' ' VAL . 59.3 mt -85.28 133.3 29.73 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.863 0 O-C-N 121.428 -0.795 . . . . 0.0 109.856 174.667 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 58' ' ' LEU . . . . . 0.451 HD11 ' HB2' ' A' ' 12' ' ' GLU . 83.1 mt . . . . . 0 N--CA 1.498 1.942 0 O-C-N 121.631 -0.668 . . . . 0.0 110.051 -179.09 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 257' ' ' SER . . . . . . . . . . . . . 49.0 m . . . . . 0 N--CA 1.503 2.21 0 CA-C-O 121.3 0.572 . . . . 0.0 110.482 . . . . . . . . . 0 0 . 1 . 019 nuclear build core ' B' B ' 258' ' ' SER . . . . . . . . . . . . . 25.1 m -69.29 -31.79 70.52 Favored 'General case' 0 N--CA 1.497 1.892 0 O-C-N 121.864 -0.523 . . . . 0.0 110.351 -179.937 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 259' ' ' GLN . . . . . . . . . . . . . 58.2 tp60 -62.65 -40.04 95.78 Favored 'General case' 0 N--CA 1.501 2.1 0 O-C-N 121.601 -0.687 . . . . 0.0 110.494 -178.665 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 260' ' ' LEU . . . . . 0.488 ' HA ' HD12 ' B' ' 263' ' ' LEU . 82.8 mt -68.83 -43.04 76.36 Favored 'General case' 0 N--CA 1.499 1.996 0 O-C-N 121.691 -0.631 . . . . 0.0 110.293 179.958 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 261' ' ' LEU . . . . . 0.405 HD22 ' HA ' ' A' ' 54' ' ' ASP . 17.6 tp -69.24 -36.22 76.94 Favored 'General case' 0 N--CA 1.498 1.941 0 O-C-N 121.586 -0.696 . . . . 0.0 109.768 177.87 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 262' ' ' SER . . . . . . . . . . . . . 22.7 t -62.33 -37.33 85.22 Favored 'General case' 0 N--CA 1.501 2.105 0 O-C-N 121.762 -0.586 . . . . 0.0 110.424 176.864 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 263' ' ' LEU . . . . . 0.488 HD12 ' HA ' ' B' ' 260' ' ' LEU . 33.0 mt . . . . . 0 N--CA 1.5 2.068 0 O-C-N 121.726 -0.609 . . . . 0.0 110.31 179.552 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 73.1 m . . . . . 0 N--CA 1.494 1.751 0 CA-C-O 121.036 0.446 . . . . 0.0 110.285 . . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 3' ' ' VAL . . . . . 0.424 HG12 ' CE1' ' A' ' 7' ' ' TYR . 83.2 t -67.74 -27.64 38.78 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.095 0 O-C-N 121.754 -0.591 . . . . 0.0 110.251 -179.407 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -54.99 -30.33 59.12 Favored 'General case' 0 N--CA 1.505 2.281 0 O-C-N 121.446 -0.783 . . . . 0.0 110.533 -178.196 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 74.5 m-20 -68.74 -30.69 69.36 Favored 'General case' 0 N--CA 1.499 1.998 0 O-C-N 121.82 -0.55 . . . . 0.0 110.298 174.859 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 96.0 m-85 -95.59 10.03 38.14 Favored 'General case' 0 N--CA 1.497 1.903 0 O-C-N 121.538 -0.726 . . . . 0.0 111.485 -178.24 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 7' ' ' TYR . . . . . 0.424 ' CE1' HG12 ' A' ' 3' ' ' VAL . 3.6 m-30 -67.3 138.6 56.95 Favored 'General case' 0 N--CA 1.501 2.095 0 O-C-N 121.154 -0.966 . . . . 0.0 110.166 174.27 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 83.3 -2.27 87.35 Favored Glycine 0 N--CA 1.498 2.8 0 N-CA-C 110.757 -0.937 . . . . 0.0 110.757 -177.289 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 27.7 t -76.24 138.2 40.44 Favored 'General case' 0 N--CA 1.497 1.878 0 O-C-N 121.117 -1.225 . . . . 0.0 110.446 179.581 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 10' ' ' ASN . . . . . 0.684 ' CG ' HG22 ' A' ' 24' ' ' VAL . 2.5 m120 -83.4 118.37 23.67 Favored 'General case' 0 N--CA 1.498 1.937 0 O-C-N 121.629 -0.669 . . . . 0.0 109.411 173.882 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 11' ' ' VAL . . . . . 0.594 HG21 HD11 ' A' ' 25' ' ' ILE . 35.2 m -143.21 161.0 17.42 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.836 0 O-C-N 121.812 -0.555 . . . . 0.0 109.638 -178.361 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 12' ' ' GLU . . . . . 0.566 ' HB2' HD11 ' A' ' 58' ' ' LEU . 40.6 tt0 -109.48 126.02 53.08 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.481 -0.762 . . . . 0.0 110.111 178.075 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 13' ' ' VAL . . . . . 0.588 HG22 ' CD2' ' A' ' 55' ' ' LEU . 60.0 t -106.81 124.4 62.44 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.782 0 O-C-N 121.663 -0.648 . . . . 0.0 110.005 -178.521 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 21.9 tp -95.96 129.27 43.26 Favored 'General case' 0 N--CA 1.494 1.758 0 O-C-N 121.697 -0.627 . . . . 0.0 109.495 174.073 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 85.9 mt -98.86 167.24 10.88 Favored 'General case' 0 N--CA 1.495 1.803 0 O-C-N 121.607 -0.683 . . . . 0.0 111.052 -172.75 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 9.6 p30 -57.95 -22.35 48.63 Favored 'General case' 0 N--CA 1.505 2.313 0 O-C-N 121.832 -0.543 . . . . 0.0 111.555 -177.412 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 43.5 p-10 -92.46 23.28 4.05 Favored 'General case' 0 N--CA 1.498 1.97 0 O-C-N 121.428 -0.795 . . . . 0.0 110.847 -176.823 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 58.77 27.83 16.52 Favored 'General case' 0 N--CA 1.505 2.279 0 O-C-N 121.498 -0.751 . . . . 0.0 110.714 175.194 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 50.8 m -105.54 133.98 49.4 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.531 -0.731 . . . . 0.0 109.542 171.754 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 33.0 ttmt -109.81 141.86 41.88 Favored 'General case' 0 N--CA 1.495 1.799 0 O-C-N 121.714 -0.616 . . . . 0.0 110.46 -176.044 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -153.12 156.09 37.99 Favored 'General case' 0 N--CA 1.496 1.836 0 O-C-N 121.625 -0.672 . . . . 0.0 110.267 178.941 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 22' ' ' ARG . . . . . 0.5 ' O ' HD13 ' A' ' 39' ' ' LEU . 31.1 ptt180 -140.55 146.58 38.25 Favored 'General case' 0 N--CA 1.497 1.9 0 O-C-N 121.623 -0.673 . . . . 0.0 110.558 179.832 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -171.73 171.48 44.11 Favored Glycine 0 N--CA 1.495 2.589 0 N-CA-C 108.829 -1.709 . . . . 0.0 108.829 -175.132 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 24' ' ' VAL . . . . . 0.684 HG22 ' CG ' ' A' ' 10' ' ' ASN . 39.8 t -94.56 120.54 44.13 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.874 0 O-C-N 121.419 -1.048 . . . . 0.0 109.309 -175.904 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 25' ' ' ILE . . . . . 0.648 ' HA ' HD23 ' A' ' 37' ' ' LEU . 75.2 mt -64.31 141.98 17.47 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.102 0 O-C-N 121.545 -0.722 . . . . 0.0 110.402 -172.093 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 26' ' ' THR . . . . . 0.645 HG21 ' HB2' ' A' ' 38' ' ' ARG . 5.7 p -121.26 -26.44 5.06 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.653 -0.654 . . . . 0.0 111.345 -179.949 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 27' ' ' ASN . . . . . 0.51 ' O ' HD12 ' A' ' 35' ' ' LEU . 2.1 t-20 -162.09 160.41 27.34 Favored 'General case' 0 N--CA 1.5 2.053 0 C-N-CA 118.877 -1.129 . . . . 0.0 111.872 -179.244 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 28' ' ' PHE . . . . . 0.534 ' HE1' HG21 ' A' ' 49' ' ' THR . 85.0 t80 -150.01 126.57 10.9 Favored 'General case' 0 N--CA 1.497 1.904 0 N-CA-C 109.116 -0.698 . . . . 0.0 109.116 169.436 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 26.7 t0 -99.77 130.4 45.97 Favored 'General case' 0 N--CA 1.491 1.599 0 N-CA-C 109.064 -0.717 . . . . 0.0 109.064 -177.019 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 22.8 t -68.85 -50.15 52.39 Favored 'General case' 0 N--CA 1.498 1.962 0 C-N-CA 120.037 -0.665 . . . . 0.0 110.597 -176.662 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 19.8 m -59.7 -42.55 93.26 Favored 'General case' 0 N--CA 1.502 2.146 0 O-C-N 121.614 -0.679 . . . . 0.0 110.915 -174.366 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 91.4 m-20 -103.97 -10.08 18.38 Favored 'General case' 0 N--CA 1.497 1.921 0 O-C-N 121.565 -0.709 . . . . 0.0 111.66 -178.136 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 3.0 m 50.09 67.21 0.95 Allowed 'General case' 0 N--CA 1.508 2.443 0 O-C-N 121.0 -1.062 . . . . 0.0 110.943 -174.345 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 34' ' ' ILE . . . . . 1.122 HD12 HG22 ' A' ' 48' ' ' VAL . 47.4 mm -124.72 126.95 72.36 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.072 0 O-C-N 121.541 -0.724 . . . . 0.0 109.469 -175.711 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.51 HD12 ' O ' ' A' ' 27' ' ' ASN . 11.7 tp -115.78 120.57 39.73 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.675 -0.641 . . . . 0.0 110.501 -169.851 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 99.1 mt-30 -91.06 134.66 34.33 Favored 'General case' 0 N--CA 1.491 1.607 0 N-CA-C 109.39 -0.596 . . . . 0.0 109.39 174.24 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 37' ' ' LEU . . . . . 0.648 HD23 ' HA ' ' A' ' 25' ' ' ILE . 88.8 mt -117.87 123.8 46.75 Favored 'General case' 0 N--CA 1.497 1.915 0 O-C-N 121.772 -0.58 . . . . 0.0 109.896 173.527 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 38' ' ' ARG . . . . . 0.645 ' HB2' HG21 ' A' ' 26' ' ' THR . 73.3 ttt-85 -97.11 109.09 21.91 Favored 'General case' 0 N--CA 1.497 1.877 0 O-C-N 121.699 -0.626 . . . . 0.0 109.8 175.863 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 39' ' ' LEU . . . . . 0.5 HD13 ' O ' ' A' ' 22' ' ' ARG . 17.6 tp -85.07 150.63 24.73 Favored 'General case' 0 N--CA 1.494 1.774 0 O-C-N 121.706 -0.621 . . . . 0.0 110.928 -173.91 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -62.3 -10.39 10.86 Favored 'General case' 0 N--CA 1.504 2.233 0 O-C-N 121.907 -0.495 . . . . 0.0 111.892 -173.059 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 39.7 t30 -85.16 29.14 0.67 Allowed 'General case' 0 N--CA 1.499 2.008 0 O-C-N 121.151 -0.968 . . . . 0.0 110.94 174.651 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 74.3 m-20 59.68 31.69 21.03 Favored 'General case' 0 N--CA 1.505 2.307 0 O-C-N 121.213 -0.929 . . . . 0.0 110.424 174.031 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 52.2 m -123.3 137.91 54.74 Favored 'General case' 0 N--CA 1.495 1.797 0 O-C-N 121.413 -0.805 . . . . 0.0 110.348 178.609 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 8.9 t -98.06 149.5 22.42 Favored 'General case' 0 N--CA 1.497 1.902 0 O-C-N 121.694 -0.629 . . . . 0.0 110.274 176.937 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 78.0 tttt -149.72 119.16 6.89 Favored 'General case' 0 N--CA 1.495 1.805 0 O-C-N 121.577 -0.702 . . . . 0.0 110.33 177.897 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 88.7 p -95.52 123.98 39.33 Favored 'General case' 0 N--CA 1.494 1.767 0 O-C-N 121.673 -0.642 . . . . 0.0 110.24 179.009 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 81.4 mt -129.35 135.3 62.05 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.838 0 O-C-N 121.621 -0.674 . . . . 0.0 109.311 179.555 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 48' ' ' VAL . . . . . 1.122 HG22 HD12 ' A' ' 34' ' ' ILE . 59.7 t -82.21 127.59 39.49 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.883 0 O-C-N 121.581 -0.699 . . . . 0.0 109.265 179.122 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 49' ' ' THR . . . . . 0.534 HG21 ' HE1' ' A' ' 28' ' ' PHE . 37.7 p -59.21 -24.95 63.57 Favored 'General case' 0 N--CA 1.504 2.25 0 O-C-N 121.611 -0.681 . . . . 0.0 112.06 -169.721 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 57.9 mttm -56.55 -22.91 36.5 Favored 'General case' 0 N--CA 1.503 2.213 0 O-C-N 121.466 -0.771 . . . . 0.0 110.991 -176.833 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 51.0 p30 -83.98 1.26 44.49 Favored 'General case' 0 N--CA 1.499 1.995 0 O-C-N 121.406 -0.809 . . . . 0.0 111.288 176.376 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 99.0 mt -75.63 126.66 36.63 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.066 0 O-C-N 121.171 -0.956 . . . . 0.0 110.042 178.883 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 37.6 ttpt -93.08 -29.27 15.88 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.851 -0.53 . . . . 0.0 109.893 170.562 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 5.1 m-20 -164.07 155.86 16.57 Favored 'General case' 0 N--CA 1.5 2.056 0 O-C-N 121.748 -0.595 . . . . 0.0 109.952 -178.251 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 55' ' ' LEU . . . . . 0.588 ' CD2' HG22 ' A' ' 13' ' ' VAL . 82.7 mt -132.89 149.69 52.23 Favored 'General case' 0 N--CA 1.496 1.849 0 O-C-N 121.645 -0.659 . . . . 0.0 110.62 -178.804 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 9.5 ptp85 -151.43 144.55 24.63 Favored 'General case' 0 N--CA 1.496 1.838 0 O-C-N 121.71 -0.619 . . . . 0.0 110.083 174.438 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 57' ' ' ILE . . . . . 0.482 ' HA ' HG12 ' A' ' 11' ' ' VAL . 66.6 mt -86.33 133.16 30.43 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.745 0 O-C-N 121.523 -0.736 . . . . 0.0 109.66 171.697 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 58' ' ' LEU . . . . . 0.566 HD11 ' HB2' ' A' ' 12' ' ' GLU . 61.8 mt . . . . . 0 N--CA 1.497 1.884 0 O-C-N 121.626 -0.671 . . . . 0.0 109.981 -179.781 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 257' ' ' SER . . . . . . . . . . . . . 74.2 m . . . . . 0 N--CA 1.503 2.208 0 CA-C-O 121.259 0.552 . . . . 0.0 110.499 . . . . . . . . . 0 0 . 1 . 020 nuclear build core ' B' B ' 258' ' ' SER . . . . . . . . . . . . . 24.9 m -68.16 -33.25 74.11 Favored 'General case' 0 N--CA 1.498 1.949 0 O-C-N 121.914 -0.491 . . . . 0.0 110.248 -179.468 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 259' ' ' GLN . . . . . . . . . . . . . 94.0 mm-40 -63.24 -36.79 84.83 Favored 'General case' 0 N--CA 1.501 2.109 0 O-C-N 121.648 -0.658 . . . . 0.0 110.463 -179.138 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 260' ' ' LEU . . . . . 0.496 ' HA ' HD12 ' B' ' 263' ' ' LEU . 81.9 mt -67.28 -42.43 83.84 Favored 'General case' 0 N--CA 1.499 2.025 0 O-C-N 121.646 -0.659 . . . . 0.0 110.191 178.989 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 261' ' ' LEU . . . . . . . . . . . . . 24.0 tp -69.79 -36.18 75.48 Favored 'General case' 0 N--CA 1.497 1.893 0 O-C-N 121.615 -0.678 . . . . 0.0 109.736 176.407 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 262' ' ' SER . . . . . . . . . . . . . 69.4 m -62.3 -36.34 81.84 Favored 'General case' 0 N--CA 1.5 2.066 0 O-C-N 121.761 -0.587 . . . . 0.0 110.465 177.41 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 263' ' ' LEU . . . . . 0.496 HD12 ' HA ' ' B' ' 260' ' ' LEU . 20.7 mt . . . . . 0 N--CA 1.501 2.076 0 O-C-N 121.679 -0.638 . . . . 0.0 110.116 179.779 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 69.1 m . . . . . 0 N--CA 1.495 1.825 0 CA-C-O 121.131 0.491 . . . . 0.0 110.545 . . . . . . . . . 0 0 . 1 . 021 nuclear build core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 52.2 t -66.13 -27.84 41.97 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.153 0 O-C-N 121.667 -0.645 . . . . 0.0 110.344 -179.059 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -55.43 -31.81 62.19 Favored 'General case' 0 N--CA 1.505 2.29 0 O-C-N 121.538 -0.726 . . . . 0.0 110.371 -178.057 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 73.7 m-20 -68.84 -35.16 76.62 Favored 'General case' 0 N--CA 1.498 1.951 0 O-C-N 121.747 -0.596 . . . . 0.0 109.912 175.24 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 6' ' ' PHE . . . . . 0.468 ' CE2' HD11 ' B' ' 260' ' ' LEU . 97.8 m-85 -97.93 10.02 41.31 Favored 'General case' 0 N--CA 1.497 1.9 0 O-C-N 121.751 -0.593 . . . . 0.0 111.284 178.826 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -67.41 129.53 40.19 Favored 'General case' 0 N--CA 1.501 2.114 0 O-C-N 121.208 -0.932 . . . . 0.0 109.975 178.694 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 8' ' ' GLY . . . . . 0.459 ' O ' HG13 ' A' ' 24' ' ' VAL . . . 82.08 0.93 90.14 Favored Glycine 0 N--CA 1.497 2.734 0 N-CA-C 110.647 -0.981 . . . . 0.0 110.647 -175.397 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 57.6 m -76.08 135.24 39.89 Favored 'General case' 0 N--CA 1.498 1.944 0 O-C-N 121.09 -1.241 . . . . 0.0 110.445 178.24 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 10' ' ' ASN . . . . . 0.405 ' CG ' HG22 ' A' ' 24' ' ' VAL . 0.1 OUTLIER -84.31 114.25 21.72 Favored 'General case' 0 N--CA 1.498 1.958 0 O-C-N 121.67 -0.644 . . . . 0.0 109.695 174.375 . . . . . . . . 3 3 . 1 . 021 nuclear build core ' A' A ' 11' ' ' VAL . . . . . 0.553 HG12 ' HA ' ' A' ' 57' ' ' ILE . 35.8 m -140.23 164.04 22.93 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.835 0 O-C-N 121.772 -0.58 . . . . 0.0 109.463 179.992 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 12' ' ' GLU . . . . . 0.49 ' HB2' HD11 ' A' ' 58' ' ' LEU . 44.1 tt0 -109.36 129.6 55.53 Favored 'General case' 0 N--CA 1.492 1.654 0 C-N-CA 119.782 -0.767 . . . . 0.0 110.02 179.129 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 13' ' ' VAL . . . . . 0.598 HG22 ' CD2' ' A' ' 55' ' ' LEU . 60.3 t -106.69 127.36 62.24 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.726 0 O-C-N 121.546 -0.721 . . . . 0.0 110.015 -179.042 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 14' ' ' LEU . . . . . 0.445 HD13 ' HG2' ' A' ' 20' ' ' LYS . 27.1 tp -95.87 125.45 40.44 Favored 'General case' 0 N--CA 1.494 1.769 0 N-CA-C 109.031 -0.729 . . . . 0.0 109.031 173.42 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 87.0 mt -95.51 168.29 10.79 Favored 'General case' 0 N--CA 1.496 1.847 0 O-C-N 121.581 -0.7 . . . . 0.0 111.113 -172.73 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 24.4 p30 -58.02 -21.68 46.21 Favored 'General case' 0 N--CA 1.506 2.339 0 O-C-N 121.856 -0.528 . . . . 0.0 111.632 -176.94 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 46.0 p-10 -91.6 22.51 4.02 Favored 'General case' 0 N--CA 1.499 1.996 0 O-C-N 121.517 -0.739 . . . . 0.0 110.919 -176.641 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 74.4 m-20 58.55 27.37 15.56 Favored 'General case' 0 N--CA 1.506 2.35 0 O-C-N 121.469 -0.769 . . . . 0.0 110.712 175.738 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 49.9 m -108.18 144.39 35.68 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.579 -0.701 . . . . 0.0 109.578 172.887 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 20' ' ' LYS . . . . . 0.445 ' HG2' HD13 ' A' ' 14' ' ' LEU . 48.2 mttm -109.57 145.47 36.32 Favored 'General case' 0 N--CA 1.495 1.806 0 O-C-N 121.61 -0.681 . . . . 0.0 110.615 -176.512 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -153.07 154.11 34.2 Favored 'General case' 0 N--CA 1.496 1.865 0 O-C-N 121.784 -0.573 . . . . 0.0 109.868 176.272 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 22' ' ' ARG . . . . . 0.407 ' O ' HD22 ' A' ' 39' ' ' LEU . 30.4 ptt180 -140.4 151.5 44.99 Favored 'General case' 0 N--CA 1.496 1.841 0 O-C-N 121.635 -0.666 . . . . 0.0 110.529 -179.513 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 23' ' ' GLY . . . . . 0.426 ' HA2' HD13 ' A' ' 39' ' ' LEU . . . -171.85 171.09 43.93 Favored Glycine 0 N--CA 1.492 2.419 0 N-CA-C 109.037 -1.625 . . . . 0.0 109.037 -179.846 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 24' ' ' VAL . . . . . 0.459 HG13 ' O ' ' A' ' 8' ' ' GLY . 61.3 t -94.63 127.24 46.77 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.845 0 O-C-N 121.651 -0.911 . . . . 0.0 109.163 176.34 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 25' ' ' ILE . . . . . 0.515 ' HA ' HD23 ' A' ' 37' ' ' LEU . 49.3 mt -61.37 138.4 22.12 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.185 0 O-C-N 121.594 -0.691 . . . . 0.0 110.874 -171.099 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 26' ' ' THR . . . . . 0.674 HG21 ' HB2' ' A' ' 38' ' ' ARG . 11.4 p -121.25 -20.59 6.66 Favored 'General case' 0 N--CA 1.493 1.717 0 O-C-N 121.876 -0.515 . . . . 0.0 111.49 -179.548 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 2.5 t-20 -165.48 158.57 15.99 Favored 'General case' 0 N--CA 1.505 2.311 0 O-C-N 120.945 -1.097 . . . . 0.0 111.871 177.093 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 65.1 t80 -150.41 119.95 6.95 Favored 'General case' 0 N--CA 1.497 1.901 0 N-CA-C 109.226 -0.657 . . . . 0.0 109.226 173.766 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 17.9 t70 -97.14 127.2 42.88 Favored 'General case' 0 N--CA 1.494 1.757 0 O-C-N 121.641 -0.662 . . . . 0.0 109.293 -177.113 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 22.7 t -65.85 -46.34 78.82 Favored 'General case' 0 N--CA 1.5 2.042 0 O-C-N 121.557 -0.715 . . . . 0.0 110.865 -175.11 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 21.4 t -58.61 -48.06 82.25 Favored 'General case' 0 N--CA 1.502 2.13 0 O-C-N 121.505 -0.747 . . . . 0.0 111.0 -173.575 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 92.4 m-20 -107.02 -1.87 21.69 Favored 'General case' 0 N--CA 1.498 1.927 0 O-C-N 121.594 -0.691 . . . . 0.0 111.804 -178.316 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 69.1 m 49.18 67.18 0.92 Allowed 'General case' 0 N--CA 1.508 2.438 0 O-C-N 121.082 -1.011 . . . . 0.0 110.901 -174.437 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 34' ' ' ILE . . . . . 1.102 HD12 HG22 ' A' ' 48' ' ' VAL . 44.2 mm -113.82 125.79 71.18 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.971 0 O-C-N 121.544 -0.723 . . . . 0.0 109.136 -175.215 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 10.9 tp -116.0 119.03 34.56 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.613 -0.679 . . . . 0.0 110.451 -169.816 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 78.2 mt-30 -90.98 132.39 36.0 Favored 'General case' 0 N--CA 1.489 1.523 0 N-CA-C 109.191 -0.67 . . . . 0.0 109.191 170.862 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 37' ' ' LEU . . . . . 0.515 HD23 ' HA ' ' A' ' 25' ' ' ILE . 48.8 mt -117.81 123.47 46.03 Favored 'General case' 0 N--CA 1.493 1.71 0 C-N-CA 120.152 -0.619 . . . . 0.0 109.949 175.218 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 38' ' ' ARG . . . . . 0.674 ' HB2' HG21 ' A' ' 26' ' ' THR . 56.5 ttt85 -105.1 105.85 16.08 Favored 'General case' 0 N--CA 1.495 1.786 0 O-C-N 121.78 -0.575 . . . . 0.0 110.091 174.101 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 39' ' ' LEU . . . . . 0.426 HD13 ' HA2' ' A' ' 23' ' ' GLY . 63.3 tp -83.37 155.04 23.72 Favored 'General case' 0 N--CA 1.498 1.949 0 O-C-N 121.609 -0.682 . . . . 0.0 110.515 -177.054 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -68.82 -2.91 10.61 Favored 'General case' 0 N--CA 1.504 2.243 0 O-C-N 121.885 -0.51 . . . . 0.0 112.131 -170.347 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 30.1 m120 -88.04 28.59 1.03 Allowed 'General case' 0 N--CA 1.497 1.907 0 O-C-N 121.029 -1.045 . . . . 0.0 110.795 174.878 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 13.5 t0 64.9 29.03 12.6 Favored 'General case' 0 N--CA 1.505 2.295 0 O-C-N 121.205 -0.934 . . . . 0.0 110.387 175.755 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 74.5 m -125.01 137.95 54.23 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.432 -0.792 . . . . 0.0 110.137 177.897 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 9.1 t -128.22 149.72 50.34 Favored 'General case' 0 N--CA 1.496 1.843 0 O-C-N 121.711 -0.618 . . . . 0.0 110.018 178.818 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 45' ' ' LYS . . . . . 0.422 ' HD3' HD11 ' A' ' 47' ' ' ILE . 57.7 tttm -151.15 134.9 16.44 Favored 'General case' 0 N--CA 1.497 1.879 0 O-C-N 121.704 -0.623 . . . . 0.0 110.574 -178.339 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 91.0 p -95.0 120.99 36.15 Favored 'General case' 0 N--CA 1.495 1.796 0 O-C-N 121.727 -0.608 . . . . 0.0 110.215 177.556 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 47' ' ' ILE . . . . . 0.422 HD11 ' HD3' ' A' ' 45' ' ' LYS . 80.9 mt -129.35 136.05 60.31 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.85 0 O-C-N 121.681 -0.637 . . . . 0.0 109.359 -179.597 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 48' ' ' VAL . . . . . 1.102 HG22 HD12 ' A' ' 34' ' ' ILE . 66.4 t -81.71 127.79 39.28 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.001 0 O-C-N 121.631 -0.668 . . . . 0.0 109.202 179.204 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 51.6 p -57.99 -25.06 60.56 Favored 'General case' 0 N--CA 1.505 2.295 0 O-C-N 121.463 -0.773 . . . . 0.0 111.87 -168.97 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 43.4 tptt -57.19 -26.06 60.02 Favored 'General case' 0 N--CA 1.502 2.134 0 O-C-N 121.507 -0.745 . . . . 0.0 111.066 -176.805 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 5.0 p30 -84.69 5.72 27.08 Favored 'General case' 0 N--CA 1.498 1.95 0 C-N-CA 119.69 -0.804 . . . . 0.0 111.286 176.323 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 96.5 mt -75.77 124.41 33.76 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.144 0 O-C-N 121.146 -0.971 . . . . 0.0 109.837 175.461 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 42.5 tttp -92.36 -28.68 16.76 Favored 'General case' 0 N--CA 1.495 1.803 0 C-N-CA 120.396 -0.521 . . . . 0.0 109.953 171.962 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 5.4 m-20 -163.75 154.57 15.92 Favored 'General case' 0 N--CA 1.501 2.085 0 O-C-N 121.791 -0.568 . . . . 0.0 110.125 -178.461 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 55' ' ' LEU . . . . . 0.598 ' CD2' HG22 ' A' ' 13' ' ' VAL . 84.4 mt -132.96 150.75 52.14 Favored 'General case' 0 N--CA 1.497 1.887 0 O-C-N 121.669 -0.645 . . . . 0.0 110.487 -179.181 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 19.6 ptp180 -151.59 145.71 25.31 Favored 'General case' 0 N--CA 1.495 1.797 0 O-C-N 121.688 -0.632 . . . . 0.0 110.009 174.824 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 57' ' ' ILE . . . . . 0.553 ' HA ' HG12 ' A' ' 11' ' ' VAL . 64.8 mt -86.32 133.27 30.16 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.837 0 O-C-N 121.527 -0.733 . . . . 0.0 109.86 173.864 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 58' ' ' LEU . . . . . 0.49 HD11 ' HB2' ' A' ' 12' ' ' GLU . 61.1 mt . . . . . 0 N--CA 1.497 1.893 0 O-C-N 121.594 -0.692 . . . . 0.0 110.145 -178.903 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' B' B ' 257' ' ' SER . . . . . . . . . . . . . 34.5 t . . . . . 0 N--CA 1.503 2.204 0 CA-C-O 121.325 0.583 . . . . 0.0 110.396 . . . . . . . . . 0 0 . 1 . 021 nuclear build core ' B' B ' 258' ' ' SER . . . . . . . . . . . . . 25.3 m -67.99 -31.25 70.82 Favored 'General case' 0 N--CA 1.498 1.934 0 O-C-N 121.888 -0.507 . . . . 0.0 110.25 178.978 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' B' B ' 259' ' ' GLN . . . . . . . . . . . . . 48.7 tt0 -61.47 -37.59 84.17 Favored 'General case' 0 N--CA 1.502 2.134 0 O-C-N 121.635 -0.666 . . . . 0.0 110.381 178.964 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' B' B ' 260' ' ' LEU . . . . . 0.502 ' HA ' HD12 ' B' ' 263' ' ' LEU . 46.0 mt -65.93 -42.36 90.2 Favored 'General case' 0 N--CA 1.5 2.038 0 O-C-N 121.721 -0.612 . . . . 0.0 110.306 178.449 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' B' B ' 261' ' ' LEU . . . . . . . . . . . . . 18.9 tp -69.89 -36.55 75.53 Favored 'General case' 0 N--CA 1.498 1.961 0 O-C-N 121.717 -0.614 . . . . 0.0 109.75 176.83 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' B' B ' 262' ' ' SER . . . . . . . . . . . . . 49.1 m -62.16 -37.0 83.56 Favored 'General case' 0 N--CA 1.501 2.078 0 O-C-N 121.714 -0.616 . . . . 0.0 110.556 176.614 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' B' B ' 263' ' ' LEU . . . . . 0.502 HD12 ' HA ' ' B' ' 260' ' ' LEU . 18.9 mt . . . . . 0 N--CA 1.502 2.133 0 O-C-N 121.698 -0.626 . . . . 0.0 110.186 179.64 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 69.7 m . . . . . 0 N--CA 1.496 1.843 0 CA-C-O 121.021 0.439 . . . . 0.0 110.247 . . . . . . . . . 0 0 . 1 . 022 nuclear build core ' A' A ' 3' ' ' VAL . . . . . 0.431 HG12 ' CE1' ' A' ' 7' ' ' TYR . 65.6 t -66.4 -27.73 41.31 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.065 0 O-C-N 121.727 -0.608 . . . . 0.0 110.337 -178.887 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -54.98 -30.63 59.62 Favored 'General case' 0 N--CA 1.505 2.303 0 O-C-N 121.487 -0.758 . . . . 0.0 110.439 -178.422 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 9.7 m-20 -68.89 -30.72 69.27 Favored 'General case' 0 N--CA 1.499 1.995 0 O-C-N 121.753 -0.592 . . . . 0.0 110.244 174.981 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 97.4 m-85 -95.56 10.06 37.96 Favored 'General case' 0 N--CA 1.497 1.909 0 O-C-N 121.636 -0.665 . . . . 0.0 111.502 -178.16 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 7' ' ' TYR . . . . . 0.431 ' CE1' HG12 ' A' ' 3' ' ' VAL . 3.9 m-30 -67.3 139.88 57.29 Favored 'General case' 0 N--CA 1.502 2.135 0 O-C-N 121.171 -0.955 . . . . 0.0 110.077 174.184 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 8' ' ' GLY . . . . . 0.424 ' O ' HG13 ' A' ' 24' ' ' VAL . . . 83.65 -3.14 86.13 Favored Glycine 0 N--CA 1.497 2.746 0 N-CA-C 110.768 -0.933 . . . . 0.0 110.768 -177.089 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 66.2 m -75.27 138.97 42.23 Favored 'General case' 0 N--CA 1.497 1.887 0 O-C-N 121.115 -1.227 . . . . 0.0 110.508 179.685 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 10' ' ' ASN . . . . . 0.669 ' CG ' HG22 ' A' ' 24' ' ' VAL . 2.4 m120 -84.58 118.8 24.57 Favored 'General case' 0 N--CA 1.498 1.971 0 O-C-N 121.651 -0.656 . . . . 0.0 109.454 174.407 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 11' ' ' VAL . . . . . 0.474 HG12 ' HA ' ' A' ' 57' ' ' ILE . 35.8 m -143.19 162.3 17.02 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.822 0 O-C-N 121.693 -0.629 . . . . 0.0 109.854 -179.116 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 12' ' ' GLU . . . . . 0.584 ' HB2' HD11 ' A' ' 58' ' ' LEU . 47.7 tt0 -109.47 127.22 54.26 Favored 'General case' 0 N--CA 1.493 1.692 0 O-C-N 121.56 -0.713 . . . . 0.0 110.047 176.331 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 13' ' ' VAL . . . . . 0.548 HG22 ' CD2' ' A' ' 55' ' ' LEU . 58.0 t -106.89 123.52 62.0 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.747 0 O-C-N 121.48 -0.763 . . . . 0.0 109.951 -178.324 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 14' ' ' LEU . . . . . 0.637 HD12 ' O ' ' A' ' 19' ' ' SER . 17.6 tp -96.0 135.1 38.22 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.663 -0.648 . . . . 0.0 109.472 175.737 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 86.2 mt -103.67 169.0 8.78 Favored 'General case' 0 N--CA 1.497 1.908 0 O-C-N 121.61 -0.681 . . . . 0.0 111.22 -172.605 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 24.1 p30 -59.05 -21.73 59.59 Favored 'General case' 0 N--CA 1.507 2.391 0 O-C-N 121.843 -0.535 . . . . 0.0 111.677 -177.507 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 47.7 p-10 -93.45 24.53 3.9 Favored 'General case' 0 N--CA 1.498 1.96 0 O-C-N 121.497 -0.752 . . . . 0.0 110.797 -175.309 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 74.3 m-20 59.31 25.64 14.33 Favored 'General case' 0 N--CA 1.505 2.298 0 O-C-N 121.523 -0.736 . . . . 0.0 110.73 176.834 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 19' ' ' SER . . . . . 0.637 ' O ' HD12 ' A' ' 14' ' ' LEU . 70.7 m -97.67 163.07 12.98 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.631 -0.668 . . . . 0.0 109.274 170.657 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 13.0 ptmt -145.4 138.02 25.98 Favored 'General case' 0 N--CA 1.495 1.818 0 O-C-N 121.59 -0.694 . . . . 0.0 110.46 -176.688 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -153.02 161.62 42.31 Favored 'General case' 0 N--CA 1.496 1.863 0 O-C-N 121.728 -0.607 . . . . 0.0 110.299 179.893 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 22' ' ' ARG . . . . . 0.486 ' O ' HD13 ' A' ' 39' ' ' LEU . 32.5 ptt180 -142.06 147.15 36.35 Favored 'General case' 0 N--CA 1.496 1.826 0 O-C-N 121.701 -0.624 . . . . 0.0 110.782 -179.751 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -171.73 171.42 44.08 Favored Glycine 0 N--CA 1.494 2.561 0 N-CA-C 108.76 -1.736 . . . . 0.0 108.76 -175.47 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 24' ' ' VAL . . . . . 0.669 HG22 ' CG ' ' A' ' 10' ' ' ASN . 39.9 t -94.59 120.89 44.65 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.901 0 O-C-N 121.424 -1.045 . . . . 0.0 109.35 -175.451 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 25' ' ' ILE . . . . . 0.662 ' HA ' HD23 ' A' ' 37' ' ' LEU . 92.6 mt -64.29 143.45 15.69 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.118 0 O-C-N 121.566 -0.709 . . . . 0.0 110.498 -171.899 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 26' ' ' THR . . . . . 0.619 HG21 ' HB2' ' A' ' 38' ' ' ARG . 6.3 p -121.23 -28.16 4.75 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.785 -0.572 . . . . 0.0 111.256 179.334 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 27' ' ' ASN . . . . . 0.518 ' O ' HD12 ' A' ' 35' ' ' LEU . 27.5 t30 -161.66 160.77 29.07 Favored 'General case' 0 N--CA 1.5 2.065 0 C-N-CA 118.919 -1.112 . . . . 0.0 111.899 -177.881 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 28' ' ' PHE . . . . . 0.56 ' HE1' HG21 ' A' ' 49' ' ' THR . 82.0 t80 -150.08 125.81 10.38 Favored 'General case' 0 N--CA 1.499 2.002 0 N-CA-C 109.052 -0.721 . . . . 0.0 109.052 169.724 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 17.8 t70 -99.68 128.56 45.78 Favored 'General case' 0 N--CA 1.492 1.664 0 N-CA-C 109.089 -0.708 . . . . 0.0 109.089 -177.484 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 21.8 m -66.43 -46.37 76.71 Favored 'General case' 0 N--CA 1.499 2.015 0 C-N-CA 120.053 -0.659 . . . . 0.0 110.673 -175.736 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 16.3 t -58.22 -48.06 81.55 Favored 'General case' 0 N--CA 1.503 2.206 0 O-C-N 121.485 -0.76 . . . . 0.0 110.957 -173.971 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 90.4 m-20 -104.59 -5.38 21.51 Favored 'General case' 0 N--CA 1.497 1.895 0 O-C-N 121.614 -0.679 . . . . 0.0 111.643 -178.486 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 71.0 m 49.36 67.25 0.91 Allowed 'General case' 0 N--CA 1.507 2.418 0 O-C-N 121.132 -0.98 . . . . 0.0 110.937 -174.32 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 34' ' ' ILE . . . . . 1.034 HD12 HG22 ' A' ' 48' ' ' VAL . 45.5 mm -120.68 126.41 75.21 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.019 0 O-C-N 121.665 -0.647 . . . . 0.0 109.323 -174.959 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.518 HD12 ' O ' ' A' ' 27' ' ' ASN . 11.9 tp -115.76 120.38 39.13 Favored 'General case' 0 N--CA 1.494 1.762 0 O-C-N 121.68 -0.637 . . . . 0.0 110.504 -169.065 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 99.0 mt-30 -90.99 134.68 34.29 Favored 'General case' 0 N--CA 1.491 1.593 0 N-CA-C 109.468 -0.568 . . . . 0.0 109.468 174.485 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 37' ' ' LEU . . . . . 0.662 HD23 ' HA ' ' A' ' 25' ' ' ILE . 90.2 mt -117.82 123.82 46.86 Favored 'General case' 0 N--CA 1.496 1.842 0 O-C-N 121.841 -0.537 . . . . 0.0 109.915 174.342 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 38' ' ' ARG . . . . . 0.619 ' HB2' HG21 ' A' ' 26' ' ' THR . 58.0 ttt85 -96.64 108.54 21.17 Favored 'General case' 0 N--CA 1.496 1.83 0 O-C-N 121.669 -0.645 . . . . 0.0 109.829 175.283 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 39' ' ' LEU . . . . . 0.486 HD13 ' O ' ' A' ' 22' ' ' ARG . 17.9 tp -84.83 153.37 22.99 Favored 'General case' 0 N--CA 1.494 1.739 0 O-C-N 121.745 -0.597 . . . . 0.0 110.962 -174.155 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -63.57 -9.65 14.4 Favored 'General case' 0 N--CA 1.503 2.183 0 O-C-N 121.985 -0.447 . . . . 0.0 111.928 -171.781 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 30.0 m120 -86.14 27.47 0.91 Allowed 'General case' 0 N--CA 1.498 1.953 0 O-C-N 121.106 -0.996 . . . . 0.0 110.984 175.679 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 15.7 t0 62.89 29.23 16.57 Favored 'General case' 0 N--CA 1.504 2.235 0 O-C-N 120.975 -1.078 . . . . 0.0 110.595 175.481 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 63.8 m -123.14 137.81 54.81 Favored 'General case' 0 N--CA 1.496 1.872 0 O-C-N 121.344 -0.847 . . . . 0.0 110.402 -179.522 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 10.2 t -97.62 151.02 20.51 Favored 'General case' 0 N--CA 1.495 1.82 0 O-C-N 121.735 -0.603 . . . . 0.0 110.281 176.756 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 57.9 tttt -149.24 119.15 7.11 Favored 'General case' 0 N--CA 1.496 1.854 0 O-C-N 121.691 -0.631 . . . . 0.0 110.202 177.812 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 88.1 p -95.21 123.95 38.99 Favored 'General case' 0 N--CA 1.495 1.798 0 O-C-N 121.64 -0.662 . . . . 0.0 110.294 -179.831 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 82.7 mt -129.27 134.83 63.14 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.866 0 O-C-N 121.692 -0.63 . . . . 0.0 109.379 178.889 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 48' ' ' VAL . . . . . 1.034 HG22 HD12 ' A' ' 34' ' ' ILE . 66.6 t -82.71 127.56 39.55 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.889 0 O-C-N 121.622 -0.674 . . . . 0.0 109.306 179.318 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 49' ' ' THR . . . . . 0.56 HG21 ' HE1' ' A' ' 28' ' ' PHE . 67.9 p -58.29 -24.93 61.09 Favored 'General case' 0 N--CA 1.507 2.408 0 O-C-N 121.545 -0.722 . . . . 0.0 111.916 -169.793 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 56.3 tttt -56.51 -23.26 38.39 Favored 'General case' 0 N--CA 1.502 2.135 0 O-C-N 121.464 -0.772 . . . . 0.0 111.149 -177.055 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 50.4 p30 -84.0 1.47 43.59 Favored 'General case' 0 N--CA 1.498 1.941 0 O-C-N 121.419 -0.8 . . . . 0.0 111.301 176.677 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 52' ' ' ILE . . . . . 0.402 HD12 ' HB ' ' A' ' 49' ' ' THR . 97.8 mt -76.13 127.56 37.44 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.074 0 O-C-N 121.163 -0.961 . . . . 0.0 110.055 179.05 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 45.8 tptt -92.14 -30.86 15.74 Favored 'General case' 0 N--CA 1.495 1.789 0 O-C-N 121.868 -0.52 . . . . 0.0 109.602 169.283 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 5.3 m-20 -163.91 159.37 20.86 Favored 'General case' 0 N--CA 1.499 2.007 0 O-C-N 121.87 -0.519 . . . . 0.0 109.89 -178.56 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 55' ' ' LEU . . . . . 0.548 ' CD2' HG22 ' A' ' 13' ' ' VAL . 85.5 mt -132.94 149.33 52.25 Favored 'General case' 0 N--CA 1.496 1.868 0 O-C-N 121.699 -0.626 . . . . 0.0 110.342 -179.241 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 6.8 ptm180 -150.71 137.6 19.1 Favored 'General case' 0 N--CA 1.496 1.832 0 O-C-N 121.716 -0.615 . . . . 0.0 109.978 176.462 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 57' ' ' ILE . . . . . 0.474 ' HA ' HG12 ' A' ' 11' ' ' VAL . 68.6 mt -84.77 133.18 29.89 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.795 0 O-C-N 121.503 -0.748 . . . . 0.0 109.843 175.182 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 58' ' ' LEU . . . . . 0.584 HD11 ' HB2' ' A' ' 12' ' ' GLU . 56.4 mt . . . . . 0 N--CA 1.496 1.863 0 O-C-N 121.592 -0.693 . . . . 0.0 110.137 179.404 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' B' B ' 257' ' ' SER . . . . . . . . . . . . . 45.4 m . . . . . 0 N--CA 1.503 2.219 0 CA-C-O 121.223 0.535 . . . . 0.0 110.422 . . . . . . . . . 0 0 . 1 . 022 nuclear build core ' B' B ' 258' ' ' SER . . . . . . . . . . . . . 25.6 t -69.51 -32.79 71.86 Favored 'General case' 0 N--CA 1.498 1.973 0 C-N-CA 120.365 -0.534 . . . . 0.0 110.274 179.171 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' B' B ' 259' ' ' GLN . . . . . . . . . . . . . 29.2 tt0 -63.27 -38.37 90.88 Favored 'General case' 0 N--CA 1.501 2.1 0 O-C-N 121.629 -0.669 . . . . 0.0 110.472 -179.37 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' B' B ' 260' ' ' LEU . . . . . 0.495 ' HA ' HD12 ' B' ' 263' ' ' LEU . 84.5 mt -67.16 -42.33 84.48 Favored 'General case' 0 N--CA 1.5 2.027 0 O-C-N 121.652 -0.655 . . . . 0.0 110.251 179.872 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' B' B ' 261' ' ' LEU . . . . . . . . . . . . . 21.6 tp -70.01 -36.61 75.24 Favored 'General case' 0 N--CA 1.496 1.873 0 O-C-N 121.668 -0.645 . . . . 0.0 109.757 176.852 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' B' B ' 262' ' ' SER . . . . . . . . . . . . . 22.6 t -62.25 -37.51 85.72 Favored 'General case' 0 N--CA 1.501 2.086 0 O-C-N 121.745 -0.597 . . . . 0.0 110.389 177.036 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' B' B ' 263' ' ' LEU . . . . . 0.495 HD12 ' HA ' ' B' ' 260' ' ' LEU . 28.2 mt . . . . . 0 N--CA 1.501 2.093 0 O-C-N 121.651 -0.655 . . . . 0.0 110.314 179.365 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' -1' ' ' MET . . . . . . . . . . . . . 61.1 mtt . . . . . 0 N--CA 1.493 1.724 0 CA-C-O 121.019 0.437 . . . . 6.75 110.16 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 0' ' ' GLY . . . . . . . . . . . . . . . 159.21 127.5 0.92 Allowed Glycine 0 N--CA 1.493 2.486 0 N-CA-C 109.528 -1.429 . . . . 2.52 109.528 179.944 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 74.1 mtm -129.59 163.5 25.88 Favored 'General case' 0 N--CA 1.496 1.826 0 O-C-N 121.723 -0.869 . . . . 2.5 110.253 -179.571 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 73.0 m -94.8 174.51 7.06 Favored 'General case' 0 N--CA 1.496 1.829 0 O-C-N 121.727 -0.608 . . . . 0.64 110.027 179.377 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 3' ' ' VAL . . . . . 0.426 HG12 ' CE1' ' A' ' 7' ' ' TYR . 66.8 t -66.55 -27.82 41.43 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.13 0 O-C-N 121.675 -0.641 . . . . 0.7 110.301 -178.486 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -55.18 -31.16 61.16 Favored 'General case' 0 N--CA 1.504 2.251 0 O-C-N 121.492 -0.755 . . . . 0.4 110.504 -178.262 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 9.7 m-20 -69.05 -30.59 68.96 Favored 'General case' 0 N--CA 1.498 1.962 0 O-C-N 121.833 -0.542 . . . . 1.17 110.304 174.903 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 6' ' ' PHE . . . . . 0.423 ' CE1' HD21 ' B' ' 260' ' ' LEU . 95.4 m-85 -95.49 10.01 38.04 Favored 'General case' 0 N--CA 1.497 1.887 0 O-C-N 121.638 -0.664 . . . . 0.66 111.537 -177.88 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 7' ' ' TYR . . . . . 0.426 ' CE1' HG12 ' A' ' 3' ' ' VAL . 3.4 m-30 -67.1 136.1 54.64 Favored 'General case' 0 N--CA 1.502 2.144 0 O-C-N 121.2 -0.938 . . . . 2.41 109.966 174.172 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 8' ' ' GLY . . . . . 0.423 ' O ' HG13 ' A' ' 24' ' ' VAL . . . 83.13 -0.9 89.5 Favored Glycine 0 N--CA 1.498 2.794 0 N-CA-C 110.583 -1.007 . . . . 0.26 110.583 -175.711 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 27.4 t -77.24 134.77 38.49 Favored 'General case' 0 N--CA 1.498 1.951 0 O-C-N 121.2 -1.176 . . . . 1.3 110.451 178.409 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 12.7 t-20 -83.52 120.03 25.43 Favored 'General case' 0 N--CA 1.497 1.896 0 O-C-N 121.623 -0.673 . . . . 2.09 109.612 173.227 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 11' ' ' VAL . . . . . 0.528 HG12 ' HA ' ' A' ' 57' ' ' ILE . 35.9 m -142.73 162.92 17.86 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.714 0 O-C-N 121.79 -0.569 . . . . 0.24 109.718 -178.89 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 12' ' ' GLU . . . . . 0.442 ' HB2' HD11 ' A' ' 58' ' ' LEU . 49.4 tt0 -109.39 147.31 32.99 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.654 -0.654 . . . . 1.06 109.533 177.04 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 13' ' ' VAL . . . . . 0.671 HG22 ' CD2' ' A' ' 55' ' ' LEU . 57.7 t -136.07 125.16 38.77 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.79 0 O-C-N 121.642 -0.661 . . . . 0.28 109.742 -174.259 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.443 HD13 ' HG2' ' A' ' 20' ' ' LYS . 24.1 tp -95.93 127.84 42.3 Favored 'General case' 0 N--CA 1.493 1.701 0 N-CA-C 109.238 -0.653 . . . . 0.34 109.238 174.942 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 85.1 mt -92.78 171.83 8.73 Favored 'General case' 0 N--CA 1.496 1.83 0 O-C-N 121.659 -0.651 . . . . 0.28 110.887 -173.961 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 24.0 p30 -56.89 -22.39 36.93 Favored 'General case' 0 N--CA 1.505 2.281 0 O-C-N 121.731 -0.606 . . . . 0.36 111.518 -177.814 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 53.2 p-10 -92.99 22.92 4.55 Favored 'General case' 0 N--CA 1.498 1.972 0 O-C-N 121.613 -0.679 . . . . 0.72 110.835 -178.038 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 74.3 m-20 58.73 27.81 16.44 Favored 'General case' 0 N--CA 1.506 2.334 0 O-C-N 121.446 -0.784 . . . . 1.0 110.647 176.279 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 49.9 m -105.81 146.9 29.28 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.511 -0.743 . . . . 0.32 109.697 173.052 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 20' ' ' LYS . . . . . 0.443 ' HG2' HD13 ' A' ' 14' ' ' LEU . 73.6 mttt -109.55 145.55 36.16 Favored 'General case' 0 N--CA 1.495 1.783 0 O-C-N 121.572 -0.705 . . . . 1.63 110.609 -176.64 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -153.07 131.52 12.14 Favored 'General case' 0 N--CA 1.496 1.833 0 O-C-N 121.809 -0.557 . . . . 0.38 110.266 176.74 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 22' ' ' ARG . . . . . 0.519 ' O ' HD13 ' A' ' 39' ' ' LEU . 16.6 ptp180 -126.17 144.26 50.82 Favored 'General case' 0 N--CA 1.497 1.92 0 O-C-N 121.659 -0.651 . . . . 2.17 110.427 -178.133 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -171.77 171.4 44.08 Favored Glycine 0 N--CA 1.496 2.642 0 N-CA-C 109.189 -1.564 . . . . 0.25 109.189 -176.101 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 24' ' ' VAL . . . . . 0.423 HG13 ' O ' ' A' ' 8' ' ' GLY . 47.2 t -94.67 119.9 43.32 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.958 0 O-C-N 121.593 -0.945 . . . . 0.24 109.375 -176.963 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 25' ' ' ILE . . . . . 0.425 ' HA ' HD23 ' A' ' 37' ' ' LEU . 90.7 mt -64.21 144.16 14.98 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.139 0 O-C-N 121.658 -0.652 . . . . 0.48 110.531 -171.482 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 26' ' ' THR . . . . . 0.778 HG21 ' HG3' ' A' ' 38' ' ' ARG . 19.1 p -121.28 -27.28 4.89 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.823 -0.548 . . . . 0.6 111.152 178.128 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 27' ' ' ASN . . . . . 0.497 ' O ' HD12 ' A' ' 35' ' ' LEU . 2.1 t-20 -161.37 160.79 29.98 Favored 'General case' 0 N--CA 1.5 2.029 0 C-N-CA 118.97 -1.092 . . . . 1.09 111.823 -178.921 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 28' ' ' PHE . . . . . 0.493 ' CE1' HG21 ' A' ' 49' ' ' THR . 84.1 t80 -150.11 126.97 11.07 Favored 'General case' 0 N--CA 1.498 1.954 0 N-CA-C 109.138 -0.689 . . . . 0.65 109.138 170.234 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 17.9 t70 -99.7 129.16 45.8 Favored 'General case' 0 N--CA 1.491 1.619 0 N-CA-C 109.121 -0.696 . . . . 1.15 109.121 -178.263 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 22.8 m -67.41 -47.67 69.58 Favored 'General case' 0 N--CA 1.498 1.949 0 O-C-N 121.647 -0.658 . . . . 1.32 110.714 -175.609 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 22.1 m -59.47 -45.23 92.23 Favored 'General case' 0 N--CA 1.503 2.206 0 O-C-N 121.596 -0.69 . . . . 1.18 110.892 -173.878 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 91.3 m-20 -104.69 -7.09 19.83 Favored 'General case' 0 N--CA 1.497 1.891 0 O-C-N 121.645 -0.659 . . . . 1.34 111.608 -178.386 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 16.7 m 49.64 67.23 0.93 Allowed 'General case' 0 N--CA 1.507 2.422 0 O-C-N 121.058 -1.026 . . . . 1.19 110.857 -174.378 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 34' ' ' ILE . . . . . 1.039 HD12 HG22 ' A' ' 48' ' ' VAL . 45.5 mm -121.4 125.98 74.34 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.993 0 O-C-N 121.545 -0.722 . . . . 0.31 109.333 -175.224 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.497 HD12 ' O ' ' A' ' 27' ' ' ASN . 11.5 tp -115.87 120.76 40.27 Favored 'General case' 0 N--CA 1.494 1.748 0 O-C-N 121.735 -0.603 . . . . 0.26 110.559 -168.865 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 98.8 mt-30 -91.03 132.8 35.79 Favored 'General case' 0 N--CA 1.49 1.563 0 N-CA-C 109.494 -0.558 . . . . 1.02 109.494 173.87 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 0.425 HD23 ' HA ' ' A' ' 25' ' ' ILE . 16.3 mt -117.86 123.82 46.82 Favored 'General case' 0 N--CA 1.495 1.819 0 O-C-N 121.824 -0.547 . . . . 0.54 109.992 176.408 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 38' ' ' ARG . . . . . 0.778 ' HG3' HG21 ' A' ' 26' ' ' THR . 26.4 mtp85 -96.79 107.09 19.51 Favored 'General case' 0 N--CA 1.496 1.87 0 O-C-N 121.651 -0.656 . . . . 2.79 109.935 175.545 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.519 HD13 ' O ' ' A' ' 22' ' ' ARG . 17.2 tp -84.53 152.08 24.15 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.684 -0.635 . . . . 0.81 110.911 -174.618 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -66.37 -5.83 12.18 Favored 'General case' 0 N--CA 1.502 2.143 0 O-C-N 121.946 -0.471 . . . . 0.48 112.006 -172.251 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 91.1 m-20 -86.61 27.91 0.92 Allowed 'General case' 0 N--CA 1.498 1.946 0 O-C-N 121.107 -0.995 . . . . 2.36 110.925 174.504 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 8.0 t70 62.96 29.46 16.47 Favored 'General case' 0 N--CA 1.504 2.251 0 O-C-N 121.099 -1.0 . . . . 2.02 110.524 175.687 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 49.9 m -124.51 137.91 54.38 Favored 'General case' 0 N--CA 1.495 1.808 0 O-C-N 121.316 -0.865 . . . . 0.81 110.554 -179.597 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 8.6 t -97.97 151.0 20.75 Favored 'General case' 0 N--CA 1.497 1.876 0 O-C-N 121.75 -0.593 . . . . 0.66 110.116 175.265 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 37.9 ttmt -150.49 119.13 6.52 Favored 'General case' 0 N--CA 1.495 1.791 0 O-C-N 121.521 -0.737 . . . . 1.97 110.393 179.023 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 88.8 p -95.12 122.87 38.24 Favored 'General case' 0 N--CA 1.496 1.834 0 O-C-N 121.687 -0.633 . . . . 0.29 110.27 179.356 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 82.0 mt -129.36 136.36 59.58 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.866 0 O-C-N 121.654 -0.654 . . . . 0.31 109.301 179.427 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 48' ' ' VAL . . . . . 1.039 HG22 HD12 ' A' ' 34' ' ' ILE . 66.9 t -81.88 127.63 39.43 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.914 0 O-C-N 121.565 -0.709 . . . . 0.35 109.165 179.068 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 49' ' ' THR . . . . . 0.493 HG21 ' CE1' ' A' ' 28' ' ' PHE . 34.6 p -59.53 -24.86 64.04 Favored 'General case' 0 N--CA 1.504 2.266 0 O-C-N 121.56 -0.713 . . . . 0.33 111.998 -170.606 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 77.1 tttt -56.55 -25.49 52.29 Favored 'General case' 0 N--CA 1.502 2.173 0 O-C-N 121.45 -0.781 . . . . 3.28 110.943 -176.558 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 7.3 p30 -84.09 4.63 29.34 Favored 'General case' 0 N--CA 1.499 2.007 0 C-N-CA 119.714 -0.794 . . . . 0.54 111.364 176.517 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 98.2 mt -75.8 126.46 36.56 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.137 0 O-C-N 121.07 -1.019 . . . . 0.49 109.872 175.933 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 47.3 tptt -91.44 -29.95 16.76 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.833 -0.542 . . . . 1.89 109.903 170.579 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 5.3 m-20 -164.29 157.01 17.24 Favored 'General case' 0 N--CA 1.5 2.06 0 O-C-N 121.795 -0.566 . . . . 0.86 110.026 -178.136 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 55' ' ' LEU . . . . . 0.671 ' CD2' HG22 ' A' ' 13' ' ' VAL . 84.1 mt -132.97 150.74 52.14 Favored 'General case' 0 N--CA 1.497 1.92 0 O-C-N 121.756 -0.59 . . . . 0.59 110.581 -178.65 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 9.2 ptp85 -152.79 142.33 21.78 Favored 'General case' 0 N--CA 1.497 1.884 0 O-C-N 121.729 -0.607 . . . . 1.93 109.973 175.349 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 57' ' ' ILE . . . . . 0.528 ' HA ' HG12 ' A' ' 11' ' ' VAL . 68.8 mt -86.42 133.25 30.24 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.928 0 O-C-N 121.501 -0.75 . . . . 0.32 110.094 175.14 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 58' ' ' LEU . . . . . 0.482 HD11 ' HB2' ' A' ' 22' ' ' ARG . 59.6 mt -83.56 161.7 55.62 Favored Pre-proline 0 N--CA 1.499 1.981 0 O-C-N 121.634 -0.666 . . . . 0.48 110.029 -179.557 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 23.7 Cg_endo -66.04 152.19 81.94 Favored 'Trans proline' 0 N--CA 1.489 1.226 0 O-C-N 123.648 1.341 . . . . 1.28 110.373 178.093 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 49.1 tttm -79.49 125.43 29.56 Favored 'General case' 0 N--CA 1.497 1.899 0 O-C-N 121.644 -0.66 . . . . 5.5 110.238 -178.979 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 8.9 t-20 58.05 166.03 0.04 OUTLIER 'General case' 0 N--CA 1.507 2.396 0 O-C-N 121.633 -0.667 . . . . 5.4 110.922 -179.03 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 75.9 mm-40 51.82 30.6 7.19 Favored 'General case' 0 N--CA 1.505 2.322 0 O-C-N 121.503 -0.748 . . . . 7.38 111.168 -179.838 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 85.6 mt -68.05 -53.11 32.16 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.155 0 O-C-N 121.658 -0.651 . . . . 8.89 109.73 -179.354 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 64' ' ' MET . . . . . . . . . . . . . 10.3 mtt -80.11 -56.81 0.7 Allowed Pre-proline 0 N--CA 1.497 1.892 0 O-C-N 121.623 -0.673 . . . . 12.43 110.614 179.429 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 41.2 Cg_endo -73.18 145.09 38.48 Favored 'Trans proline' 0 N--CA 1.487 1.135 0 O-C-N 123.231 1.122 . . . . 12.01 110.29 -178.549 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 50.2 mttp -111.3 125.89 54.31 Favored 'General case' 0 N--CA 1.496 1.849 0 O-C-N 121.69 -0.631 . . . . 15.83 110.133 179.195 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 79.1 m-20 -141.36 167.25 22.61 Favored 'General case' 0 N--CA 1.495 1.783 0 O-C-N 121.761 -0.587 . . . . 14.96 110.232 179.4 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . -126.31 41.04 1.7 Allowed Glycine 0 N--CA 1.495 2.615 0 N-CA-C 109.623 -1.391 . . . . 16.62 109.623 -179.731 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 39.7 p -120.6 153.66 36.5 Favored 'General case' 0 N--CA 1.495 1.823 0 O-C-N 121.662 -0.905 . . . . 17.77 110.229 179.779 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 66.9 tttt -66.58 -38.06 86.24 Favored 'General case' 0 N--CA 1.499 2.019 0 O-C-N 121.754 -0.592 . . . . 20.45 110.347 -179.612 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 1.4 t 52.83 64.3 7.44 Favored Pre-proline 0 N--CA 1.504 2.233 0 O-C-N 121.552 -0.718 . . . . 20.36 110.787 -178.555 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 25.4 Cg_endo -66.11 -32.61 42.98 Favored 'Trans proline' 0 N--CA 1.488 1.198 0 O-C-N 123.542 1.285 . . . . 21.91 110.635 -178.278 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 23.6 p -119.63 143.87 47.45 Favored 'General case' 0 N--CA 1.495 1.813 0 O-C-N 121.6 -0.687 . . . . 22.42 110.307 -179.269 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 24.5 m -69.26 -35.68 76.34 Favored 'General case' 0 N--CA 1.498 1.948 0 O-C-N 121.736 -0.603 . . . . 23.31 110.129 179.349 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 30.4 m120 53.35 44.91 29.44 Favored 'General case' 0 N--CA 1.507 2.382 0 O-C-N 121.717 -0.614 . . . . 24.31 110.838 -179.851 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 96.3 p -100.26 146.39 26.97 Favored 'General case' 0 N--CA 1.495 1.775 0 O-C-N 121.624 -0.672 . . . . 24.83 110.155 179.559 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 35.5 p -138.55 39.43 2.23 Favored 'General case' 0 N--CA 1.494 1.76 0 O-C-N 121.69 -0.631 . . . . 26.44 110.238 -178.992 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 57.7 tttm -67.93 129.04 38.69 Favored 'General case' 0 N--CA 1.5 2.032 0 O-C-N 121.609 -0.682 . . . . 28.15 110.209 -179.167 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 81.8 mt 53.36 178.97 0.02 OUTLIER 'General case' 0 N--CA 1.507 2.403 0 O-C-N 121.73 -0.606 . . . . 28.03 111.199 -179.127 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 42.9 tttp 51.97 91.47 0.02 OUTLIER 'General case' 0 N--CA 1.506 2.337 0 O-C-N 121.579 -0.7 . . . . 28.49 110.994 -179.555 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 27.5 t -115.44 140.86 48.76 Favored 'General case' 0 N--CA 1.496 1.837 0 O-C-N 121.67 -0.644 . . . . 28.79 110.178 -179.4 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -113.12 -172.01 1.98 Allowed 'General case' 0 N--CA 1.495 1.793 0 O-C-N 121.623 -0.673 . . . . 29.4 110.142 179.665 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 50.9 mt-10 -97.76 26.41 5.13 Favored 'General case' 0 N--CA 1.496 1.854 0 O-C-N 121.635 -0.665 . . . . 30.48 110.719 -180.0 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 24.4 m -125.85 138.87 53.83 Favored 'General case' 0 N--CA 1.494 1.772 0 O-C-N 121.469 -0.769 . . . . 32.57 110.16 -179.919 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 99.0 m-85 -117.57 137.75 52.38 Favored 'General case' 0 N--CA 1.496 1.866 0 O-C-N 121.717 -0.614 . . . . 33.79 110.174 -179.999 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 31.9 t -127.69 140.52 52.02 Favored 'General case' 0 N--CA 1.495 1.798 0 O-C-N 121.689 -0.632 . . . . 34.38 110.21 179.477 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 32.1 t -129.12 138.08 51.59 Favored 'General case' 0 N--CA 1.496 1.848 0 O-C-N 121.739 -0.601 . . . . 35.72 110.204 179.873 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 27.1 mtpp 55.43 -84.93 0.01 OUTLIER 'General case' 0 N--CA 1.506 2.341 0 O-C-N 121.889 -0.507 . . . . 36.18 111.309 -179.203 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 46.2 p-10 -146.99 148.99 32.26 Favored 'General case' 0 N--CA 1.496 1.852 0 O-C-N 121.114 -0.991 . . . . 37.24 110.345 -179.438 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 49.7 mttp -66.68 -39.17 88.03 Favored 'General case' 0 N--CA 1.499 2.007 0 O-C-N 121.668 -0.645 . . . . 39.54 110.347 -179.728 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 91' ' ' TRP . . . . . . . . . . . . . 98.5 m95 -116.82 135.64 53.58 Favored 'General case' 0 N--CA 1.495 1.812 0 O-C-N 121.651 -0.656 . . . . 39.64 110.24 -179.736 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 50.5 m -126.58 144.75 50.79 Favored 'General case' 0 N--CA 1.495 1.823 0 O-C-N 121.746 -0.596 . . . . 39.16 110.236 179.255 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 93' ' ' MET . . . . . . . . . . . . . 13.4 mmt 52.58 31.91 10.83 Favored 'General case' 0 N--CA 1.504 2.267 0 O-C-N 121.615 -0.678 . . . . 41.23 111.13 179.496 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 7.0 m-20 . . . . . 0 N--CA 1.495 1.788 0 CA-C-O 117.946 -1.026 . . . . 40.8 110.273 179.202 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' B' B ' 240' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.295 0 N-CA-C 109.499 -1.44 . . . . 23.28 109.499 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' B' B ' 241' ' ' ALA . . . . . . . . . . . . . . . -103.7 145.32 30.24 Favored 'General case' 0 N--CA 1.495 1.807 0 O-C-N 121.678 -0.895 . . . . 21.82 110.189 -179.949 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 242' ' ' THR . . . . . . . . . . . . . 52.7 p -128.2 164.13 23.19 Favored 'General case' 0 N--CA 1.496 1.843 0 O-C-N 121.665 -0.647 . . . . 19.99 110.094 -179.933 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 243' ' ' THR . . . . . . . . . . . . . 23.9 m -65.47 -39.24 91.74 Favored 'General case' 0 N--CA 1.501 2.079 0 O-C-N 121.685 -0.634 . . . . 18.5 110.371 -179.758 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 244' ' ' LYS . . . . . . . . . . . . . 45.3 mtpt -103.56 133.31 48.8 Favored 'General case' 0 N--CA 1.495 1.785 0 O-C-N 121.653 -0.654 . . . . 17.83 110.15 179.702 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 245' ' ' GLU . . . . . . . . . . . . . 54.7 mt-10 -68.36 -34.24 75.72 Favored 'General case' 0 N--CA 1.499 1.996 0 O-C-N 121.653 -0.654 . . . . 15.5 110.267 179.692 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 246' ' ' LYS . . . . . . . . . . . . . 39.2 tttp -96.85 132.1 42.93 Favored 'General case' 0 N--CA 1.494 1.761 0 O-C-N 121.742 -0.599 . . . . 16.68 110.228 -179.665 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 247' ' ' ASN . . . . . . . . . . . . . 35.2 t-20 -131.41 -54.24 1.02 Allowed 'General case' 0 N--CA 1.495 1.823 0 O-C-N 121.701 -0.624 . . . . 12.92 110.126 179.4 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 248' ' ' ILE . . . . . . . . . . . . . 33.8 pt 38.99 -159.78 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.515 2.814 0 N-CA-C 112.253 0.464 . . . . 11.91 112.253 -179.648 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 249' ' ' SER . . . . . 0.456 ' C ' HG22 ' B' ' 250' ' ' VAL . 56.7 p -138.47 -64.01 0.53 Allowed 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.322 -0.861 . . . . 9.03 110.228 178.919 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 250' ' ' VAL . . . . . 0.456 HG22 ' C ' ' B' ' 249' ' ' SER . 19.7 m 41.19 -159.46 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.515 2.797 0 N-CA-C 112.118 0.414 . . . . 8.13 112.118 177.827 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 251' ' ' ASP . . . . . . . . . . . . . 8.8 p-10 -161.2 103.88 1.28 Allowed 'General case' 0 N--CA 1.497 1.89 0 O-C-N 121.367 -0.833 . . . . 6.36 110.312 179.09 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 252' ' ' VAL . . . . . 0.574 ' O ' HG13 ' B' ' 252' ' ' VAL . 8.3 p -162.22 81.86 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.497 1.88 0 O-C-N 121.596 -0.69 . . . . 4.58 110.02 -179.882 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 253' ' ' ASP . . . . . . . . . . . . . 74.5 m-20 -79.93 140.1 36.81 Favored 'General case' 0 N--CA 1.497 1.918 0 O-C-N 121.457 -0.777 . . . . 3.47 110.349 -177.834 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 254' ' ' ALA . . . . . . . . . . . . . . . -66.8 -23.86 66.11 Favored 'General case' 0 N--CA 1.5 2.047 0 O-C-N 121.8 -0.562 . . . . 1.46 110.768 178.935 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 255' ' ' ASP . . . . . . . . . . . . . 16.7 t70 -70.75 -28.72 64.91 Favored 'General case' 0 N--CA 1.499 1.994 0 O-C-N 121.528 -0.732 . . . . 2.11 110.465 -178.781 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 256' ' ' ALA . . . . . . . . . . . . . . . -63.19 -38.04 89.6 Favored 'General case' 0 N--CA 1.501 2.11 0 O-C-N 121.475 -0.766 . . . . 0.82 110.42 179.689 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 257' ' ' SER . . . . . . . . . . . . . 49.0 m -55.37 -34.98 64.78 Favored 'General case' 0 N--CA 1.503 2.207 0 O-C-N 121.586 -0.696 . . . . 1.2 110.459 177.74 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 258' ' ' SER . . . . . . . . . . . . . 25.4 m -69.07 -32.27 71.6 Favored 'General case' 0 N--CA 1.498 1.968 0 C-N-CA 120.502 -0.479 . . . . 1.3 110.3 -179.883 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 259' ' ' GLN . . . . . . . . . . . . . 98.5 mt-30 -63.42 -36.88 85.2 Favored 'General case' 0 N--CA 1.501 2.086 0 O-C-N 121.557 -0.714 . . . . 2.24 110.46 -179.038 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 260' ' ' LEU . . . . . 0.423 HD21 ' CE1' ' A' ' 6' ' ' PHE . 83.3 mt -68.18 -43.9 77.1 Favored 'General case' 0 N--CA 1.5 2.051 0 O-C-N 121.691 -0.631 . . . . 0.49 110.206 179.349 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 261' ' ' LEU . . . . . . . . . . . . . 21.7 tp -68.88 -35.06 76.43 Favored 'General case' 0 N--CA 1.498 1.932 0 O-C-N 121.703 -0.623 . . . . 0.39 109.756 176.039 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 262' ' ' SER . . . . . . . . . . . . . 23.1 t -62.74 -37.98 88.74 Favored 'General case' 0 N--CA 1.5 2.028 0 O-C-N 121.714 -0.616 . . . . 1.21 110.599 178.127 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 263' ' ' LEU . . . . . . . . . . . . . 33.8 mt -65.55 -46.64 78.73 Favored 'General case' 0 N--CA 1.501 2.117 0 O-C-N 121.663 -0.648 . . . . 0.64 110.09 -179.212 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 264' ' ' LEU . . . . . . . . . . . . . 81.2 mt -63.68 -33.73 76.27 Favored 'General case' 0 N--CA 1.502 2.139 0 O-C-N 121.805 -0.56 . . . . 0.82 110.651 178.103 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 265' ' ' LYS . . . . . . . . . . . . . 22.5 ttmt -75.68 -42.13 52.01 Favored 'General case' 0 N--CA 1.498 1.934 0 O-C-N 121.67 -0.644 . . . . 2.66 110.37 -177.029 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 266' ' ' SER . . . . . . . . . . . . . 85.7 p -163.01 169.51 19.46 Favored 'General case' 0 N--CA 1.496 1.859 0 O-C-N 121.65 -0.656 . . . . 2.62 110.389 -178.699 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 267' ' ' SER . . . . . . . . . . . . . 22.7 t -64.97 -31.32 72.5 Favored 'General case' 0 N--CA 1.501 2.095 0 O-C-N 121.742 -0.599 . . . . 3.87 110.638 -179.939 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 268' ' ' THR . . . . . . . . . . . . . 3.2 m 65.28 -66.08 0.15 Allowed 'General case' 0 N--CA 1.509 2.498 0 O-C-N 121.944 -0.473 . . . . 6.28 110.844 -176.839 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 269' ' ' ALA . . . . . 0.548 ' HB1' ' HD2' ' B' ' 270' ' ' PRO . . . 55.43 177.3 0.03 OUTLIER Pre-proline 0 N--CA 1.506 2.35 0 O-C-N 121.336 -0.853 . . . . 7.6 111.108 -179.74 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 270' ' ' PRO . . . . . 0.548 ' HD2' ' HB1' ' B' ' 269' ' ' ALA . 20.5 Cg_exo -62.19 -37.1 65.09 Favored 'Trans proline' 0 N--CA 1.49 1.302 0 O-C-N 123.58 1.305 . . . . 9.4 110.87 -178.749 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 271' ' ' SER . . . . . . . . . . . . . 27.5 t -144.36 129.19 18.35 Favored 'General case' 0 N--CA 1.495 1.783 0 O-C-N 121.692 -0.63 . . . . 11.68 110.473 -179.214 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 272' ' ' ASP . . . . . 0.544 ' OD2' ' HB3' ' B' ' 269' ' ' ALA . 3.2 m-20 -161.24 47.66 0.21 Allowed 'General case' 0 N--CA 1.495 1.821 0 CA-C-O 121.324 0.583 . . . . 13.91 109.849 178.644 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 273' ' ' LEU . . . . . . . . . . . . . 20.4 tp -162.06 -44.42 0.04 OUTLIER 'General case' 0 N--CA 1.497 1.881 0 O-C-N 121.531 -0.731 . . . . 16.84 110.184 -178.548 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 274' ' ' ALA . . . . . . . . . . . . . . . -74.95 -178.85 3.95 Favored 'General case' 0 N--CA 1.498 1.927 0 O-C-N 121.642 -0.661 . . . . 15.53 110.156 179.983 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 275' ' ' THR . . . . . . . . . . . . . 37.9 p -68.09 158.4 84.12 Favored Pre-proline 0 N--CA 1.5 2.045 0 O-C-N 121.707 -0.62 . . . . 16.75 110.171 -179.243 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 276' ' ' PRO . . . . . . . . . . . . . 21.5 Cg_exo -61.38 136.45 63.89 Favored 'Trans proline' 0 N--CA 1.491 1.359 0 O-C-N 123.571 1.301 . . . . 18.02 110.702 -179.605 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 277' ' ' GLN . . . . . . . . . . . . . 39.2 mm-40 -141.88 158.81 61.46 Favored Pre-proline 0 N--CA 1.494 1.749 0 O-C-N 121.673 -0.642 . . . . 20.35 110.173 179.272 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 278' ' ' PRO . . . . . . . . . . . . . 28.7 Cg_endo -67.58 115.52 3.77 Favored 'Trans proline' 0 N--CA 1.487 1.132 0 O-C-N 123.648 1.341 . . . . 20.31 110.362 179.701 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 279' ' ' SER . . . . . . . . . . . . . 87.6 p -151.86 160.97 43.37 Favored 'General case' 0 N--CA 1.495 1.804 0 O-C-N 121.732 -0.605 . . . . 21.95 110.205 179.965 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 280' ' ' THR . . . . . . . . . . . . . 24.6 m -126.13 140.4 52.6 Favored 'General case' 0 N--CA 1.495 1.824 0 O-C-N 121.671 -0.643 . . . . 23.36 110.116 179.635 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 281' ' ' PHE . . . . . . . . . . . . . 21.6 t80 -124.39 79.49 60.84 Favored Pre-proline 0 N--CA 1.495 1.82 0 O-C-N 121.712 -0.617 . . . . 24.56 110.074 179.478 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 282' ' ' PRO . . . . . . . . . . . . . 28.1 Cg_endo -67.16 141.17 56.33 Favored 'Trans proline' 0 N--CA 1.488 1.188 0 O-C-N 123.491 1.258 . . . . 26.21 110.422 -179.648 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 283' ' ' GLN . . . . . . . . . . . . . 45.6 tt0 -130.91 86.54 51.77 Favored Pre-proline 0 N--CA 1.496 1.832 0 O-C-N 121.653 -0.655 . . . . 27.38 110.149 179.43 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 284' ' ' PRO . . . . . . . . . . . . . 29.8 Cg_endo -68.24 151.95 76.29 Favored 'Trans proline' 0 N--CA 1.487 1.122 0 O-C-N 123.591 1.311 . . . . 28.45 110.312 -179.85 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 285' ' ' PRO . . . . . . . . . . . . . 30.0 Cg_endo -67.9 -34.18 24.44 Favored 'Trans proline' 0 N--CA 1.488 1.153 0 O-C-N 123.599 1.315 . . . . 29.23 110.451 -179.159 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 286' ' ' VAL . . . . . . . . . . . . . 61.2 t -128.15 137.35 57.73 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.923 0 O-C-N 121.685 -0.635 . . . . 30.04 109.866 -179.014 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 287' ' ' GLU . . . . . . . . . . . . . 46.3 mt-10 -107.58 145.93 32.6 Favored 'General case' 0 N--CA 1.496 1.845 0 O-C-N 121.665 -0.647 . . . . 31.7 110.058 178.638 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 288' ' ' SER . . . . . . . . . . . . . 30.5 t -136.12 142.45 44.26 Favored 'General case' 0 N--CA 1.495 1.824 0 O-C-N 121.638 -0.664 . . . . 32.6 110.283 -179.642 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 289' ' ' HIS . . . . . . . . . . . . . 77.7 m80 -91.58 -31.71 15.8 Favored 'General case' 0 N--CA 1.497 1.877 0 O-C-N 121.656 -0.653 . . . . 33.08 110.364 179.239 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 290' ' ' SER . . . . . . . . . . . . . 50.7 m -121.04 148.45 44.13 Favored 'General case' 0 N--CA 1.496 1.829 0 O-C-N 121.635 -0.666 . . . . 33.49 110.194 179.728 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 291' ' ' SER . . . . . . . . . . . . . 42.5 m . . . . . 0 N--CA 1.494 1.773 0 CA-C-O 117.993 -1.003 . . . . 34.91 110.213 179.987 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' -1' ' ' MET . . . . . . . . . . . . . 74.4 mtm . . . . . 0 N--CA 1.494 1.727 0 CA-C-O 120.989 0.423 . . . . 0.0 110.112 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 0' ' ' GLY . . . . . . . . . . . . . . . 158.19 -151.32 22.42 Favored Glycine 0 N--CA 1.494 2.527 0 N-CA-C 109.51 -1.436 . . . . 0.0 109.51 -179.711 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 90.1 mtp -94.39 148.02 22.65 Favored 'General case' 0 N--CA 1.496 1.833 0 O-C-N 121.675 -0.897 . . . . 0.0 110.103 179.856 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 70.7 m -101.05 167.25 10.36 Favored 'General case' 0 N--CA 1.495 1.794 0 O-C-N 121.661 -0.649 . . . . 0.0 110.085 -179.387 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 3' ' ' VAL . . . . . 0.416 HG12 ' CE1' ' A' ' 7' ' ' TYR . 73.2 t -66.18 -27.82 41.85 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.061 0 O-C-N 121.703 -0.623 . . . . 0.0 110.278 -179.153 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -55.06 -31.07 60.87 Favored 'General case' 0 N--CA 1.505 2.295 0 O-C-N 121.454 -0.779 . . . . 0.0 110.405 -178.907 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 74.4 m-20 -68.91 -30.62 69.13 Favored 'General case' 0 N--CA 1.499 1.991 0 O-C-N 121.845 -0.534 . . . . 0.0 110.279 174.886 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 96.1 m-85 -95.63 10.13 37.85 Favored 'General case' 0 N--CA 1.497 1.909 0 O-C-N 121.652 -0.655 . . . . 0.0 111.507 -178.025 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 7' ' ' TYR . . . . . 0.416 ' CE1' HG12 ' A' ' 3' ' ' VAL . 3.1 m-30 -67.28 133.18 49.2 Favored 'General case' 0 N--CA 1.502 2.141 0 O-C-N 121.17 -0.956 . . . . 0.0 110.018 173.986 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 8' ' ' GLY . . . . . 0.417 ' O ' HG13 ' A' ' 24' ' ' VAL . . . 83.66 -2.15 87.75 Favored Glycine 0 N--CA 1.497 2.753 0 N-CA-C 110.695 -0.962 . . . . 0.0 110.695 -176.086 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 30.4 t -77.27 138.91 39.67 Favored 'General case' 0 N--CA 1.497 1.918 0 O-C-N 121.11 -1.23 . . . . 0.0 110.461 177.948 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 14.8 t-20 -83.7 121.99 28.03 Favored 'General case' 0 N--CA 1.497 1.924 0 O-C-N 121.69 -0.631 . . . . 0.0 109.659 173.652 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 11' ' ' VAL . . . . . 0.457 HG12 ' HA ' ' A' ' 57' ' ' ILE . 35.8 m -143.24 159.75 17.46 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.775 0 O-C-N 121.79 -0.568 . . . . 0.0 109.598 -179.22 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 12' ' ' GLU . . . . . 0.565 ' HB2' HD11 ' A' ' 58' ' ' LEU . 46.5 tt0 -109.45 123.74 49.87 Favored 'General case' 0 N--CA 1.493 1.71 0 C-N-CA 119.901 -0.72 . . . . 0.0 109.984 177.009 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 13' ' ' VAL . . . . . 0.594 HG22 ' CD2' ' A' ' 55' ' ' LEU . 60.3 t -106.77 123.4 61.74 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.822 0 O-C-N 121.592 -0.693 . . . . 0.0 109.964 -177.128 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 27.0 tp -96.03 127.53 42.13 Favored 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.69 -0.631 . . . . 0.0 109.622 175.537 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 84.6 mt -97.83 169.87 9.36 Favored 'General case' 0 N--CA 1.495 1.813 0 O-C-N 121.623 -0.673 . . . . 0.0 110.977 -171.945 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 25.0 p30 -58.07 -21.18 44.71 Favored 'General case' 0 N--CA 1.505 2.314 0 O-C-N 121.782 -0.574 . . . . 0.0 111.594 -178.427 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 52.9 p-10 -90.27 21.01 4.02 Favored 'General case' 0 N--CA 1.499 1.978 0 O-C-N 121.548 -0.72 . . . . 0.0 111.121 -177.372 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 74.4 m-20 58.84 27.39 16.05 Favored 'General case' 0 N--CA 1.505 2.298 0 O-C-N 121.36 -0.838 . . . . 0.0 110.734 175.046 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 49.1 m -109.76 133.85 52.67 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.486 -0.759 . . . . 0.0 109.613 172.159 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 22.2 ttpt -109.78 143.12 40.06 Favored 'General case' 0 N--CA 1.494 1.748 0 O-C-N 121.618 -0.677 . . . . 0.0 110.738 -176.377 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -153.08 159.72 42.84 Favored 'General case' 0 N--CA 1.495 1.805 0 O-C-N 121.756 -0.59 . . . . 0.0 109.838 178.264 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 22' ' ' ARG . . . . . 0.519 ' O ' HD13 ' A' ' 39' ' ' LEU . 33.9 ptt-85 -141.27 148.64 40.15 Favored 'General case' 0 N--CA 1.497 1.895 0 O-C-N 121.625 -0.672 . . . . 0.0 110.831 -178.779 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -171.7 171.41 44.06 Favored Glycine 0 N--CA 1.495 2.631 0 N-CA-C 108.805 -1.718 . . . . 0.0 108.805 -176.589 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 24' ' ' VAL . . . . . 0.417 HG13 ' O ' ' A' ' 8' ' ' GLY . 46.4 t -94.57 122.5 46.08 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.944 0 O-C-N 121.428 -1.042 . . . . 0.0 109.348 -175.371 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 25' ' ' ILE . . . . . 0.642 ' HA ' HD23 ' A' ' 37' ' ' LEU . 93.6 mt -64.85 142.73 16.54 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.152 0 O-C-N 121.665 -0.647 . . . . 0.0 110.496 -172.066 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 26' ' ' THR . . . . . 0.627 HG21 ' HB2' ' A' ' 38' ' ' ARG . 6.7 p -121.22 -26.46 5.07 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.758 -0.589 . . . . 0.0 111.363 179.09 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 27' ' ' ASN . . . . . 0.523 ' O ' HD12 ' A' ' 35' ' ' LEU . 6.9 t-20 -162.07 160.49 27.49 Favored 'General case' 0 N--CA 1.499 2.009 0 C-N-CA 118.93 -1.108 . . . . 0.0 111.912 -179.109 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 28' ' ' PHE . . . . . 0.498 ' HE1' HG21 ' A' ' 49' ' ' THR . 86.8 t80 -150.03 127.49 11.49 Favored 'General case' 0 N--CA 1.498 1.935 0 N-CA-C 109.136 -0.69 . . . . 0.0 109.136 169.18 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 17.9 t70 -99.43 130.41 45.7 Favored 'General case' 0 N--CA 1.492 1.654 0 N-CA-C 109.002 -0.74 . . . . 0.0 109.002 -177.726 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 23.1 t -68.8 -50.31 51.23 Favored 'General case' 0 N--CA 1.498 1.956 0 C-N-CA 120.097 -0.641 . . . . 0.0 110.538 -176.268 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 21.8 t -59.57 -43.0 93.72 Favored 'General case' 0 N--CA 1.502 2.147 0 O-C-N 121.614 -0.679 . . . . 0.0 110.907 -174.415 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 91.6 m-20 -103.47 -10.02 18.87 Favored 'General case' 0 N--CA 1.498 1.929 0 O-C-N 121.628 -0.67 . . . . 0.0 111.615 -178.079 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 1.9 m 49.94 67.34 0.92 Allowed 'General case' 0 N--CA 1.508 2.443 0 O-C-N 121.072 -1.018 . . . . 0.0 110.938 -174.284 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 34' ' ' ILE . . . . . 1.123 HD12 HG22 ' A' ' 48' ' ' VAL . 46.9 mm -124.31 126.51 72.17 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.09 0 O-C-N 121.615 -0.678 . . . . 0.0 109.472 -175.753 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.523 HD12 ' O ' ' A' ' 27' ' ' ASN . 11.7 tp -115.8 121.17 41.64 Favored 'General case' 0 N--CA 1.494 1.75 0 O-C-N 121.692 -0.63 . . . . 0.0 110.517 -169.243 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 78.9 mt-30 -91.27 134.33 34.66 Favored 'General case' 0 N--CA 1.491 1.577 0 N-CA-C 109.436 -0.579 . . . . 0.0 109.436 173.684 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 0.642 HD23 ' HA ' ' A' ' 25' ' ' ILE . 89.3 mt -117.78 123.85 46.98 Favored 'General case' 0 N--CA 1.497 1.891 0 O-C-N 121.729 -0.607 . . . . 0.0 109.862 173.635 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 38' ' ' ARG . . . . . 0.627 ' HB2' HG21 ' A' ' 26' ' ' THR . 64.8 ttt180 -97.12 108.4 21.12 Favored 'General case' 0 N--CA 1.497 1.918 0 O-C-N 121.678 -0.639 . . . . 0.0 109.813 176.371 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.519 HD13 ' O ' ' A' ' 22' ' ' ARG . 19.1 tp -84.81 151.85 24.05 Favored 'General case' 0 N--CA 1.494 1.77 0 O-C-N 121.758 -0.589 . . . . 0.0 110.925 -174.522 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -65.88 -6.69 13.05 Favored 'General case' 0 N--CA 1.503 2.176 0 O-C-N 121.97 -0.456 . . . . 0.0 111.951 -172.481 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 91.6 m-20 -86.58 27.81 0.93 Allowed 'General case' 0 N--CA 1.498 1.974 0 O-C-N 121.103 -0.998 . . . . 0.0 110.909 174.73 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 7.9 t70 62.99 29.45 16.43 Favored 'General case' 0 N--CA 1.505 2.275 0 O-C-N 121.078 -1.014 . . . . 0.0 110.52 175.591 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 51.0 m -123.19 137.85 54.79 Favored 'General case' 0 N--CA 1.496 1.872 0 O-C-N 121.36 -0.837 . . . . 0.0 110.411 -179.651 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 8.9 t -98.89 151.02 21.31 Favored 'General case' 0 N--CA 1.497 1.902 0 O-C-N 121.754 -0.591 . . . . 0.0 110.278 176.08 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 85.4 tttt -149.81 119.12 6.83 Favored 'General case' 0 N--CA 1.494 1.767 0 O-C-N 121.579 -0.7 . . . . 0.0 110.301 178.183 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 91.2 p -96.12 122.87 39.42 Favored 'General case' 0 N--CA 1.496 1.827 0 O-C-N 121.647 -0.658 . . . . 0.0 110.175 178.653 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 82.3 mt -129.32 136.2 60.0 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.871 0 O-C-N 121.698 -0.626 . . . . 0.0 109.377 179.682 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 48' ' ' VAL . . . . . 1.123 HG22 HD12 ' A' ' 34' ' ' ILE . 59.3 t -82.37 127.6 39.5 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.91 0 O-C-N 121.6 -0.687 . . . . 0.0 109.196 178.762 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 49' ' ' THR . . . . . 0.498 HG21 ' HE1' ' A' ' 28' ' ' PHE . 37.5 p -59.92 -24.88 64.7 Favored 'General case' 0 N--CA 1.505 2.302 0 O-C-N 121.563 -0.711 . . . . 0.0 112.021 -170.265 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 91.4 mttt -56.84 -23.65 45.62 Favored 'General case' 0 N--CA 1.503 2.204 0 O-C-N 121.461 -0.774 . . . . 0.0 111.006 -176.616 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 45.7 p30 -84.34 2.75 38.96 Favored 'General case' 0 N--CA 1.498 1.957 0 C-N-CA 119.718 -0.793 . . . . 0.0 111.402 176.407 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 98.9 mt -75.12 126.15 35.55 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.119 0 O-C-N 121.204 -0.935 . . . . 0.0 109.997 178.17 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 40.9 tttp -92.79 -28.87 16.3 Favored 'General case' 0 N--CA 1.493 1.722 0 O-C-N 121.848 -0.532 . . . . 0.0 109.954 171.111 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 5.3 m-20 -163.98 155.27 16.14 Favored 'General case' 0 N--CA 1.501 2.086 0 O-C-N 121.806 -0.559 . . . . 0.0 110.005 -178.033 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 55' ' ' LEU . . . . . 0.594 ' CD2' HG22 ' A' ' 13' ' ' VAL . 85.2 mt -132.95 149.03 52.27 Favored 'General case' 0 N--CA 1.496 1.833 0 O-C-N 121.708 -0.62 . . . . 0.0 110.563 -178.973 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 6.6 ptm180 -151.52 136.05 16.99 Favored 'General case' 0 N--CA 1.497 1.88 0 O-C-N 121.784 -0.573 . . . . 0.0 109.893 175.262 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 57' ' ' ILE . . . . . 0.457 ' HA ' HG12 ' A' ' 11' ' ' VAL . 68.7 mt -84.42 133.18 29.84 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.893 0 O-C-N 121.424 -0.798 . . . . 0.0 109.876 175.841 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 58' ' ' LEU . . . . . 0.565 HD11 ' HB2' ' A' ' 12' ' ' GLU . 32.3 mt -84.7 141.89 39.04 Favored Pre-proline 0 N--CA 1.497 1.909 0 O-C-N 121.581 -0.7 . . . . 0.0 110.01 179.619 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 50.6 Cg_endo -74.78 65.84 5.84 Favored 'Trans proline' 0 N--CA 1.486 1.064 0 O-C-N 123.495 1.261 . . . . 0.0 110.229 179.188 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 39.4 tttp -93.8 -63.1 1.24 Allowed 'General case' 0 N--CA 1.496 1.827 0 O-C-N 121.498 -0.751 . . . . 0.0 110.274 -178.898 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 16.8 t-20 -115.94 120.06 37.94 Favored 'General case' 0 N--CA 1.495 1.793 0 O-C-N 121.647 -0.658 . . . . 0.0 110.219 -178.755 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 78.8 mt-10 -108.53 139.51 43.19 Favored 'General case' 0 N--CA 1.495 1.803 0 O-C-N 121.744 -0.598 . . . . 0.0 110.097 178.819 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 81.9 mt -120.44 130.08 74.84 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.924 0 O-C-N 121.592 -0.692 . . . . 0.0 109.747 -179.761 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 64' ' ' MET . . . . . . . . . . . . . 35.9 ttm 51.75 89.3 0.1 Allowed Pre-proline 0 N--CA 1.505 2.291 0 O-C-N 121.68 -0.637 . . . . 0.0 111.103 179.586 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 22.1 Cg_exo -61.37 -31.48 88.67 Favored 'Trans proline' 0 N--CA 1.491 1.347 0 O-C-N 123.511 1.269 . . . . 0.0 110.701 179.166 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 8.7 tttm 53.35 -163.06 0.1 Allowed 'General case' 0 N--CA 1.507 2.398 0 O-C-N 121.573 -0.705 . . . . 0.0 110.616 179.429 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 89.3 m-20 53.16 39.1 29.09 Favored 'General case' 0 N--CA 1.506 2.346 0 O-C-N 121.502 -0.749 . . . . 0.0 110.901 179.618 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . -75.98 141.98 27.93 Favored Glycine 0 N--CA 1.494 2.507 0 N-CA-C 109.481 -1.447 . . . . 0.0 109.481 179.382 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 24.5 m -124.69 132.4 53.4 Favored 'General case' 0 N--CA 1.495 1.787 0 O-C-N 121.695 -0.885 . . . . 0.0 110.218 -179.842 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 55.0 mtmt -96.74 -33.01 11.86 Favored 'General case' 0 N--CA 1.495 1.823 0 O-C-N 121.65 -0.656 . . . . 0.0 110.253 178.855 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 3.9 m 60.12 159.55 0.11 Allowed Pre-proline 0 N--CA 1.507 2.412 0 O-C-N 121.694 -0.629 . . . . 0.0 110.932 -178.974 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 30.8 Cg_endo -68.45 173.23 10.06 Favored 'Trans proline' 0 N--CA 1.488 1.159 0 O-C-N 123.543 1.286 . . . . 0.0 110.378 179.232 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 30.0 t -97.06 144.93 26.46 Favored 'General case' 0 N--CA 1.495 1.776 0 O-C-N 121.734 -0.604 . . . . 0.0 110.218 179.874 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 23.6 m -117.85 144.92 44.97 Favored 'General case' 0 N--CA 1.495 1.802 0 O-C-N 121.629 -0.67 . . . . 0.0 110.135 -179.522 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 41.6 t-20 -62.72 -34.86 78.04 Favored 'General case' 0 N--CA 1.501 2.12 0 O-C-N 121.678 -0.639 . . . . 0.0 110.602 -178.407 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 22.6 t -63.34 -33.51 75.68 Favored 'General case' 0 N--CA 1.501 2.088 0 O-C-N 121.634 -0.666 . . . . 0.0 110.377 179.943 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 40.3 p -106.67 31.59 5.15 Favored 'General case' 0 N--CA 1.495 1.808 0 O-C-N 121.712 -0.618 . . . . 0.0 110.322 179.009 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 18.8 tptm -62.11 -38.68 89.84 Favored 'General case' 0 N--CA 1.502 2.139 0 O-C-N 121.59 -0.694 . . . . 0.0 110.332 -179.402 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 15.2 tp -112.86 129.24 56.52 Favored 'General case' 0 N--CA 1.495 1.802 0 O-C-N 121.736 -0.603 . . . . 0.0 110.086 178.945 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 49.3 mttp -94.86 148.4 22.34 Favored 'General case' 0 N--CA 1.495 1.785 0 O-C-N 121.668 -0.645 . . . . 0.0 110.276 -179.991 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 85.5 p -77.76 165.03 24.7 Favored 'General case' 0 N--CA 1.498 1.93 0 O-C-N 121.724 -0.61 . . . . 0.0 110.198 -179.777 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -97.73 142.66 29.24 Favored 'General case' 0 N--CA 1.495 1.796 0 O-C-N 121.652 -0.655 . . . . 0.0 110.256 -179.885 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 13.4 pt-20 -64.93 -30.59 71.59 Favored 'General case' 0 N--CA 1.501 2.101 0 O-C-N 121.687 -0.633 . . . . 0.0 110.681 -179.612 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 24.6 m -112.75 139.99 47.9 Favored 'General case' 0 N--CA 1.496 1.84 0 O-C-N 121.626 -0.671 . . . . 0.0 110.169 -179.854 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 59.4 t80 -121.81 140.18 52.68 Favored 'General case' 0 N--CA 1.496 1.827 0 O-C-N 121.703 -0.623 . . . . 0.0 110.123 179.803 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 92.2 p -116.73 157.92 24.69 Favored 'General case' 0 N--CA 1.495 1.784 0 O-C-N 121.609 -0.682 . . . . 0.0 110.246 -179.575 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 22.7 t -63.86 -33.44 75.69 Favored 'General case' 0 N--CA 1.501 2.084 0 O-C-N 121.652 -0.655 . . . . 0.0 110.437 -179.923 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 59.2 mttm -95.23 137.33 34.43 Favored 'General case' 0 N--CA 1.495 1.822 0 O-C-N 121.668 -0.645 . . . . 0.0 110.148 179.232 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 91.2 m-20 -108.79 122.16 46.57 Favored 'General case' 0 N--CA 1.496 1.866 0 O-C-N 121.709 -0.62 . . . . 0.0 110.189 -179.775 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 53.5 mttm -128.71 127.98 43.16 Favored 'General case' 0 N--CA 1.495 1.808 0 O-C-N 121.72 -0.613 . . . . 0.0 110.179 179.377 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 91' ' ' TRP . . . . . . . . . . . . . 74.5 t-105 -161.8 -61.08 0.05 OUTLIER 'General case' 0 N--CA 1.496 1.827 0 O-C-N 121.723 -0.611 . . . . 0.0 110.166 179.641 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 50.0 m -125.02 150.85 46.32 Favored 'General case' 0 N--CA 1.496 1.835 0 O-C-N 121.674 -0.641 . . . . 0.0 110.148 -179.846 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 93' ' ' MET . . . . . . . . . . . . . 74.2 mtm -64.61 -34.8 79.12 Favored 'General case' 0 N--CA 1.5 2.064 0 O-C-N 121.668 -0.645 . . . . 0.0 110.372 179.846 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 20.0 t70 . . . . . 0 N--CA 1.495 1.777 0 CA-C-O 118.026 -0.988 . . . . 0.0 110.148 179.913 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' B' B ' 240' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.286 0 N-CA-C 109.541 -1.423 . . . . 0.0 109.541 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' B' B ' 241' ' ' ALA . . . . . . . . . . . . . . . -144.13 153.73 42.44 Favored 'General case' 0 N--CA 1.495 1.807 0 O-C-N 121.71 -0.876 . . . . 0.0 110.192 179.975 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 242' ' ' THR . . . . . . . . . . . . . 40.2 p -124.28 161.47 25.77 Favored 'General case' 0 N--CA 1.496 1.828 0 O-C-N 121.69 -0.631 . . . . 0.0 110.209 179.978 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 243' ' ' THR . . . . . 0.467 HG22 ' O ' ' B' ' 243' ' ' THR . 18.9 m -107.45 30.92 5.81 Favored 'General case' 0 N--CA 1.496 1.852 0 O-C-N 121.67 -0.644 . . . . 0.0 110.364 179.943 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 244' ' ' LYS . . . . . . . . . . . . . 64.4 tttt -129.96 138.31 50.79 Favored 'General case' 0 N--CA 1.495 1.794 0 O-C-N 121.604 -0.685 . . . . 0.0 110.134 -179.724 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 245' ' ' GLU . . . . . . . . . . . . . 46.3 mt-10 -95.51 137.48 34.51 Favored 'General case' 0 N--CA 1.495 1.812 0 O-C-N 121.702 -0.624 . . . . 0.0 110.268 -179.576 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 246' ' ' LYS . . . . . . . . . . . . . 37.5 ttpt -65.87 -35.89 81.89 Favored 'General case' 0 N--CA 1.5 2.051 0 O-C-N 121.702 -0.624 . . . . 0.0 110.311 179.771 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 247' ' ' ASN . . . . . . . . . . . . . 91.8 m-20 -98.85 157.62 16.18 Favored 'General case' 0 N--CA 1.495 1.81 0 O-C-N 121.745 -0.597 . . . . 0.0 110.265 -178.869 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 248' ' ' ILE . . . . . . . . . . . . . 17.9 tt -161.57 165.33 0.73 Allowed 'Isoleucine or valine' 0 N--CA 1.496 1.873 0 O-C-N 121.75 -0.594 . . . . 0.0 110.005 -179.934 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 249' ' ' SER . . . . . 0.424 ' C ' HG23 ' B' ' 250' ' ' VAL . 33.1 m -113.85 139.46 49.15 Favored 'General case' 0 N--CA 1.496 1.827 0 O-C-N 121.691 -0.631 . . . . 0.0 110.262 -179.28 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 250' ' ' VAL . . . . . 0.424 HG23 ' C ' ' B' ' 249' ' ' SER . 91.3 t -149.65 141.36 17.31 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.951 0 O-C-N 121.671 -0.643 . . . . 0.0 109.382 179.797 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 251' ' ' ASP . . . . . . . . . . . . . 2.3 t0 52.88 -157.84 0.15 Allowed 'General case' 0 N--CA 1.506 2.355 0 O-C-N 121.555 -0.716 . . . . 0.0 110.772 179.253 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 252' ' ' VAL . . . . . . . . . . . . . 48.7 t 54.74 95.36 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.507 2.407 0 O-C-N 121.392 -0.817 . . . . 0.0 110.488 -179.733 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 253' ' ' ASP . . . . . . . . . . . . . 74.5 m-20 52.66 47.41 24.74 Favored 'General case' 0 N--CA 1.505 2.289 0 O-C-N 121.691 -0.631 . . . . 0.0 111.05 179.578 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 254' ' ' ALA . . . . . . . . . . . . . . . -68.43 -38.23 80.99 Favored 'General case' 0 N--CA 1.499 2.013 0 O-C-N 121.701 -0.624 . . . . 0.0 110.153 178.708 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 255' ' ' ASP . . . . . . . . . . . . . 16.5 t70 -74.13 -27.94 61.1 Favored 'General case' 0 N--CA 1.499 1.989 0 O-C-N 121.784 -0.572 . . . . 0.0 110.663 -179.431 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 256' ' ' ALA . . . . . . . . . . . . . . . -62.67 -44.29 96.65 Favored 'General case' 0 N--CA 1.501 2.116 0 O-C-N 121.48 -0.763 . . . . 0.0 110.568 -177.577 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 257' ' ' SER . . . . . . . . . . . . . 24.3 m -55.78 -37.64 68.83 Favored 'General case' 0 N--CA 1.503 2.213 0 O-C-N 121.596 -0.69 . . . . 0.0 110.389 178.1 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 258' ' ' SER . . . . . . . . . . . . . 24.0 m -69.56 -32.75 71.72 Favored 'General case' 0 N--CA 1.498 1.934 0 C-N-CA 120.501 -0.48 . . . . 0.0 110.252 179.189 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 259' ' ' GLN . . . . . . . . . . . . . 48.4 tt0 -63.05 -37.85 88.82 Favored 'General case' 0 N--CA 1.501 2.085 0 O-C-N 121.66 -0.65 . . . . 0.0 110.494 -179.248 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 260' ' ' LEU . . . . . . . . . . . . . 84.5 mt -67.47 -42.68 82.61 Favored 'General case' 0 N--CA 1.499 2.01 0 O-C-N 121.611 -0.681 . . . . 0.0 110.154 179.69 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 261' ' ' LEU . . . . . . . . . . . . . 23.1 tp -69.65 -35.87 75.57 Favored 'General case' 0 N--CA 1.497 1.913 0 O-C-N 121.665 -0.647 . . . . 0.0 109.743 175.802 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 262' ' ' SER . . . . . . . . . . . . . 22.8 t -62.72 -38.29 89.89 Favored 'General case' 0 N--CA 1.5 2.074 0 O-C-N 121.743 -0.598 . . . . 0.0 110.634 178.013 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 263' ' ' LEU . . . . . . . . . . . . . 34.9 mt -64.99 -43.51 92.35 Favored 'General case' 0 N--CA 1.501 2.123 0 O-C-N 121.673 -0.642 . . . . 0.0 110.221 -179.306 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 264' ' ' LEU . . . . . 0.451 ' CD1' HD11 ' A' ' 55' ' ' LEU . 84.0 mt -62.61 -32.7 73.76 Favored 'General case' 0 N--CA 1.502 2.159 0 O-C-N 121.734 -0.604 . . . . 0.0 110.67 178.137 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 265' ' ' LYS . . . . . . . . . . . . . 54.2 tttm -74.61 -33.94 62.72 Favored 'General case' 0 N--CA 1.498 1.962 0 O-C-N 121.665 -0.647 . . . . 0.0 110.187 -178.136 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 266' ' ' SER . . . . . . . . . . . . . 53.1 m -78.51 143.31 36.72 Favored 'General case' 0 N--CA 1.498 1.933 0 O-C-N 121.687 -0.633 . . . . 0.0 110.194 -179.755 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 267' ' ' SER . . . . . . . . . . . . . 87.3 p -153.5 165.09 36.94 Favored 'General case' 0 N--CA 1.495 1.775 0 O-C-N 121.709 -0.619 . . . . 0.0 110.229 -179.869 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 268' ' ' THR . . . . . . . . . . . . . 40.1 p -124.14 158.33 32.58 Favored 'General case' 0 N--CA 1.496 1.873 0 O-C-N 121.664 -0.647 . . . . 0.0 110.144 179.463 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 269' ' ' ALA . . . . . . . . . . . . . . . 48.09 85.58 0.17 Allowed Pre-proline 0 N--CA 1.506 2.357 0 O-C-N 121.778 -0.576 . . . . 0.0 111.346 -178.689 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 270' ' ' PRO . . . . . . . . . . . . . 28.1 Cg_endo -67.11 145.12 72.05 Favored 'Trans proline' 0 N--CA 1.489 1.207 0 O-C-N 123.588 1.309 . . . . 0.0 110.418 179.819 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 271' ' ' SER . . . . . . . . . . . . . 95.4 p -132.27 156.32 46.74 Favored 'General case' 0 N--CA 1.495 1.806 0 O-C-N 121.612 -0.68 . . . . 0.0 110.185 179.551 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 272' ' ' ASP . . . . . . . . . . . . . 26.4 t0 -129.4 108.94 10.67 Favored 'General case' 0 N--CA 1.496 1.843 0 O-C-N 121.707 -0.62 . . . . 0.0 110.211 -179.883 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 273' ' ' LEU . . . . . . . . . . . . . 20.3 tp 51.43 88.25 0.03 OUTLIER 'General case' 0 N--CA 1.506 2.345 0 O-C-N 121.643 -0.661 . . . . 0.0 111.103 179.874 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 274' ' ' ALA . . . . . . . . . . . . . . . 49.9 -165.79 0.03 OUTLIER 'General case' 0 N--CA 1.506 2.37 0 O-C-N 121.649 -0.657 . . . . 0.0 111.244 -179.81 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 275' ' ' THR . . . . . 0.461 HG22 ' O ' ' B' ' 277' ' ' GLN . 26.0 m -114.54 87.76 14.74 Favored Pre-proline 0 N--CA 1.495 1.815 0 O-C-N 121.687 -0.633 . . . . 0.0 110.073 179.848 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 276' ' ' PRO . . . . . . . . . . . . . 25.7 Cg_endo -66.25 -32.28 42.41 Favored 'Trans proline' 0 N--CA 1.49 1.275 0 O-C-N 123.54 1.284 . . . . 0.0 110.6 -178.764 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 277' ' ' GLN . . . . . 0.461 ' O ' HG22 ' B' ' 275' ' ' THR . 40.7 mm-40 -116.58 155.21 49.02 Favored Pre-proline 0 N--CA 1.495 1.806 0 O-C-N 121.603 -0.686 . . . . 0.0 110.238 -179.469 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 278' ' ' PRO . . . . . . . . . . . . . 29.3 Cg_endo -67.83 146.11 71.02 Favored 'Trans proline' 0 N--CA 1.488 1.198 0 O-C-N 123.686 1.361 . . . . 0.0 110.379 -179.58 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 279' ' ' SER . . . . . . . . . . . . . 89.2 p -66.74 -30.44 70.67 Favored 'General case' 0 N--CA 1.5 2.036 0 O-C-N 121.634 -0.666 . . . . 0.0 110.486 179.115 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 280' ' ' THR . . . . . . . . . . . . . 23.3 m -92.98 146.18 23.82 Favored 'General case' 0 N--CA 1.496 1.851 0 O-C-N 121.599 -0.688 . . . . 0.0 110.14 179.774 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 281' ' ' PHE . . . . . . . . . . . . . 63.2 m-85 -116.49 92.49 37.21 Favored Pre-proline 0 N--CA 1.495 1.787 0 O-C-N 121.653 -0.654 . . . . 0.0 110.24 -179.62 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 282' ' ' PRO . . . . . . . . . . . . . 23.6 Cg_exo -60.54 -30.0 89.75 Favored 'Trans proline' 0 N--CA 1.491 1.326 0 O-C-N 123.446 1.235 . . . . 0.0 110.85 179.601 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 283' ' ' GLN . . . . . . . . . . . . . 13.1 mm100 -87.27 160.62 48.19 Favored Pre-proline 0 N--CA 1.496 1.85 0 O-C-N 121.647 -0.658 . . . . 0.0 110.134 179.282 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 284' ' ' PRO . . . . . . . . . . . . . 28.5 Cg_endo -67.56 153.73 75.53 Favored 'Trans proline' 0 N--CA 1.487 1.128 0 O-C-N 123.685 1.361 . . . . 0.0 110.39 -179.235 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 285' ' ' PRO . . . . . . . . . . . . . 29.4 Cg_endo -67.77 153.06 76.78 Favored 'Trans proline' 0 N--CA 1.488 1.184 0 O-C-N 123.645 1.339 . . . . 0.0 110.391 -179.653 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 286' ' ' VAL . . . . . . . . . . . . . 61.0 t -107.81 135.41 46.56 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.897 0 O-C-N 121.658 -0.651 . . . . 0.0 109.674 179.534 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 287' ' ' GLU . . . . . . . . . . . . . 78.5 mt-10 -103.57 151.35 23.0 Favored 'General case' 0 N--CA 1.495 1.792 0 O-C-N 121.717 -0.614 . . . . 0.0 110.27 -179.249 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 288' ' ' SER . . . . . . . . . . . . . 28.6 t -120.95 146.37 46.73 Favored 'General case' 0 N--CA 1.495 1.796 0 O-C-N 121.659 -0.651 . . . . 0.0 110.194 179.861 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 289' ' ' HIS . . . . . . . . . . . . . 77.1 m80 -64.02 -35.15 79.77 Favored 'General case' 0 N--CA 1.501 2.088 0 O-C-N 121.658 -0.651 . . . . 0.0 110.443 -179.811 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 290' ' ' SER . . . . . . . . . . . . . 89.3 p -125.97 155.28 41.63 Favored 'General case' 0 N--CA 1.495 1.807 0 O-C-N 121.697 -0.627 . . . . 0.0 110.153 179.824 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 291' ' ' SER . . . . . . . . . . . . . 44.9 m . . . . . 0 N--CA 1.494 1.749 0 CA-C-O 117.96 -1.019 . . . . 0.0 110.225 179.985 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' -1' ' ' MET . . . . . . . . . . . . . 60.6 mtt . . . . . 0 N--CA 1.493 1.679 0 CA-C-O 120.985 0.421 . . . . 0.0 110.139 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 0' ' ' GLY . . . . . . . . . . . . . . . -84.6 -175.25 50.69 Favored Glycine 0 N--CA 1.493 2.494 0 N-CA-C 109.535 -1.426 . . . . 0.0 109.535 179.923 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 65.9 mtt -97.78 141.56 30.63 Favored 'General case' 0 N--CA 1.494 1.759 0 O-C-N 121.691 -0.888 . . . . 0.0 110.217 179.983 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 70.8 m -101.09 164.86 11.6 Favored 'General case' 0 N--CA 1.494 1.755 0 O-C-N 121.743 -0.598 . . . . 0.0 110.057 -179.631 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 3' ' ' VAL . . . . . 0.45 HG12 ' CE1' ' A' ' 7' ' ' TYR . 67.1 t -66.69 -27.92 41.56 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.084 0 O-C-N 121.652 -0.655 . . . . 0.0 110.086 179.474 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -55.02 -30.46 59.56 Favored 'General case' 0 N--CA 1.505 2.289 0 O-C-N 121.451 -0.781 . . . . 0.0 110.395 -179.523 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 74.4 m-20 -68.46 -31.15 70.25 Favored 'General case' 0 N--CA 1.499 1.99 0 O-C-N 121.802 -0.561 . . . . 0.0 110.186 174.676 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 96.1 m-85 -96.02 10.07 38.67 Favored 'General case' 0 N--CA 1.498 1.948 0 O-C-N 121.712 -0.618 . . . . 0.0 111.469 -178.755 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 7' ' ' TYR . . . . . 0.45 ' CE1' HG12 ' A' ' 3' ' ' VAL . 3.6 m-30 -67.19 140.28 57.46 Favored 'General case' 0 N--CA 1.503 2.178 0 O-C-N 121.153 -0.967 . . . . 0.0 110.102 174.647 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 8' ' ' GLY . . . . . 0.424 ' O ' HG13 ' A' ' 24' ' ' VAL . . . 82.33 0.05 89.43 Favored Glycine 0 N--CA 1.497 2.727 0 N-CA-C 110.574 -1.01 . . . . 0.0 110.574 -175.982 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 30.2 t -77.41 134.91 38.3 Favored 'General case' 0 N--CA 1.497 1.912 0 O-C-N 121.129 -1.218 . . . . 0.0 110.492 179.208 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 11.8 t-20 -83.23 118.73 23.83 Favored 'General case' 0 N--CA 1.497 1.889 0 O-C-N 121.625 -0.672 . . . . 0.0 109.596 173.063 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 11' ' ' VAL . . . . . 0.538 HG12 ' HA ' ' A' ' 57' ' ' ILE . 35.6 m -142.45 161.68 19.04 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.678 0 O-C-N 121.674 -0.641 . . . . 0.0 109.741 -177.381 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 12' ' ' GLU . . . . . 0.525 ' HB2' HD11 ' A' ' 58' ' ' LEU . 46.7 tt0 -109.32 147.41 32.74 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.684 -0.635 . . . . 0.0 109.632 177.103 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 13' ' ' VAL . . . . . 0.594 ' CG1' HG23 ' A' ' 52' ' ' ILE . 60.9 t -137.14 126.41 36.43 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.743 0 O-C-N 121.621 -0.674 . . . . 0.0 109.709 -175.36 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.442 HD13 ' HG2' ' A' ' 20' ' ' LYS . 23.7 tp -95.89 129.79 43.04 Favored 'General case' 0 N--CA 1.492 1.646 0 N-CA-C 109.432 -0.581 . . . . 0.0 109.432 176.525 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.503 HD23 ' HA ' ' A' ' 52' ' ' ILE . 82.3 mt -90.6 170.14 10.42 Favored 'General case' 0 N--CA 1.496 1.857 0 O-C-N 121.657 -0.652 . . . . 0.0 110.565 -175.53 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 23.9 p30 -56.8 -22.95 39.98 Favored 'General case' 0 N--CA 1.506 2.351 0 O-C-N 121.751 -0.593 . . . . 0.0 111.51 -177.799 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 53.6 p-10 -94.2 24.15 4.58 Favored 'General case' 0 N--CA 1.497 1.89 0 O-C-N 121.535 -0.728 . . . . 0.0 110.733 -177.714 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 10.4 m-20 59.41 28.43 17.8 Favored 'General case' 0 N--CA 1.506 2.346 0 O-C-N 121.446 -0.783 . . . . 0.0 110.607 175.721 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 50.3 m -103.87 144.83 30.98 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.437 -0.789 . . . . 0.0 109.659 172.359 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 20' ' ' LYS . . . . . 0.442 ' HG2' HD13 ' A' ' 14' ' ' LEU . 97.2 mttt -109.57 145.07 36.99 Favored 'General case' 0 N--CA 1.495 1.791 0 O-C-N 121.543 -0.723 . . . . 0.0 110.665 -176.166 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -153.05 133.4 13.58 Favored 'General case' 0 N--CA 1.496 1.86 0 O-C-N 121.713 -0.617 . . . . 0.0 110.229 176.359 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 22' ' ' ARG . . . . . 0.488 ' O ' HD13 ' A' ' 39' ' ' LEU . 35.1 ptt180 -128.48 144.78 51.2 Favored 'General case' 0 N--CA 1.498 1.957 0 O-C-N 121.685 -0.634 . . . . 0.0 110.39 -178.009 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -171.78 171.43 44.1 Favored Glycine 0 N--CA 1.496 2.635 0 N-CA-C 109.229 -1.548 . . . . 0.0 109.229 -175.36 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 24' ' ' VAL . . . . . 0.424 HG13 ' O ' ' A' ' 8' ' ' GLY . 47.4 t -94.59 119.11 42.11 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.986 0 O-C-N 121.609 -0.936 . . . . 0.0 109.355 -176.968 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 25' ' ' ILE . . . . . 0.423 ' HA ' HD23 ' A' ' 37' ' ' LEU . 89.7 mt -64.29 143.57 15.57 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.163 0 O-C-N 121.704 -0.623 . . . . 0.0 110.56 -171.381 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 26' ' ' THR . . . . . 0.584 HG21 ' HB2' ' A' ' 38' ' ' ARG . 10.1 p -121.24 -25.89 5.17 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.773 -0.58 . . . . 0.0 111.237 178.246 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 2.0 t-20 -162.28 158.07 23.76 Favored 'General case' 0 N--CA 1.501 2.121 0 O-C-N 121.0 -1.063 . . . . 0.0 111.774 -179.08 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 28' ' ' PHE . . . . . 0.568 ' HE1' HG21 ' A' ' 49' ' ' THR . 91.2 t80 -150.16 124.29 9.43 Favored 'General case' 0 N--CA 1.5 2.056 0 N-CA-C 109.361 -0.607 . . . . 0.0 109.361 171.428 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 29' ' ' ASP . . . . . 0.402 ' O ' ' N ' ' A' ' 33' ' ' SER . 21.7 t70 -98.12 126.27 43.49 Favored 'General case' 0 N--CA 1.492 1.658 0 N-CA-C 109.091 -0.707 . . . . 0.0 109.091 -179.296 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 87.0 p -65.16 -43.03 93.1 Favored 'General case' 0 N--CA 1.5 2.07 0 O-C-N 121.65 -0.656 . . . . 0.0 110.778 -174.143 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 19.6 m -60.21 -48.05 83.37 Favored 'General case' 0 N--CA 1.503 2.196 0 O-C-N 121.522 -0.736 . . . . 0.0 110.884 -173.573 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 91.7 m-20 -107.07 -0.05 23.18 Favored 'General case' 0 N--CA 1.498 1.961 0 O-C-N 121.621 -0.675 . . . . 0.0 111.697 -179.258 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 33' ' ' SER . . . . . 0.402 ' N ' ' O ' ' A' ' 29' ' ' ASP . 38.8 p 45.71 67.08 0.79 Allowed 'General case' 0 N--CA 1.508 2.45 0 O-C-N 121.423 -0.798 . . . . 0.0 111.142 -174.754 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 34' ' ' ILE . . . . . 1.074 HD12 HG22 ' A' ' 48' ' ' VAL . 44.8 mm -114.5 125.79 71.89 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.981 0 O-C-N 121.553 -0.717 . . . . 0.0 109.222 -175.917 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 11.3 tp -115.84 120.52 39.53 Favored 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.633 -0.667 . . . . 0.0 110.53 -168.605 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 67.3 mt-30 -91.04 132.11 36.21 Favored 'General case' 0 N--CA 1.489 1.51 0 N-CA-C 109.201 -0.666 . . . . 0.0 109.201 171.952 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 0.423 HD23 ' HA ' ' A' ' 25' ' ' ILE . 16.7 mt -117.77 123.76 46.77 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.812 -0.555 . . . . 0.0 110.07 175.837 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 38' ' ' ARG . . . . . 0.584 ' HB2' HG21 ' A' ' 26' ' ' THR . 72.8 ttt180 -96.29 104.95 16.95 Favored 'General case' 0 N--CA 1.496 1.868 0 O-C-N 121.721 -0.612 . . . . 0.0 109.79 176.001 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.488 HD13 ' O ' ' A' ' 22' ' ' ARG . 18.4 tp -84.56 153.63 23.13 Favored 'General case' 0 N--CA 1.495 1.803 0 O-C-N 121.699 -0.626 . . . . 0.0 110.949 -173.602 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -67.46 -4.59 11.77 Favored 'General case' 0 N--CA 1.503 2.201 0 O-C-N 121.895 -0.503 . . . . 0.0 111.986 -171.753 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 30.1 m120 -87.1 27.62 1.01 Allowed 'General case' 0 N--CA 1.498 1.925 0 O-C-N 121.063 -1.023 . . . . 0.0 110.871 174.063 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 15.3 t0 63.13 29.28 16.16 Favored 'General case' 0 N--CA 1.505 2.286 0 O-C-N 121.079 -1.013 . . . . 0.0 110.521 175.848 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 48.7 m -125.65 137.85 53.89 Favored 'General case' 0 N--CA 1.495 1.818 0 O-C-N 121.357 -0.839 . . . . 0.0 110.528 -179.33 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 9.7 t -97.94 151.03 20.7 Favored 'General case' 0 N--CA 1.497 1.917 0 O-C-N 121.764 -0.585 . . . . 0.0 110.122 174.986 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 45' ' ' LYS . . . . . 0.426 ' CE ' HD11 ' A' ' 47' ' ' ILE . 42.1 tttp -148.96 119.09 7.21 Favored 'General case' 0 N--CA 1.496 1.84 0 O-C-N 121.562 -0.711 . . . . 0.0 110.384 179.049 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 90.3 p -96.46 120.34 36.6 Favored 'General case' 0 N--CA 1.495 1.805 0 O-C-N 121.712 -0.617 . . . . 0.0 110.286 179.271 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 47' ' ' ILE . . . . . 0.426 HD11 ' CE ' ' A' ' 45' ' ' LYS . 82.5 mt -129.42 138.89 53.16 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.908 0 O-C-N 121.712 -0.618 . . . . 0.0 109.343 179.251 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 48' ' ' VAL . . . . . 1.074 HG22 HD12 ' A' ' 34' ' ' ILE . 63.2 t -82.12 127.69 39.39 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.955 0 C-N-CA 120.001 -0.679 . . . . 0.0 109.207 178.54 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 49' ' ' THR . . . . . 0.568 HG21 ' HE1' ' A' ' 28' ' ' PHE . 41.9 p -59.34 -25.08 63.9 Favored 'General case' 0 N--CA 1.504 2.235 0 O-C-N 121.624 -0.672 . . . . 0.0 112.059 -169.449 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 60.0 tttt -57.58 -23.15 49.2 Favored 'General case' 0 N--CA 1.502 2.149 0 O-C-N 121.546 -0.721 . . . . 0.0 111.261 -175.524 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 10.3 p30 -81.17 -3.46 52.26 Favored 'General case' 0 N--CA 1.499 2.01 0 C-N-CA 119.702 -0.799 . . . . 0.0 111.058 176.078 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 52' ' ' ILE . . . . . 0.761 HG21 HD11 ' A' ' 55' ' ' LEU . 95.8 mt -79.79 135.28 25.84 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.021 0 O-C-N 121.265 -0.897 . . . . 0.0 110.219 177.926 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 83.6 tttt -92.08 -28.47 17.11 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.9 -0.5 . . . . 0.0 109.785 170.294 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 54' ' ' ASP . . . . . 0.402 ' HA ' HD13 ' B' ' 261' ' ' LEU . 1.6 m-20 -164.83 158.46 17.42 Favored 'General case' 0 N--CA 1.503 2.204 0 O-C-N 121.735 -0.603 . . . . 0.0 110.287 -177.012 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 55' ' ' LEU . . . . . 0.761 HD11 HG21 ' A' ' 52' ' ' ILE . 4.2 mp -132.93 153.64 51.21 Favored 'General case' 0 N--CA 1.497 1.893 0 O-C-N 121.74 -0.6 . . . . 0.0 110.411 178.227 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 20.1 ptp180 -151.87 146.39 25.63 Favored 'General case' 0 N--CA 1.496 1.863 0 O-C-N 121.719 -0.613 . . . . 0.0 109.964 175.549 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 57' ' ' ILE . . . . . 0.538 ' HA ' HG12 ' A' ' 11' ' ' VAL . 62.4 mt -85.54 133.32 29.78 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.956 0 O-C-N 121.559 -0.713 . . . . 0.0 109.87 173.732 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 58' ' ' LEU . . . . . 0.525 HD11 ' HB2' ' A' ' 12' ' ' GLU . 61.3 mt -83.03 146.87 52.76 Favored Pre-proline 0 N--CA 1.498 1.946 0 O-C-N 121.559 -0.713 . . . . 0.0 110.073 -177.971 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 36.9 Cg_endo -70.8 140.22 38.3 Favored 'Trans proline' 0 N--CA 1.487 1.121 0 O-C-N 123.49 1.258 . . . . 0.0 110.229 178.742 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 83.8 tttt -96.4 -63.56 1.13 Allowed 'General case' 0 N--CA 1.494 1.753 0 O-C-N 121.623 -0.673 . . . . 0.0 110.196 179.472 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 89.4 m-20 52.9 42.44 32.06 Favored 'General case' 0 N--CA 1.506 2.345 0 O-C-N 121.549 -0.72 . . . . 0.0 110.936 -179.65 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 76.2 mt-10 -108.49 162.63 13.94 Favored 'General case' 0 N--CA 1.496 1.827 0 O-C-N 121.625 -0.672 . . . . 0.0 110.297 179.695 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 82.9 mt -107.81 141.02 24.1 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.868 0 O-C-N 121.702 -0.624 . . . . 0.0 109.56 179.452 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 64' ' ' MET . . . . . . . . . . . . . 13.2 mmt 51.81 86.48 0.16 Allowed Pre-proline 0 N--CA 1.505 2.321 0 O-C-N 121.612 -0.68 . . . . 0.0 110.848 -178.671 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 26.7 Cg_endo -66.49 134.64 36.4 Favored 'Trans proline' 0 N--CA 1.49 1.273 0 O-C-N 123.628 1.33 . . . . 0.0 110.482 -178.438 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 55.4 mmtt -66.08 -35.39 80.4 Favored 'General case' 0 N--CA 1.5 2.056 0 O-C-N 121.625 -0.672 . . . . 0.0 110.201 179.167 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 15.7 t-20 -65.08 -34.01 77.39 Favored 'General case' 0 N--CA 1.5 2.035 0 O-C-N 121.634 -0.666 . . . . 0.0 110.429 179.724 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 89.36 -163.72 31.54 Favored Glycine 0 N--CA 1.493 2.489 0 N-CA-C 109.465 -1.454 . . . . 0.0 109.465 -179.456 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 24.4 m -115.77 139.78 49.84 Favored 'General case' 0 N--CA 1.496 1.835 0 O-C-N 121.642 -0.917 . . . . 0.0 110.16 -179.5 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 98.4 mttt -101.06 155.93 17.71 Favored 'General case' 0 N--CA 1.495 1.81 0 O-C-N 121.69 -0.631 . . . . 0.0 110.225 -179.674 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 92.7 p -80.87 159.65 68.23 Favored Pre-proline 0 N--CA 1.497 1.912 0 O-C-N 121.677 -0.64 . . . . 0.0 110.015 178.622 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 20.7 Cg_endo -65.53 -57.07 0.28 Allowed 'Trans proline' 0 N--CA 1.489 1.206 0 O-C-N 123.599 1.315 . . . . 0.0 110.507 -179.377 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 70.1 m -135.69 131.53 35.78 Favored 'General case' 0 N--CA 1.496 1.827 0 O-C-N 121.747 -0.596 . . . . 0.0 110.251 179.085 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 24.3 m -78.97 -34.64 44.05 Favored 'General case' 0 N--CA 1.498 1.97 0 O-C-N 121.683 -0.636 . . . . 0.0 110.078 178.34 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 30.6 m120 56.08 168.85 0.03 OUTLIER 'General case' 0 N--CA 1.507 2.399 0 CA-C-O 121.277 0.56 . . . . 0.0 111.249 -179.086 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 32.7 t -160.97 157.37 26.24 Favored 'General case' 0 N--CA 1.495 1.777 0 O-C-N 121.589 -0.695 . . . . 0.0 110.225 -179.877 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 38.9 p -120.23 145.64 46.83 Favored 'General case' 0 N--CA 1.496 1.86 0 O-C-N 121.703 -0.623 . . . . 0.0 110.111 179.18 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 59.1 mttm -140.62 155.86 46.43 Favored 'General case' 0 N--CA 1.496 1.837 0 O-C-N 121.724 -0.61 . . . . 0.0 110.264 -179.982 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 82.6 mt -67.17 -33.32 75.16 Favored 'General case' 0 N--CA 1.499 2.002 0 O-C-N 121.654 -0.654 . . . . 0.0 110.353 179.089 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 35.1 ttmt -64.01 -42.58 97.1 Favored 'General case' 0 N--CA 1.502 2.152 0 O-C-N 121.673 -0.642 . . . . 0.0 110.532 -179.392 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 89.5 p -148.05 157.53 43.57 Favored 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.705 -0.622 . . . . 0.0 110.344 -179.793 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -146.13 155.86 43.03 Favored 'General case' 0 N--CA 1.495 1.776 0 O-C-N 121.728 -0.607 . . . . 0.0 110.17 -179.946 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 30.4 tp10 -100.75 132.34 46.2 Favored 'General case' 0 N--CA 1.494 1.767 0 O-C-N 121.725 -0.61 . . . . 0.0 110.142 179.92 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 25.0 m -128.09 139.98 52.21 Favored 'General case' 0 N--CA 1.495 1.786 0 O-C-N 121.723 -0.611 . . . . 0.0 110.097 179.618 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 69.7 t80 -111.54 122.17 47.12 Favored 'General case' 0 N--CA 1.495 1.792 0 O-C-N 121.683 -0.636 . . . . 0.0 110.219 179.733 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 88.8 p -151.99 159.16 43.82 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.741 -0.599 . . . . 0.0 110.154 179.685 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 92.3 p -146.96 156.29 42.94 Favored 'General case' 0 N--CA 1.494 1.758 0 O-C-N 121.616 -0.677 . . . . 0.0 110.265 179.569 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 4.3 mmpt? -124.68 124.21 41.69 Favored 'General case' 0 N--CA 1.495 1.81 0 O-C-N 121.6 -0.688 . . . . 0.0 110.126 179.296 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 91.1 m-20 -67.8 -36.59 80.69 Favored 'General case' 0 N--CA 1.5 2.04 0 O-C-N 121.696 -0.627 . . . . 0.0 110.188 179.429 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 30.6 mtmm -66.44 -34.54 78.17 Favored 'General case' 0 N--CA 1.5 2.061 0 O-C-N 121.683 -0.636 . . . . 0.0 110.44 -179.956 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 91' ' ' TRP . . . . . . . . . . . . . 71.6 t-105 -64.03 -36.43 83.98 Favored 'General case' 0 N--CA 1.502 2.136 0 O-C-N 121.607 -0.683 . . . . 0.0 110.538 -178.386 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 96.9 p -108.42 155.21 20.82 Favored 'General case' 0 N--CA 1.496 1.829 0 O-C-N 121.686 -0.634 . . . . 0.0 110.274 -178.838 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 93' ' ' MET . . . . . . . . . . . . . 74.4 mtm -122.19 156.03 34.57 Favored 'General case' 0 N--CA 1.495 1.804 0 O-C-N 121.677 -0.639 . . . . 0.0 110.195 -179.988 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 26.3 t0 . . . . . 0 N--CA 1.495 1.812 0 CA-C-O 118.039 -0.982 . . . . 0.0 110.145 179.973 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' B' B ' 240' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.336 0 N-CA-C 109.502 -1.439 . . . . 0.0 109.502 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' B' B ' 241' ' ' ALA . . . . . . . . . . . . . . . 53.29 32.68 14.01 Favored 'General case' 0 N--CA 1.506 2.356 0 O-C-N 121.554 -0.968 . . . . 0.0 110.954 179.82 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 242' ' ' THR . . . . . . . . . . . . . 42.7 p -68.2 -34.0 75.46 Favored 'General case' 0 N--CA 1.499 2.0 0 O-C-N 121.565 -0.709 . . . . 0.0 110.215 -179.782 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 243' ' ' THR . . . . . . . . . . . . . 40.5 p -126.3 159.62 32.62 Favored 'General case' 0 N--CA 1.497 1.896 0 O-C-N 121.707 -0.621 . . . . 0.0 110.205 179.52 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 244' ' ' LYS . . . . . . . . . . . . . 47.6 pttt -67.2 140.86 57.46 Favored 'General case' 0 N--CA 1.499 2.007 0 O-C-N 121.683 -0.636 . . . . 0.0 110.426 179.354 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 245' ' ' GLU . . . . . . . . . . . . . 50.6 mt-10 -99.01 28.09 4.62 Favored 'General case' 0 N--CA 1.496 1.834 0 O-C-N 121.66 -0.65 . . . . 0.0 110.565 -179.9 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 246' ' ' LYS . . . . . . . . . . . . . 62.4 mttm -65.05 -33.31 75.73 Favored 'General case' 0 N--CA 1.501 2.075 0 O-C-N 121.511 -0.743 . . . . 0.0 110.427 -179.757 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 247' ' ' ASN . . . . . . . . . . . . . 65.7 t30 -92.98 153.74 18.57 Favored 'General case' 0 N--CA 1.495 1.784 0 O-C-N 121.726 -0.609 . . . . 0.0 110.17 179.99 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 248' ' ' ILE . . . . . . . . . . . . . 82.4 mt -76.6 -33.15 21.9 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.042 0 O-C-N 121.695 -0.628 . . . . 0.0 109.792 -179.204 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 249' ' ' SER . . . . . 0.417 ' C ' HG13 ' B' ' 250' ' ' VAL . 96.9 p -109.52 141.66 41.67 Favored 'General case' 0 N--CA 1.495 1.799 0 O-C-N 121.599 -0.688 . . . . 0.0 110.193 179.677 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 250' ' ' VAL . . . . . 0.417 HG13 ' C ' ' B' ' 249' ' ' SER . 30.6 m -150.48 159.74 4.63 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.958 0 O-C-N 121.66 -0.65 . . . . 0.0 109.977 -179.994 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 251' ' ' ASP . . . . . . . . . . . . . 74.3 m-20 56.55 -81.96 0.01 OUTLIER 'General case' 0 N--CA 1.507 2.386 0 O-C-N 121.972 -0.455 . . . . 0.0 111.332 -179.066 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 252' ' ' VAL . . . . . . . . . . . . . 51.4 t 53.46 95.99 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.508 2.446 0 O-C-N 121.149 -0.969 . . . . 0.0 110.512 -178.33 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 253' ' ' ASP . . . . . . . . . . . . . 12.5 p-10 -161.56 -168.45 1.99 Allowed 'General case' 0 N--CA 1.496 1.862 0 O-C-N 121.644 -0.66 . . . . 0.0 110.384 -179.01 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 254' ' ' ALA . . . . . . . . . . . . . . . -65.42 -29.74 70.46 Favored 'General case' 0 N--CA 1.5 2.069 0 O-C-N 121.778 -0.577 . . . . 0.0 110.827 -176.926 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 255' ' ' ASP . . . . . . . . . . . . . 74.5 m-20 -72.14 -32.35 66.83 Favored 'General case' 0 N--CA 1.499 2.024 0 O-C-N 121.626 -0.671 . . . . 0.0 110.22 -178.997 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 256' ' ' ALA . . . . . . . . . . . . . . . -64.67 -37.56 87.99 Favored 'General case' 0 N--CA 1.501 2.115 0 O-C-N 121.548 -0.72 . . . . 0.0 110.165 177.262 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 257' ' ' SER . . . . . . . . . . . . . 27.1 m -56.7 -38.14 71.87 Favored 'General case' 0 N--CA 1.503 2.195 0 O-C-N 121.748 -0.595 . . . . 0.0 110.643 179.713 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 258' ' ' SER . . . . . . . . . . . . . 60.2 p -69.32 -30.87 69.02 Favored 'General case' 0 N--CA 1.5 2.029 0 C-N-CA 120.366 -0.534 . . . . 0.0 110.4 -177.604 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 259' ' ' GLN . . . . . . . . . . . . . 47.4 tt0 -64.96 -40.1 94.48 Favored 'General case' 0 N--CA 1.5 2.051 0 O-C-N 121.623 -0.673 . . . . 0.0 110.395 -179.721 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 260' ' ' LEU . . . . . 0.461 ' HA ' HD12 ' B' ' 263' ' ' LEU . 83.7 mt -68.84 -38.98 80.19 Favored 'General case' 0 N--CA 1.499 1.993 0 O-C-N 121.686 -0.634 . . . . 0.0 110.243 179.882 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 261' ' ' LEU . . . . . 0.612 HD13 HD12 ' A' ' 55' ' ' LEU . 29.6 tp -67.91 -36.98 81.13 Favored 'General case' 0 N--CA 1.498 1.965 0 O-C-N 121.638 -0.664 . . . . 0.0 110.018 179.064 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 262' ' ' SER . . . . . . . . . . . . . 23.0 t -62.48 -38.54 90.25 Favored 'General case' 0 N--CA 1.501 2.101 0 O-C-N 121.754 -0.591 . . . . 0.0 110.465 177.587 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 263' ' ' LEU . . . . . 0.461 HD12 ' HA ' ' B' ' 260' ' ' LEU . 45.7 mt -65.01 -40.17 94.51 Favored 'General case' 0 N--CA 1.501 2.076 0 O-C-N 121.663 -0.648 . . . . 0.0 110.363 179.208 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 264' ' ' LEU . . . . . 0.585 ' CD1' HD13 ' A' ' 55' ' ' LEU . 84.2 mt -62.24 -35.55 79.28 Favored 'General case' 0 N--CA 1.502 2.143 0 O-C-N 121.736 -0.603 . . . . 0.0 110.564 178.517 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 265' ' ' LYS . . . . . . . . . . . . . 30.1 ttpt -75.81 -36.72 59.63 Favored 'General case' 0 N--CA 1.497 1.922 0 O-C-N 121.757 -0.59 . . . . 0.0 110.085 -179.511 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 266' ' ' SER . . . . . . . . . . . . . 86.3 p -162.95 171.04 17.16 Favored 'General case' 0 N--CA 1.495 1.805 0 O-C-N 121.682 -0.636 . . . . 0.0 110.178 -179.659 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 267' ' ' SER . . . . . . . . . . . . . 86.5 p -89.49 160.04 16.95 Favored 'General case' 0 N--CA 1.496 1.871 0 O-C-N 121.792 -0.567 . . . . 0.0 110.181 -179.949 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 268' ' ' THR . . . . . . . . . . . . . 24.1 m -65.74 -37.83 87.45 Favored 'General case' 0 N--CA 1.5 2.056 0 O-C-N 121.697 -0.627 . . . . 0.0 110.326 -179.65 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 269' ' ' ALA . . . . . . . . . . . . . . . 48.53 86.78 0.14 Allowed Pre-proline 0 N--CA 1.506 2.342 0 O-C-N 121.748 -0.595 . . . . 0.0 111.255 -178.37 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 270' ' ' PRO . . . . . . . . . . . . . 23.9 Cg_endo -65.87 -32.61 45.26 Favored 'Trans proline' 0 N--CA 1.489 1.225 0 O-C-N 123.54 1.284 . . . . 0.0 110.583 -179.506 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 271' ' ' SER . . . . . . . . . . . . . 50.2 m -123.41 146.64 47.84 Favored 'General case' 0 N--CA 1.496 1.842 0 O-C-N 121.682 -0.636 . . . . 0.0 110.226 179.952 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 272' ' ' ASP . . . . . . . . . . . . . 19.9 t70 -160.52 31.66 0.16 Allowed 'General case' 0 N--CA 1.495 1.804 0 O-C-N 121.659 -0.651 . . . . 0.0 110.356 179.307 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 273' ' ' LEU . . . . . 0.528 HD12 ' N ' ' B' ' 273' ' ' LEU . 7.3 mp 51.23 65.2 1.55 Allowed 'General case' 0 N--CA 1.505 2.322 0 O-C-N 121.636 -0.665 . . . . 0.0 111.077 -179.303 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 274' ' ' ALA . . . . . . . . . . . . . . . -166.51 170.45 12.8 Favored 'General case' 0 N--CA 1.497 1.895 0 O-C-N 121.492 -0.755 . . . . 0.0 110.036 -179.588 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 275' ' ' THR . . . . . . . . . . . . . 23.5 m -117.27 81.76 13.75 Favored Pre-proline 0 N--CA 1.494 1.759 0 O-C-N 121.67 -0.644 . . . . 0.0 110.109 179.899 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 276' ' ' PRO . . . . . . . . . . . . . 26.3 Cg_endo -66.5 -30.91 42.97 Favored 'Trans proline' 0 N--CA 1.487 1.146 0 O-C-N 123.551 1.29 . . . . 0.0 110.647 -179.668 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 277' ' ' GLN . . . . . . . . . . . . . 43.2 mt-30 -120.04 88.47 40.93 Favored Pre-proline 0 N--CA 1.495 1.806 0 O-C-N 121.618 -0.676 . . . . 0.0 110.25 -179.349 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 278' ' ' PRO . . . . . . . . . . . . . 18.6 Cg_exo -62.98 152.65 78.27 Favored 'Trans proline' 0 N--CA 1.489 1.264 0 O-C-N 123.481 1.253 . . . . 0.0 110.542 178.906 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 279' ' ' SER . . . . . . . . . . . . . 90.8 p -107.75 149.86 27.67 Favored 'General case' 0 N--CA 1.494 1.77 0 O-C-N 121.619 -0.676 . . . . 0.0 110.237 -179.819 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 280' ' ' THR . . . . . . . . . . . . . 20.6 m -152.58 -46.21 0.1 Allowed 'General case' 0 N--CA 1.495 1.777 0 O-C-N 121.687 -0.633 . . . . 0.0 110.298 -179.612 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 281' ' ' PHE . . . . . . . . . . . . . 1.7 m-85 -61.75 -48.51 89.37 Favored Pre-proline 0 N--CA 1.502 2.154 0 O-C-N 121.657 -0.652 . . . . 0.0 111.044 -179.348 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 282' ' ' PRO . . . . . . . . . . . . . 27.5 Cg_exo -57.83 150.94 59.79 Favored 'Trans proline' 0 N--CA 1.494 1.527 0 O-C-N 123.182 1.096 . . . . 0.0 110.838 177.216 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 283' ' ' GLN . . . . . . . . . . . . . 4.7 pt20 -64.1 158.07 65.73 Favored Pre-proline 0 N--CA 1.501 2.119 0 O-C-N 121.661 -0.649 . . . . 0.0 110.536 -179.672 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 284' ' ' PRO . . . . . . . . . . . . . 28.4 Cg_endo -67.38 155.59 69.74 Favored 'Trans proline' 0 N--CA 1.488 1.161 0 O-C-N 123.711 1.374 . . . . 0.0 110.399 -179.324 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 285' ' ' PRO . . . . . . . . . . . . . 26.5 Cg_endo -66.7 151.2 83.09 Favored 'Trans proline' 0 N--CA 1.488 1.172 0 O-C-N 123.662 1.348 . . . . 0.0 110.419 -179.669 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 286' ' ' VAL . . . . . . . . . . . . . 15.0 p -63.88 -32.78 58.44 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.086 0 O-C-N 121.709 -0.62 . . . . 0.0 110.417 179.887 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 287' ' ' GLU . . . . . . . . . . . . . 29.8 tp10 -99.11 137.63 37.36 Favored 'General case' 0 N--CA 1.494 1.764 0 O-C-N 121.698 -0.626 . . . . 0.0 110.167 179.915 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 288' ' ' SER . . . . . . . . . . . . . 26.6 t -136.23 153.73 51.13 Favored 'General case' 0 N--CA 1.495 1.782 0 O-C-N 121.66 -0.65 . . . . 0.0 110.093 -179.869 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 289' ' ' HIS . . . . . . . . . . . . . 98.4 m-70 -103.75 132.69 49.77 Favored 'General case' 0 N--CA 1.495 1.782 0 O-C-N 121.633 -0.667 . . . . 0.0 110.201 -179.725 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 290' ' ' SER . . . . . . . . . . . . . 27.5 t -135.37 147.64 49.13 Favored 'General case' 0 N--CA 1.494 1.76 0 O-C-N 121.671 -0.643 . . . . 0.0 110.176 -179.756 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 291' ' ' SER . . . . . . . . . . . . . 3.4 m . . . . . 0 N--CA 1.494 1.768 0 CA-C-O 118.034 -0.984 . . . . 0.0 110.228 179.931 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' -1' ' ' MET . . . . . . . . . . . . . 74.2 mtm . . . . . 0 N--CA 1.493 1.687 0 CA-C-O 120.979 0.419 . . . . 0.0 110.223 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 0' ' ' GLY . . . . . . . . . . . . . . . -71.16 134.84 23.51 Favored Glycine 0 N--CA 1.493 2.465 0 N-CA-C 109.549 -1.42 . . . . 0.0 109.549 -179.989 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 65.3 mtt -131.7 164.32 26.2 Favored 'General case' 0 N--CA 1.495 1.804 0 O-C-N 121.603 -0.939 . . . . 0.0 110.215 179.935 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 68.6 m -95.28 171.93 8.42 Favored 'General case' 0 N--CA 1.496 1.858 0 O-C-N 121.738 -0.601 . . . . 0.0 110.047 179.488 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 3' ' ' VAL . . . . . 0.422 HG12 ' CE1' ' A' ' 7' ' ' TYR . 78.5 t -66.64 -27.75 41.09 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.06 0 O-C-N 121.699 -0.626 . . . . 0.0 110.303 -178.543 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -55.33 -31.53 61.77 Favored 'General case' 0 N--CA 1.504 2.272 0 O-C-N 121.375 -0.828 . . . . 0.0 110.399 -178.828 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 74.4 m-20 -69.04 -30.64 69.04 Favored 'General case' 0 N--CA 1.499 2.0 0 O-C-N 121.85 -0.531 . . . . 0.0 110.283 174.845 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 91.0 m-85 -95.4 10.02 37.86 Favored 'General case' 0 N--CA 1.497 1.917 0 O-C-N 121.59 -0.694 . . . . 0.0 111.536 -178.08 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 7' ' ' TYR . . . . . 0.422 ' CE1' HG12 ' A' ' 3' ' ' VAL . 2.9 m-30 -67.2 134.57 51.95 Favored 'General case' 0 N--CA 1.502 2.163 0 O-C-N 121.072 -1.017 . . . . 0.0 109.941 173.953 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 8' ' ' GLY . . . . . 0.435 ' O ' HG13 ' A' ' 24' ' ' VAL . . . 83.49 -1.05 89.3 Favored Glycine 0 N--CA 1.496 2.676 0 N-CA-C 110.84 -0.904 . . . . 0.0 110.84 -178.046 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 9' ' ' SER . . . . . 0.634 ' OG ' HD12 ' A' ' 25' ' ' ILE . 83.1 p -77.82 137.59 38.5 Favored 'General case' 0 N--CA 1.499 2.01 0 O-C-N 121.064 -1.257 . . . . 0.0 110.516 176.855 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 27.0 t-20 -85.17 119.28 25.38 Favored 'General case' 0 N--CA 1.498 1.952 0 O-C-N 121.592 -0.692 . . . . 0.0 109.925 174.102 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 11' ' ' VAL . . . . . 0.517 HG12 ' HA ' ' A' ' 57' ' ' ILE . 35.2 m -142.5 163.02 18.37 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.729 0 N-CA-C 109.448 -0.575 . . . . 0.0 109.448 -179.837 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 12' ' ' GLU . . . . . 0.527 ' HB2' HD11 ' A' ' 58' ' ' LEU . 41.8 tt0 -109.34 127.4 54.3 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.489 -0.757 . . . . 0.0 110.072 178.236 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 13' ' ' VAL . . . . . 0.61 HG22 ' CD2' ' A' ' 55' ' ' LEU . 55.5 t -106.83 124.78 62.7 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.744 0 O-C-N 121.619 -0.675 . . . . 0.0 109.913 -177.848 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 22.2 tp -96.02 126.73 41.46 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.687 -0.633 . . . . 0.0 109.456 174.31 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 86.3 mt -97.46 166.37 11.56 Favored 'General case' 0 N--CA 1.495 1.819 0 O-C-N 121.588 -0.695 . . . . 0.0 111.167 -171.38 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 16.7 p30 -58.09 -22.62 51.33 Favored 'General case' 0 N--CA 1.506 2.333 0 O-C-N 121.746 -0.596 . . . . 0.0 111.535 -177.277 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 40.3 p-10 -93.0 23.56 4.18 Favored 'General case' 0 N--CA 1.497 1.918 0 O-C-N 121.571 -0.705 . . . . 0.0 110.847 -176.551 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 74.3 m-20 59.1 27.7 16.75 Favored 'General case' 0 N--CA 1.505 2.292 0 O-C-N 121.398 -0.814 . . . . 0.0 110.671 175.838 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 50.5 m -104.62 133.98 48.55 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.502 -0.749 . . . . 0.0 109.63 172.339 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 30.2 ttmt -109.66 138.76 45.56 Favored 'General case' 0 N--CA 1.495 1.793 0 O-C-N 121.715 -0.616 . . . . 0.0 110.413 -176.008 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -153.02 160.54 43.0 Favored 'General case' 0 N--CA 1.496 1.845 0 O-C-N 121.718 -0.614 . . . . 0.0 110.278 179.438 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 6.8 ptp85 -140.69 154.44 46.37 Favored 'General case' 0 N--CA 1.496 1.831 0 O-C-N 121.665 -0.647 . . . . 0.0 110.355 -179.914 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 23' ' ' GLY . . . . . 0.515 ' HA2' HD13 ' A' ' 39' ' ' LEU . . . -171.85 171.13 43.95 Favored Glycine 0 N--CA 1.494 2.527 0 N-CA-C 109.059 -1.616 . . . . 0.0 109.059 179.429 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 24' ' ' VAL . . . . . 0.435 HG13 ' O ' ' A' ' 8' ' ' GLY . 40.9 t -94.7 123.05 46.67 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.983 0 O-C-N 121.66 -0.906 . . . . 0.0 109.259 176.3 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 25' ' ' ILE . . . . . 0.634 HD12 ' OG ' ' A' ' 9' ' ' SER . 96.0 mt -63.18 141.43 18.14 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.182 0 O-C-N 121.62 -0.675 . . . . 0.0 110.499 -171.953 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 26' ' ' THR . . . . . 0.641 HG21 ' HB2' ' A' ' 38' ' ' ARG . 12.2 p -121.15 -25.41 5.3 Favored 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.818 -0.551 . . . . 0.0 111.229 -179.545 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 27' ' ' ASN . . . . . 0.488 ' O ' HD12 ' A' ' 35' ' ' LEU . 2.0 t-20 -163.38 161.42 24.44 Favored 'General case' 0 N--CA 1.5 2.075 0 O-C-N 120.901 -1.124 . . . . 0.0 111.849 178.864 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 28' ' ' PHE . . . . . 0.453 ' HE1' HG21 ' A' ' 49' ' ' THR . 84.5 t80 -150.03 129.0 12.59 Favored 'General case' 0 N--CA 1.498 1.963 0 N-CA-C 109.23 -0.655 . . . . 0.0 109.23 169.032 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 21.2 t70 -98.77 131.23 45.06 Favored 'General case' 0 N--CA 1.492 1.625 0 N-CA-C 109.031 -0.729 . . . . 0.0 109.031 -178.359 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 87.4 p -69.81 -50.64 41.01 Favored 'General case' 0 N--CA 1.498 1.953 0 C-N-CA 120.032 -0.667 . . . . 0.0 110.616 -175.35 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 5.2 t -59.63 -42.61 93.1 Favored 'General case' 0 N--CA 1.502 2.131 0 O-C-N 121.567 -0.708 . . . . 0.0 110.782 -174.632 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 28.6 m120 -103.79 -10.06 18.56 Favored 'General case' 0 N--CA 1.496 1.875 0 O-C-N 121.663 -0.648 . . . . 0.0 111.518 -177.266 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 2.1 m 49.94 67.31 0.92 Allowed 'General case' 0 N--CA 1.508 2.452 0 O-C-N 121.027 -1.046 . . . . 0.0 110.876 -174.153 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 34' ' ' ILE . . . . . 1.125 HD12 HG22 ' A' ' 48' ' ' VAL . 45.8 mm -123.51 125.86 72.18 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.043 0 O-C-N 121.519 -0.738 . . . . 0.0 109.333 -175.698 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.488 HD12 ' O ' ' A' ' 27' ' ' ASN . 9.5 tp -115.7 122.73 46.42 Favored 'General case' 0 N--CA 1.495 1.792 0 O-C-N 121.701 -0.624 . . . . 0.0 110.628 -168.639 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 78.4 mt-30 -91.03 133.22 35.49 Favored 'General case' 0 N--CA 1.49 1.562 0 N-CA-C 109.445 -0.576 . . . . 0.0 109.445 172.318 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 13.7 mt -117.83 123.54 46.16 Favored 'General case' 0 N--CA 1.494 1.772 0 C-N-CA 120.224 -0.59 . . . . 0.0 110.036 174.676 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 38' ' ' ARG . . . . . 0.641 ' HB2' HG21 ' A' ' 26' ' ' THR . 63.3 ttt180 -104.5 105.01 14.96 Favored 'General case' 0 N--CA 1.495 1.811 0 O-C-N 121.761 -0.587 . . . . 0.0 110.132 174.62 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.515 HD13 ' HA2' ' A' ' 23' ' ' GLY . 62.9 tp -83.65 155.45 23.18 Favored 'General case' 0 N--CA 1.499 1.977 0 O-C-N 121.535 -0.728 . . . . 0.0 110.679 -176.086 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -67.19 -3.1 6.8 Favored 'General case' 0 N--CA 1.503 2.22 0 O-C-N 121.806 -0.559 . . . . 0.0 112.154 -170.497 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 35.4 p-10 -85.75 28.99 0.73 Allowed 'General case' 0 N--CA 1.499 1.993 0 O-C-N 121.044 -1.035 . . . . 0.0 110.937 173.166 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 74.1 m-20 59.05 29.28 18.8 Favored 'General case' 0 N--CA 1.505 2.298 0 O-C-N 121.26 -0.9 . . . . 0.0 110.357 177.138 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 68.9 m -121.5 141.93 50.55 Favored 'General case' 0 N--CA 1.494 1.758 0 O-C-N 121.502 -0.748 . . . . 0.0 109.99 177.112 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 9.0 t -128.16 147.37 50.55 Favored 'General case' 0 N--CA 1.495 1.816 0 O-C-N 121.621 -0.674 . . . . 0.0 109.966 179.903 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 77.1 tttt -150.76 134.11 16.26 Favored 'General case' 0 N--CA 1.495 1.798 0 C-N-CA 120.157 -0.617 . . . . 0.0 110.595 -177.325 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 88.4 p -94.72 123.04 37.94 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.817 -0.552 . . . . 0.0 110.105 177.93 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 82.2 mt -129.25 137.92 55.76 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.857 0 N-CA-C 109.252 -0.648 . . . . 0.0 109.252 179.683 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 48' ' ' VAL . . . . . 1.125 HG22 HD12 ' A' ' 34' ' ' ILE . 58.7 t -82.41 127.61 39.48 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.874 0 O-C-N 121.598 -0.689 . . . . 0.0 109.297 179.638 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 49' ' ' THR . . . . . 0.453 HG21 ' HE1' ' A' ' 28' ' ' PHE . 34.2 p -59.88 -24.89 64.64 Favored 'General case' 0 N--CA 1.504 2.269 0 O-C-N 121.552 -0.717 . . . . 0.0 112.052 -170.727 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 51.4 mttm -57.14 -25.23 58.55 Favored 'General case' 0 N--CA 1.503 2.224 0 O-C-N 121.474 -0.766 . . . . 0.0 110.96 -176.289 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 6.4 p30 -84.35 4.85 29.39 Favored 'General case' 0 N--CA 1.499 1.998 0 C-N-CA 119.659 -0.817 . . . . 0.0 111.381 176.295 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 98.9 mt -75.59 127.72 37.1 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.13 0 O-C-N 121.119 -0.988 . . . . 0.0 109.831 175.953 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 85.3 tttt -92.9 -29.62 15.82 Favored 'General case' 0 N--CA 1.493 1.697 0 O-C-N 121.853 -0.53 . . . . 0.0 109.738 170.844 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 5.3 m-20 -164.09 155.18 15.77 Favored 'General case' 0 N--CA 1.5 2.048 0 O-C-N 121.821 -0.549 . . . . 0.0 110.091 -177.715 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 55' ' ' LEU . . . . . 0.61 ' CD2' HG22 ' A' ' 13' ' ' VAL . 80.0 mt -132.95 148.97 52.28 Favored 'General case' 0 N--CA 1.496 1.861 0 O-C-N 121.675 -0.641 . . . . 0.0 110.4 -179.346 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 19.7 ptp180 -150.8 146.46 26.39 Favored 'General case' 0 N--CA 1.496 1.874 0 O-C-N 121.75 -0.594 . . . . 0.0 109.933 174.937 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 57' ' ' ILE . . . . . 0.517 ' HA ' HG12 ' A' ' 11' ' ' VAL . 59.2 mt -86.98 133.24 30.45 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.866 0 O-C-N 121.497 -0.752 . . . . 0.0 109.97 173.455 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 58' ' ' LEU . . . . . 0.527 HD11 ' HB2' ' A' ' 12' ' ' GLU . 73.0 mt -83.47 153.25 65.14 Favored Pre-proline 0 N--CA 1.498 1.955 0 O-C-N 121.628 -0.67 . . . . 0.0 110.153 -179.205 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 32.4 Cg_endo -69.05 145.43 61.25 Favored 'Trans proline' 0 N--CA 1.488 1.154 0 O-C-N 123.671 1.353 . . . . 0.0 110.311 -179.968 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 61.2 mttm -95.34 -39.32 10.09 Favored 'General case' 0 N--CA 1.495 1.803 0 O-C-N 121.715 -0.615 . . . . 0.0 110.261 179.197 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 18.0 t-20 -109.82 124.97 52.24 Favored 'General case' 0 N--CA 1.495 1.816 0 O-C-N 121.651 -0.655 . . . . 0.0 110.17 179.652 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 34.2 tt0 -154.17 -46.82 0.09 Allowed 'General case' 0 N--CA 1.495 1.801 0 O-C-N 121.735 -0.603 . . . . 0.0 110.433 -179.244 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 49.4 mm -112.44 141.23 28.63 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.916 0 O-C-N 121.656 -0.652 . . . . 0.0 109.987 -177.864 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 64' ' ' MET . . . . . . . . . . . . . 2.7 tpt 52.44 62.31 10.54 Favored Pre-proline 0 N--CA 1.506 2.338 0 O-C-N 121.709 -0.619 . . . . 0.0 111.038 179.609 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 29.6 Cg_endo -67.98 134.46 32.05 Favored 'Trans proline' 0 N--CA 1.488 1.171 0 O-C-N 123.552 1.291 . . . . 0.0 110.295 178.66 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 57.5 mtpt -108.64 136.86 47.52 Favored 'General case' 0 N--CA 1.494 1.765 0 O-C-N 121.621 -0.674 . . . . 0.0 110.228 179.821 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 25.8 t30 -91.09 -61.12 1.73 Allowed 'General case' 0 N--CA 1.495 1.817 0 O-C-N 121.664 -0.648 . . . . 0.0 110.226 179.533 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 67.75 -122.42 16.88 Favored Glycine 0 N--CA 1.496 2.643 0 N-CA-C 109.692 -1.363 . . . . 0.0 109.692 -179.907 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 40.9 p -97.12 165.14 12.2 Favored 'General case' 0 N--CA 1.494 1.766 0 O-C-N 121.75 -0.853 . . . . 0.0 110.058 178.741 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 28.7 tptt -99.43 31.59 3.08 Favored 'General case' 0 N--CA 1.495 1.811 0 O-C-N 121.671 -0.643 . . . . 0.0 110.379 -179.338 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 15.2 m -137.1 156.99 75.32 Favored Pre-proline 0 N--CA 1.495 1.81 0 O-C-N 121.617 -0.677 . . . . 0.0 110.196 179.927 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 29.0 Cg_endo -67.58 151.09 80.01 Favored 'Trans proline' 0 N--CA 1.489 1.235 0 O-C-N 123.603 1.318 . . . . 0.0 110.434 179.998 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 25.4 t -115.16 135.29 54.34 Favored 'General case' 0 N--CA 1.495 1.81 0 O-C-N 121.687 -0.633 . . . . 0.0 110.174 179.054 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 24.4 m -68.63 -42.9 77.38 Favored 'General case' 0 N--CA 1.498 1.938 0 O-C-N 121.653 -0.655 . . . . 0.0 110.35 -178.962 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 16.4 t-20 -114.55 120.86 41.64 Favored 'General case' 0 N--CA 1.496 1.859 0 O-C-N 121.65 -0.656 . . . . 0.0 110.218 -178.681 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 85.7 p -108.43 30.55 6.34 Favored 'General case' 0 N--CA 1.495 1.784 0 O-C-N 121.636 -0.665 . . . . 0.0 110.443 179.129 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 24.9 m -116.3 138.69 51.11 Favored 'General case' 0 N--CA 1.496 1.825 0 O-C-N 121.608 -0.682 . . . . 0.0 110.183 -179.198 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 44.8 pttt -136.6 153.52 50.93 Favored 'General case' 0 N--CA 1.497 1.915 0 O-C-N 121.72 -0.612 . . . . 0.0 110.272 -179.755 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 79' ' ' LEU . . . . . 0.543 ' N ' HD12 ' A' ' 79' ' ' LEU . 6.1 mp -98.6 138.65 35.47 Favored 'General case' 0 N--CA 1.495 1.776 0 O-C-N 121.664 -0.647 . . . . 0.0 110.184 179.669 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 98.7 mttt -109.47 127.1 54.17 Favored 'General case' 0 N--CA 1.496 1.829 0 O-C-N 121.694 -0.629 . . . . 0.0 110.221 -179.611 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 24.6 m -67.09 -39.76 86.83 Favored 'General case' 0 N--CA 1.5 2.031 0 O-C-N 121.668 -0.645 . . . . 0.0 110.274 179.761 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -160.87 147.46 15.11 Favored 'General case' 0 N--CA 1.495 1.809 0 O-C-N 121.688 -0.632 . . . . 0.0 110.149 179.278 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 46.5 mt-10 -104.24 -57.8 1.98 Allowed 'General case' 0 N--CA 1.496 1.826 0 O-C-N 121.677 -0.639 . . . . 0.0 110.164 179.3 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 39.3 p -127.77 173.71 9.73 Favored 'General case' 0 N--CA 1.496 1.859 0 O-C-N 121.722 -0.612 . . . . 0.0 110.057 179.989 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 98.8 m-85 -103.87 130.51 51.46 Favored 'General case' 0 N--CA 1.494 1.768 0 O-C-N 121.728 -0.607 . . . . 0.0 110.207 179.66 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 44.0 m -127.73 157.14 41.14 Favored 'General case' 0 N--CA 1.495 1.812 0 O-C-N 121.769 -0.582 . . . . 0.0 110.145 -179.458 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 23.0 t -62.25 -34.55 76.75 Favored 'General case' 0 N--CA 1.501 2.118 0 O-C-N 121.543 -0.723 . . . . 0.0 110.391 179.768 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 53.2 mttp -102.36 129.93 48.96 Favored 'General case' 0 N--CA 1.495 1.809 0 O-C-N 121.649 -0.657 . . . . 0.0 110.028 178.368 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 90.7 m-20 -66.44 -36.57 83.13 Favored 'General case' 0 N--CA 1.5 2.041 0 O-C-N 121.671 -0.643 . . . . 0.0 110.33 -178.676 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 63.1 mttm -103.51 28.56 6.38 Favored 'General case' 0 N--CA 1.496 1.865 0 O-C-N 121.674 -0.641 . . . . 0.0 110.651 -179.072 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 91' ' ' TRP . . . . . . . . . . . . . 27.0 t90 55.62 -84.79 0.01 OUTLIER 'General case' 0 N--CA 1.506 2.348 0 O-C-N 121.787 -0.57 . . . . 0.0 111.229 -178.99 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 27.2 t -127.59 141.36 51.65 Favored 'General case' 0 N--CA 1.495 1.818 0 O-C-N 121.174 -0.954 . . . . 0.0 110.229 -178.952 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 93' ' ' MET . . . . . . . . . . . . . 13.3 mmt -66.0 -35.23 80.02 Favored 'General case' 0 N--CA 1.501 2.09 0 O-C-N 121.701 -0.624 . . . . 0.0 110.31 179.859 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 17.1 t70 . . . . . 0 N--CA 1.495 1.796 0 CA-C-O 118.021 -0.99 . . . . 0.0 110.148 -179.864 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' B' B ' 240' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.239 0 N-CA-C 109.566 -1.414 . . . . 0.0 109.566 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' B' B ' 241' ' ' ALA . . . . . . . . . . . . . . . -67.27 -32.67 73.84 Favored 'General case' 0 N--CA 1.501 2.076 0 O-C-N 121.684 -0.892 . . . . 0.0 110.355 179.866 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 242' ' ' THR . . . . . . . . . . . . . 23.2 m -119.79 144.84 47.09 Favored 'General case' 0 N--CA 1.495 1.791 0 O-C-N 121.66 -0.65 . . . . 0.0 110.165 179.971 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 243' ' ' THR . . . . . . . . . . . . . 42.8 p -82.18 154.34 25.52 Favored 'General case' 0 N--CA 1.497 1.92 0 O-C-N 121.663 -0.648 . . . . 0.0 110.164 -179.665 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 244' ' ' LYS . . . . . . . . . . . . . 53.2 mtmt -89.65 -30.33 18.19 Favored 'General case' 0 N--CA 1.496 1.85 0 O-C-N 121.684 -0.635 . . . . 0.0 110.571 -179.404 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 245' ' ' GLU . . . . . . . . . . . . . 46.3 tt0 -94.1 132.36 38.7 Favored 'General case' 0 N--CA 1.496 1.85 0 O-C-N 121.571 -0.705 . . . . 0.0 110.171 -178.931 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 246' ' ' LYS . . . . . . . . . . . . . 53.8 mttp -132.72 160.92 35.38 Favored 'General case' 0 N--CA 1.495 1.789 0 O-C-N 121.671 -0.643 . . . . 0.0 110.211 179.989 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 247' ' ' ASN . . . . . . . . . . . . . 89.9 m-20 -74.01 171.16 13.99 Favored 'General case' 0 N--CA 1.498 1.957 0 O-C-N 121.743 -0.598 . . . . 0.0 110.155 -179.797 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 248' ' ' ILE . . . . . 0.429 HG22 ' N ' ' B' ' 249' ' ' SER . 46.5 mm 58.36 164.54 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.508 2.464 0 O-C-N 121.764 -0.585 . . . . 0.0 110.719 -179.564 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 249' ' ' SER . . . . . 0.446 ' OG ' HG21 ' B' ' 252' ' ' VAL . 91.5 p -110.83 156.87 20.5 Favored 'General case' 0 N--CA 1.495 1.813 0 O-C-N 121.581 -0.699 . . . . 0.0 110.22 179.653 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 250' ' ' VAL . . . . . 0.43 ' O ' HG23 ' B' ' 252' ' ' VAL . 34.4 m -87.57 129.02 39.62 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.014 0 O-C-N 121.71 -0.619 . . . . 0.0 110.463 -178.908 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 251' ' ' ASP . . . . . . . . . . . . . 74.5 m-20 54.72 -86.61 0.02 OUTLIER 'General case' 0 N--CA 1.506 2.34 0 O-C-N 121.829 -0.544 . . . . 0.0 111.455 179.916 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 252' ' ' VAL . . . . . 0.446 HG21 ' OG ' ' B' ' 249' ' ' SER . 96.2 t 54.89 -87.07 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.507 2.389 0 O-C-N 121.212 -0.93 . . . . 0.0 110.783 -176.72 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 253' ' ' ASP . . . . . . . . . . . . . 74.6 m-20 52.03 48.34 22.94 Favored 'General case' 0 N--CA 1.506 2.352 0 O-C-N 121.091 -1.006 . . . . 0.0 111.055 -179.275 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 254' ' ' ALA . . . . . . . . . . . . . . . -67.92 -38.47 82.93 Favored 'General case' 0 N--CA 1.5 2.026 0 O-C-N 121.728 -0.608 . . . . 0.0 110.233 179.586 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 255' ' ' ASP . . . . . . . . . . . . . 9.6 m-20 -74.35 -26.01 59.87 Favored 'General case' 0 N--CA 1.499 1.985 0 O-C-N 121.724 -0.61 . . . . 0.0 110.759 -179.782 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 256' ' ' ALA . . . . . . . . . . . . . . . -63.0 -34.7 78.11 Favored 'General case' 0 N--CA 1.5 2.052 0 O-C-N 121.4 -0.813 . . . . 0.0 110.441 -179.959 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 257' ' ' SER . . . . . . . . . . . . . 23.6 m -56.73 -40.5 75.82 Favored 'General case' 0 N--CA 1.502 2.139 0 O-C-N 121.656 -0.652 . . . . 0.0 110.546 179.236 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 258' ' ' SER . . . . . . . . . . . . . 62.4 p -70.3 -31.79 69.27 Favored 'General case' 0 N--CA 1.498 1.973 0 C-N-CA 120.306 -0.558 . . . . 0.0 110.373 -179.265 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 259' ' ' GLN . . . . . . . . . . . . . 77.7 mt-30 -65.39 -34.87 79.32 Favored 'General case' 0 N--CA 1.501 2.085 0 O-C-N 121.597 -0.69 . . . . 0.0 110.361 -179.986 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 260' ' ' LEU . . . . . 0.419 ' HA ' HD12 ' B' ' 263' ' ' LEU . 82.7 mt -68.48 -40.93 80.75 Favored 'General case' 0 N--CA 1.499 2.018 0 O-C-N 121.661 -0.649 . . . . 0.0 110.19 179.878 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 261' ' ' LEU . . . . . . . . . . . . . 24.6 tp -69.81 -40.77 75.75 Favored 'General case' 0 N--CA 1.498 1.967 0 O-C-N 121.671 -0.643 . . . . 0.0 109.972 177.678 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 262' ' ' SER . . . . . . . . . . . . . 83.5 p -63.07 -33.85 76.34 Favored 'General case' 0 N--CA 1.501 2.081 0 O-C-N 121.678 -0.639 . . . . 0.0 110.462 177.64 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 263' ' ' LEU . . . . . 0.419 HD12 ' HA ' ' B' ' 260' ' ' LEU . 25.3 mt -65.3 -43.48 90.97 Favored 'General case' 0 N--CA 1.501 2.118 0 O-C-N 121.606 -0.684 . . . . 0.0 110.204 178.682 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 264' ' ' LEU . . . . . 0.421 ' CD1' HD11 ' A' ' 55' ' ' LEU . 81.4 mt -62.52 -35.12 78.4 Favored 'General case' 0 N--CA 1.502 2.137 0 O-C-N 121.673 -0.642 . . . . 0.0 110.467 178.564 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 265' ' ' LYS . . . . . . . . . . . . . 56.0 tttm -75.62 -38.12 59.2 Favored 'General case' 0 N--CA 1.498 1.967 0 O-C-N 121.786 -0.571 . . . . 0.0 110.239 -178.602 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 266' ' ' SER . . . . . . . . . . . . . 27.3 t -163.31 161.66 24.74 Favored 'General case' 0 N--CA 1.497 1.904 0 O-C-N 121.686 -0.634 . . . . 0.0 110.255 -178.674 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 267' ' ' SER . . . . . . . . . . . . . 93.3 p -118.87 157.48 27.56 Favored 'General case' 0 N--CA 1.495 1.798 0 O-C-N 121.702 -0.624 . . . . 0.0 110.145 179.703 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 268' ' ' THR . . . . . . . . . . . . . 23.6 m -65.53 -39.24 91.55 Favored 'General case' 0 N--CA 1.502 2.165 0 O-C-N 121.678 -0.639 . . . . 0.0 110.379 -179.498 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 269' ' ' ALA . . . . . . . . . . . . . . . 48.84 72.49 1.25 Allowed Pre-proline 0 N--CA 1.506 2.344 0 O-C-N 121.688 -0.633 . . . . 0.0 111.281 -178.934 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 270' ' ' PRO . . . . . . . . . . . . . 19.1 Cg_exo -62.48 151.89 80.44 Favored 'Trans proline' 0 N--CA 1.489 1.26 0 O-C-N 123.435 1.229 . . . . 0.0 110.639 179.585 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 271' ' ' SER . . . . . . . . . . . . . 88.7 p -65.92 -29.63 70.09 Favored 'General case' 0 N--CA 1.5 2.061 0 O-C-N 121.635 -0.665 . . . . 0.0 110.6 -179.942 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 272' ' ' ASP . . . . . . . . . . . . . 74.5 m-20 -67.8 150.3 48.8 Favored 'General case' 0 N--CA 1.5 2.048 0 O-C-N 121.601 -0.687 . . . . 0.0 110.203 -179.981 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 273' ' ' LEU . . . . . . . . . . . . . 21.3 tp -78.54 -33.63 47.71 Favored 'General case' 0 N--CA 1.498 1.953 0 O-C-N 121.659 -0.651 . . . . 0.0 110.096 -179.124 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 274' ' ' ALA . . . . . . . . . . . . . . . -165.58 149.48 8.23 Favored 'General case' 0 N--CA 1.497 1.894 0 O-C-N 121.55 -0.719 . . . . 0.0 110.134 -179.957 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 275' ' ' THR . . . . . 0.58 HG23 ' O ' ' B' ' 275' ' ' THR . 6.2 t -156.94 102.49 1.94 Allowed Pre-proline 0 N--CA 1.497 1.887 0 O-C-N 121.683 -0.636 . . . . 0.0 110.26 -179.676 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 276' ' ' PRO . . . . . . . . . . . . . 21.3 Cg_endo -65.52 138.06 53.14 Favored 'Trans proline' 0 N--CA 1.49 1.317 0 O-C-N 123.174 1.091 . . . . 0.0 110.52 -179.243 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 277' ' ' GLN . . . . . . . . . . . . . 29.4 mt-30 52.28 83.04 0.23 Allowed Pre-proline 0 N--CA 1.506 2.346 0 O-C-N 121.622 -0.674 . . . . 0.0 111.011 -179.842 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 278' ' ' PRO . . . . . . . . . . . . . 25.8 Cg_endo -66.44 -32.57 39.95 Favored 'Trans proline' 0 N--CA 1.489 1.207 0 O-C-N 123.528 1.278 . . . . 0.0 110.494 179.685 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 279' ' ' SER . . . . . . . . . . . . . 97.6 p -135.7 158.47 44.3 Favored 'General case' 0 N--CA 1.495 1.776 0 O-C-N 121.616 -0.678 . . . . 0.0 110.143 179.307 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 280' ' ' THR . . . . . . . . . . . . . 54.1 p -128.08 160.65 31.32 Favored 'General case' 0 N--CA 1.497 1.891 0 O-C-N 121.666 -0.646 . . . . 0.0 110.177 -179.673 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 281' ' ' PHE . . . . . . . . . . . . . 51.4 p90 -132.01 157.49 78.09 Favored Pre-proline 0 N--CA 1.495 1.795 0 O-C-N 121.639 -0.663 . . . . 0.0 110.199 179.649 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 282' ' ' PRO . . . . . . . . . . . . . 27.5 Cg_endo -67.08 142.02 59.93 Favored 'Trans proline' 0 N--CA 1.49 1.268 0 O-C-N 123.724 1.381 . . . . 0.0 110.33 179.92 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 283' ' ' GLN . . . . . . . . . . . . . 36.8 mt-30 -122.52 168.43 11.83 Favored Pre-proline 0 N--CA 1.495 1.802 0 O-C-N 121.656 -0.653 . . . . 0.0 110.197 -179.752 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 284' ' ' PRO . . . . . . . . . . . . . 17.8 Cg_exo -62.98 155.55 59.91 Favored 'Trans proline' 0 N--CA 1.489 1.25 0 O-C-N 123.636 1.334 . . . . 0.0 110.532 -179.965 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 285' ' ' PRO . . . . . . . . . . . . . 23.5 Cg_endo -65.95 -41.45 13.65 Favored 'Trans proline' 0 N--CA 1.488 1.189 0 O-C-N 123.561 1.295 . . . . 0.0 110.427 -179.227 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 286' ' ' VAL . . . . . 0.53 HG12 ' HG3' ' B' ' 287' ' ' GLU . 77.6 t -144.0 -67.52 0.1 Allowed 'Isoleucine or valine' 0 N--CA 1.497 1.879 0 O-C-N 121.713 -0.617 . . . . 0.0 109.694 179.369 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 287' ' ' GLU . . . . . 0.53 ' HG3' HG12 ' B' ' 286' ' ' VAL . 75.3 mt-10 -142.69 167.28 22.44 Favored 'General case' 0 N--CA 1.494 1.768 0 O-C-N 121.622 -0.674 . . . . 0.0 110.245 179.66 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 288' ' ' SER . . . . . . . . . . . . . 30.4 t -111.98 144.66 40.95 Favored 'General case' 0 N--CA 1.496 1.839 0 O-C-N 121.663 -0.648 . . . . 0.0 110.135 179.733 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 289' ' ' HIS . . . . . . . . . . . . . 59.1 t-80 -118.38 131.54 56.29 Favored 'General case' 0 N--CA 1.496 1.826 0 O-C-N 121.654 -0.654 . . . . 0.0 110.238 -179.509 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 290' ' ' SER . . . . . . . . . . . . . 50.4 m -121.83 148.09 45.13 Favored 'General case' 0 N--CA 1.497 1.898 0 O-C-N 121.767 -0.583 . . . . 0.0 110.209 179.625 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 291' ' ' SER . . . . . . . . . . . . . 57.6 p . . . . . 0 N--CA 1.495 1.776 0 CA-C-O 118.098 -0.953 . . . . 0.0 110.23 179.975 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' -1' ' ' MET . . . . . . . . . . . . . 61.2 mtt . . . . . 0 N--CA 1.493 1.684 0 CA-C-O 120.977 0.418 . . . . 0.0 110.151 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 0' ' ' GLY . . . . . . . . . . . . . . . -140.73 57.41 0.59 Allowed Glycine 0 N--CA 1.494 2.54 0 N-CA-C 109.5 -1.44 . . . . 0.0 109.5 -179.777 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 44.9 ttm -94.04 119.13 32.48 Favored 'General case' 0 N--CA 1.495 1.791 0 O-C-N 121.639 -0.918 . . . . 0.0 110.066 179.937 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 73.9 m -101.03 -178.97 3.91 Favored 'General case' 0 N--CA 1.496 1.87 0 O-C-N 121.709 -0.619 . . . . 0.0 110.435 -177.212 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 3' ' ' VAL . . . . . 0.453 HG21 ' CE1' ' A' ' 28' ' ' PHE . 55.9 t -64.97 -27.95 43.63 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.165 0 O-C-N 121.707 -0.621 . . . . 0.0 110.408 -179.298 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -55.45 -31.39 61.91 Favored 'General case' 0 N--CA 1.504 2.234 0 O-C-N 121.418 -0.801 . . . . 0.0 110.515 -178.664 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 74.4 m-20 -68.5 -34.24 75.54 Favored 'General case' 0 N--CA 1.499 1.984 0 O-C-N 121.793 -0.567 . . . . 0.0 109.973 174.787 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 6' ' ' PHE . . . . . 0.411 ' CD1' HD21 ' B' ' 260' ' ' LEU . 96.6 m-85 -97.5 10.12 40.64 Favored 'General case' 0 N--CA 1.496 1.867 0 O-C-N 121.732 -0.605 . . . . 0.0 111.246 178.931 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -67.41 127.95 34.61 Favored 'General case' 0 N--CA 1.501 2.09 0 O-C-N 121.223 -0.923 . . . . 0.0 110.162 -178.661 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 8' ' ' GLY . . . . . 0.456 ' O ' HG13 ' A' ' 24' ' ' VAL . . . 83.24 -2.11 87.58 Favored Glycine 0 N--CA 1.498 2.77 0 N-CA-C 110.851 -0.899 . . . . 0.0 110.851 -177.51 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 57.0 p -76.85 145.05 38.61 Favored 'General case' 0 N--CA 1.498 1.949 0 O-C-N 120.969 -1.312 . . . . 0.0 110.168 177.499 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 10' ' ' ASN . . . . . 0.78 ' CG ' HG22 ' A' ' 24' ' ' VAL . 2.3 m-20 -85.21 119.27 25.41 Favored 'General case' 0 N--CA 1.496 1.87 0 O-C-N 121.644 -0.66 . . . . 0.0 109.598 174.785 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 11' ' ' VAL . . . . . 0.479 HG12 ' HA ' ' A' ' 57' ' ' ILE . 32.9 m -142.44 159.84 19.42 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.846 0 O-C-N 121.69 -0.631 . . . . 0.0 109.754 179.885 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 12' ' ' GLU . . . . . 0.577 ' HB2' HD11 ' A' ' 58' ' ' LEU . 46.5 tt0 -109.4 128.94 55.52 Favored 'General case' 0 N--CA 1.494 1.731 0 C-N-CA 119.912 -0.715 . . . . 0.0 110.169 179.023 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 13' ' ' VAL . . . . . 0.562 HG22 ' CD2' ' A' ' 55' ' ' LEU . 60.4 t -106.78 127.69 62.1 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.766 0 O-C-N 121.728 -0.608 . . . . 0.0 109.957 -179.289 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.533 HD13 ' HG2' ' A' ' 20' ' ' LYS . 29.0 tp -95.74 127.73 42.02 Favored 'General case' 0 N--CA 1.494 1.733 0 N-CA-C 109.125 -0.695 . . . . 0.0 109.125 173.776 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 83.8 mt -96.05 168.27 10.72 Favored 'General case' 0 N--CA 1.495 1.821 0 O-C-N 121.653 -0.654 . . . . 0.0 111.097 -172.846 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 24.2 p30 -57.89 -22.06 46.48 Favored 'General case' 0 N--CA 1.506 2.333 0 O-C-N 121.815 -0.553 . . . . 0.0 111.484 -178.537 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 25.1 p30 -91.29 22.36 3.91 Favored 'General case' 0 N--CA 1.499 1.996 0 O-C-N 121.586 -0.696 . . . . 0.0 111.078 -177.364 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 74.4 m-20 59.79 28.53 18.01 Favored 'General case' 0 N--CA 1.506 2.361 0 O-C-N 121.393 -0.817 . . . . 0.0 110.813 172.805 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 17.9 m -111.49 147.32 35.58 Favored 'General case' 0 N--CA 1.494 1.743 0 O-C-N 121.474 -0.766 . . . . 0.0 109.573 171.229 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 20' ' ' LYS . . . . . 0.533 ' HG2' HD13 ' A' ' 14' ' ' LEU . 97.1 mttt -109.59 150.29 28.43 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.616 -0.677 . . . . 0.0 110.608 -177.248 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -153.01 154.15 34.35 Favored 'General case' 0 N--CA 1.496 1.867 0 O-C-N 121.824 -0.548 . . . . 0.0 109.999 176.188 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 22' ' ' ARG . . . . . 0.405 ' O ' HD22 ' A' ' 39' ' ' LEU . 7.7 ptp85 -138.22 150.41 46.71 Favored 'General case' 0 N--CA 1.494 1.765 0 O-C-N 121.569 -0.707 . . . . 0.0 110.494 179.75 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 23' ' ' GLY . . . . . 0.425 ' HA2' HD13 ' A' ' 39' ' ' LEU . . . -171.83 171.16 43.96 Favored Glycine 0 N--CA 1.492 2.383 0 N-CA-C 109.069 -1.613 . . . . 0.0 109.069 -178.958 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 24' ' ' VAL . . . . . 0.78 HG22 ' CG ' ' A' ' 10' ' ' ASN . 40.6 t -94.48 125.39 47.1 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.912 0 O-C-N 121.676 -0.896 . . . . 0.0 109.082 176.156 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 25' ' ' ILE . . . . . 0.498 ' HA ' HD23 ' A' ' 37' ' ' LEU . 45.7 mt -61.23 137.03 24.13 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.259 0 O-C-N 121.568 -0.707 . . . . 0.0 110.824 -171.554 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 26' ' ' THR . . . . . 0.709 HG21 ' HB2' ' A' ' 38' ' ' ARG . 10.0 p -121.15 -19.81 6.99 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.921 -0.487 . . . . 0.0 111.581 -178.25 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 4.0 t-20 -165.74 158.14 14.97 Favored 'General case' 0 N--CA 1.504 2.268 0 O-C-N 120.886 -1.134 . . . . 0.0 111.937 176.517 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 28' ' ' PHE . . . . . 0.453 ' CE1' HG21 ' A' ' 3' ' ' VAL . 77.2 t80 -150.34 119.99 7.0 Favored 'General case' 0 N--CA 1.496 1.853 0 N-CA-C 109.101 -0.703 . . . . 0.0 109.101 172.618 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 21.2 t70 -98.21 128.28 44.59 Favored 'General case' 0 N--CA 1.492 1.641 0 N-CA-C 109.248 -0.649 . . . . 0.0 109.248 -176.949 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 22.7 m -67.48 -47.97 68.51 Favored 'General case' 0 N--CA 1.498 1.956 0 O-C-N 121.578 -0.701 . . . . 0.0 110.661 -175.856 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 22.2 m -59.32 -45.49 91.2 Favored 'General case' 0 N--CA 1.502 2.164 0 O-C-N 121.591 -0.693 . . . . 0.0 110.897 -174.058 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 91.4 m-20 -105.53 -5.63 20.05 Favored 'General case' 0 N--CA 1.496 1.861 0 O-C-N 121.63 -0.669 . . . . 0.0 111.743 -177.973 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 58.7 m 49.42 67.18 0.93 Allowed 'General case' 0 N--CA 1.508 2.461 0 O-C-N 121.023 -1.048 . . . . 0.0 110.925 -174.277 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 34' ' ' ILE . . . . . 1.09 HD12 HG22 ' A' ' 48' ' ' VAL . 44.5 mm -117.7 125.9 74.4 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.974 0 O-C-N 121.537 -0.727 . . . . 0.0 109.236 -175.407 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 11.0 tp -115.93 118.97 34.44 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.687 -0.633 . . . . 0.0 110.477 -170.539 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 78.2 mt-30 -91.51 133.34 35.59 Favored 'General case' 0 N--CA 1.49 1.537 0 N-CA-C 109.333 -0.617 . . . . 0.0 109.333 171.872 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 0.498 HD23 ' HA ' ' A' ' 25' ' ' ILE . 52.0 mt -117.84 123.55 46.17 Favored 'General case' 0 N--CA 1.493 1.684 0 C-N-CA 120.222 -0.591 . . . . 0.0 110.009 174.535 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 38' ' ' ARG . . . . . 0.709 ' HB2' HG21 ' A' ' 26' ' ' THR . 40.7 ttp180 -105.65 104.97 14.8 Favored 'General case' 0 N--CA 1.496 1.826 0 O-C-N 121.758 -0.589 . . . . 0.0 110.126 174.137 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.425 HD13 ' HA2' ' A' ' 23' ' ' GLY . 64.5 tp -83.59 156.53 22.7 Favored 'General case' 0 N--CA 1.499 1.982 0 O-C-N 121.64 -0.663 . . . . 0.0 110.616 -175.977 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -68.05 -3.03 8.88 Favored 'General case' 0 N--CA 1.502 2.166 0 O-C-N 121.898 -0.501 . . . . 0.0 112.208 -170.582 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 30.1 m120 -86.75 29.13 0.82 Allowed 'General case' 0 N--CA 1.499 1.986 0 O-C-N 121.104 -0.997 . . . . 0.0 110.782 173.734 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 73.1 m-20 60.76 31.54 20.1 Favored 'General case' 0 N--CA 1.506 2.332 0 O-C-N 121.213 -0.929 . . . . 0.0 110.278 175.728 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 67.0 m -125.76 138.62 53.86 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.447 -0.783 . . . . 0.0 109.981 177.33 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 9.1 t -128.21 147.26 50.57 Favored 'General case' 0 N--CA 1.496 1.85 0 O-C-N 121.652 -0.655 . . . . 0.0 109.988 179.511 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 7.6 tmtm? -150.63 135.93 17.84 Favored 'General case' 0 N--CA 1.495 1.794 0 O-C-N 121.666 -0.646 . . . . 0.0 110.439 -177.959 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 88.5 p -94.67 124.51 38.75 Favored 'General case' 0 N--CA 1.495 1.813 0 O-C-N 121.745 -0.597 . . . . 0.0 110.208 178.372 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 82.8 mt -129.32 133.92 64.69 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.894 0 O-C-N 121.687 -0.633 . . . . 0.0 109.356 179.238 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 48' ' ' VAL . . . . . 1.09 HG22 HD12 ' A' ' 34' ' ' ILE . 63.6 t -81.88 127.74 39.33 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.925 0 C-N-CA 119.999 -0.68 . . . . 0.0 109.182 179.214 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 49' ' ' THR . . . . . 0.405 ' HB ' HD12 ' A' ' 52' ' ' ILE . 80.8 p -57.37 -25.06 58.87 Favored 'General case' 0 N--CA 1.506 2.37 0 O-C-N 121.474 -0.766 . . . . 0.0 111.927 -168.197 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 16.0 ttpp -56.8 -26.36 57.7 Favored 'General case' 0 N--CA 1.501 2.116 0 O-C-N 121.464 -0.773 . . . . 0.0 111.022 -177.126 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 5.0 p30 -84.83 6.13 25.88 Favored 'General case' 0 N--CA 1.498 1.946 0 C-N-CA 119.729 -0.788 . . . . 0.0 111.389 176.709 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 52' ' ' ILE . . . . . 0.46 HD12 HD13 ' B' ' 264' ' ' LEU . 97.7 mt -75.67 126.73 36.74 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.144 0 O-C-N 121.151 -0.968 . . . . 0.0 109.909 176.095 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 76.3 tttt -93.13 -29.17 15.9 Favored 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.802 -0.561 . . . . 0.0 109.929 170.727 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 5.0 m-20 -163.71 154.86 16.32 Favored 'General case' 0 N--CA 1.501 2.075 0 O-C-N 121.723 -0.611 . . . . 0.0 110.112 -177.836 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 55' ' ' LEU . . . . . 0.562 ' CD2' HG22 ' A' ' 13' ' ' VAL . 86.7 mt -132.99 148.22 52.27 Favored 'General case' 0 N--CA 1.497 1.886 0 O-C-N 121.667 -0.645 . . . . 0.0 110.507 -179.248 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 4.7 ptm180 -152.19 142.33 22.3 Favored 'General case' 0 N--CA 1.495 1.793 0 O-C-N 121.757 -0.589 . . . . 0.0 109.959 175.934 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 57' ' ' ILE . . . . . 0.479 ' HA ' HG12 ' A' ' 11' ' ' VAL . 69.9 mt -85.07 133.14 30.04 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.86 0 O-C-N 121.495 -0.753 . . . . 0.0 109.678 172.575 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 58' ' ' LEU . . . . . 0.577 HD11 ' HB2' ' A' ' 12' ' ' GLU . 40.6 mt -83.39 116.88 66.73 Favored Pre-proline 0 N--CA 1.497 1.905 0 O-C-N 121.496 -0.752 . . . . 0.0 110.204 -177.975 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 12.9 Cg_exo -66.7 159.46 51.04 Favored 'Trans proline' 0 N--CA 1.489 1.237 0 O-C-N 123.332 1.175 . . . . 0.0 110.207 177.001 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 77.6 tttt -63.22 -37.71 88.32 Favored 'General case' 0 N--CA 1.5 2.074 0 O-C-N 121.679 -0.638 . . . . 0.0 110.325 179.111 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 36.4 t30 -109.94 120.82 43.67 Favored 'General case' 0 N--CA 1.495 1.782 0 O-C-N 121.721 -0.612 . . . . 0.0 110.128 178.956 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 12.2 pt-20 -134.98 37.98 3.01 Favored 'General case' 0 N--CA 1.496 1.838 0 O-C-N 121.629 -0.669 . . . . 0.0 110.326 -179.614 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 18.6 tt -64.24 -30.56 50.44 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.07 0 O-C-N 121.633 -0.667 . . . . 0.0 110.602 -179.521 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 64' ' ' MET . . . . . . . . . . . . . 3.9 mtt -159.88 170.45 8.68 Favored Pre-proline 0 N--CA 1.495 1.8 0 O-C-N 121.618 -0.676 . . . . 0.0 110.12 -178.724 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 22.8 Cg_exo -60.87 -28.27 86.11 Favored 'Trans proline' 0 N--CA 1.491 1.363 0 O-C-N 123.677 1.356 . . . . 0.0 111.061 -179.772 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 92.6 mttt -81.88 145.25 30.46 Favored 'General case' 0 N--CA 1.498 1.931 0 O-C-N 121.569 -0.707 . . . . 0.0 110.212 -179.901 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 90.6 m-20 -64.38 -34.18 77.56 Favored 'General case' 0 N--CA 1.5 2.06 0 O-C-N 121.705 -0.622 . . . . 0.0 110.513 -179.183 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . -175.41 -175.17 42.62 Favored Glycine 0 N--CA 1.494 2.535 0 N-CA-C 109.577 -1.409 . . . . 0.0 109.577 -179.961 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 9.5 t -135.87 171.43 14.47 Favored 'General case' 0 N--CA 1.498 1.932 0 O-C-N 121.754 -0.85 . . . . 0.0 110.231 -179.813 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 39.0 ttpt -61.94 -35.64 79.03 Favored 'General case' 0 N--CA 1.501 2.121 0 O-C-N 121.645 -0.659 . . . . 0.0 110.429 179.855 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 98.8 p -123.81 79.55 56.69 Favored Pre-proline 0 N--CA 1.496 1.842 0 O-C-N 121.717 -0.614 . . . . 0.0 110.061 178.86 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 28.1 Cg_endo -67.12 143.57 65.73 Favored 'Trans proline' 0 N--CA 1.488 1.179 0 O-C-N 123.496 1.261 . . . . 0.0 110.437 -179.288 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 86.1 p -99.67 29.0 4.31 Favored 'General case' 0 N--CA 1.495 1.787 0 O-C-N 121.732 -0.605 . . . . 0.0 110.561 179.394 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 38.4 p -105.22 30.64 5.45 Favored 'General case' 0 N--CA 1.496 1.843 0 O-C-N 121.583 -0.698 . . . . 0.0 110.462 -179.004 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 89.4 m-20 53.32 44.27 30.32 Favored 'General case' 0 N--CA 1.505 2.311 0 O-C-N 121.493 -0.755 . . . . 0.0 110.865 179.597 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 22.8 t -64.02 -33.45 75.76 Favored 'General case' 0 N--CA 1.5 2.052 0 O-C-N 121.495 -0.753 . . . . 0.0 110.475 -179.941 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 24.2 m -66.0 -35.09 79.64 Favored 'General case' 0 N--CA 1.501 2.09 0 O-C-N 121.727 -0.608 . . . . 0.0 110.269 179.598 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 60.8 tttt -86.16 138.52 31.84 Favored 'General case' 0 N--CA 1.496 1.873 0 O-C-N 121.734 -0.604 . . . . 0.0 110.25 179.97 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 82.4 mt -90.67 151.05 21.42 Favored 'General case' 0 N--CA 1.498 1.926 0 O-C-N 121.63 -0.669 . . . . 0.0 110.136 -179.511 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 39.4 tttp -62.27 -33.29 74.35 Favored 'General case' 0 N--CA 1.502 2.163 0 O-C-N 121.73 -0.606 . . . . 0.0 110.464 -179.803 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 28.9 t -97.9 143.0 28.95 Favored 'General case' 0 N--CA 1.495 1.785 0 O-C-N 121.679 -0.638 . . . . 0.0 110.186 179.759 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -132.75 -167.95 1.99 Allowed 'General case' 0 N--CA 1.495 1.821 0 O-C-N 121.611 -0.681 . . . . 0.0 110.212 -179.168 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 74.8 mm-40 -94.51 158.49 15.52 Favored 'General case' 0 N--CA 1.495 1.797 0 O-C-N 121.738 -0.601 . . . . 0.0 110.22 -179.722 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 24.2 m -64.64 -35.81 82.23 Favored 'General case' 0 N--CA 1.501 2.096 0 O-C-N 121.653 -0.654 . . . . 0.0 110.355 -179.197 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 99.4 m-85 -113.36 133.68 55.02 Favored 'General case' 0 N--CA 1.495 1.798 0 O-C-N 121.625 -0.672 . . . . 0.0 110.232 -179.739 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 28.9 t -140.85 145.99 36.93 Favored 'General case' 0 N--CA 1.495 1.777 0 O-C-N 121.639 -0.663 . . . . 0.0 110.18 179.552 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 98.3 p -122.1 150.73 41.76 Favored 'General case' 0 N--CA 1.494 1.766 0 O-C-N 121.628 -0.67 . . . . 0.0 110.296 -179.92 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 98.6 mttt -126.79 147.21 50.02 Favored 'General case' 0 N--CA 1.496 1.828 0 O-C-N 121.7 -0.625 . . . . 0.0 110.078 179.418 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 29.9 m120 -104.38 103.51 13.25 Favored 'General case' 0 N--CA 1.494 1.766 0 O-C-N 121.628 -0.67 . . . . 0.0 110.248 -179.744 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 94.9 mttt -133.02 132.32 41.72 Favored 'General case' 0 N--CA 1.495 1.789 0 O-C-N 121.622 -0.674 . . . . 0.0 110.133 179.104 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 91' ' ' TRP . . . . . . . . . . . . . 87.3 t90 -126.78 125.04 41.05 Favored 'General case' 0 N--CA 1.495 1.798 0 O-C-N 121.662 -0.648 . . . . 0.0 110.233 179.678 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 29.0 t -146.1 137.48 24.73 Favored 'General case' 0 N--CA 1.495 1.814 0 O-C-N 121.704 -0.623 . . . . 0.0 110.224 179.271 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 93' ' ' MET . . . . . . . . . . . . . 74.4 mtm -66.86 -35.77 80.79 Favored 'General case' 0 N--CA 1.5 2.039 0 O-C-N 121.651 -0.656 . . . . 0.0 110.302 179.541 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 74.4 m-20 . . . . . 0 N--CA 1.505 2.308 0 CA-C-O 118.012 -0.994 . . . . 0.0 111.043 -179.91 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' B' B ' 240' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.326 0 N-CA-C 109.495 -1.442 . . . . 0.0 109.495 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' B' B ' 241' ' ' ALA . . . . . . . . . . . . . . . -142.26 151.35 41.98 Favored 'General case' 0 N--CA 1.495 1.79 0 O-C-N 121.66 -0.906 . . . . 0.0 110.201 179.841 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 242' ' ' THR . . . . . . . . . . . . . 9.8 t -137.56 156.41 48.13 Favored 'General case' 0 N--CA 1.496 1.865 0 O-C-N 121.698 -0.626 . . . . 0.0 110.452 -179.832 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 243' ' ' THR . . . . . . . . . . . . . 23.0 m -152.25 -61.16 0.16 Allowed 'General case' 0 N--CA 1.495 1.803 0 O-C-N 121.677 -0.639 . . . . 0.0 110.056 179.255 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 244' ' ' LYS . . . . . . . . . . . . . 54.1 mttp -104.24 29.03 6.3 Favored 'General case' 0 N--CA 1.496 1.826 0 O-C-N 121.705 -0.622 . . . . 0.0 110.477 179.312 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 245' ' ' GLU . . . . . . . . . . . . . 46.4 mt-10 -111.42 166.4 11.16 Favored 'General case' 0 N--CA 1.496 1.848 0 O-C-N 121.656 -0.652 . . . . 0.0 110.077 -179.453 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 246' ' ' LYS . . . . . . . . . . . . . 58.8 mttm 53.48 70.58 0.58 Allowed 'General case' 0 N--CA 1.504 2.246 0 O-C-N 121.587 -0.695 . . . . 0.0 110.841 179.809 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 247' ' ' ASN . . . . . . . . . . . . . 34.6 t30 -61.55 -32.32 72.39 Favored 'General case' 0 N--CA 1.503 2.175 0 O-C-N 121.544 -0.723 . . . . 0.0 110.611 -179.371 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 248' ' ' ILE . . . . . . . . . . . . . 80.6 mt 53.76 94.6 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.508 2.452 0 O-C-N 121.552 -0.717 . . . . 0.0 110.432 -179.87 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 249' ' ' SER . . . . . . . . . . . . . 66.5 m -79.79 -174.83 4.57 Favored 'General case' 0 N--CA 1.498 1.932 0 O-C-N 121.723 -0.61 . . . . 0.0 110.162 -179.759 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 250' ' ' VAL . . . . . . . . . . . . . 11.9 p -87.08 152.12 3.48 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.897 0 O-C-N 121.7 -0.625 . . . . 0.0 110.135 -179.623 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 251' ' ' ASP . . . . . 0.534 ' OD2' ' HB3' ' B' ' 254' ' ' ALA . 25.9 t0 53.18 35.13 19.08 Favored 'General case' 0 N--CA 1.506 2.335 0 O-C-N 121.674 -0.642 . . . . 0.0 110.921 -178.464 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 252' ' ' VAL . . . . . 0.437 HG22 ' C ' ' B' ' 251' ' ' ASP . 32.8 m 36.73 36.45 0.15 Allowed 'Isoleucine or valine' 0 N--CA 1.514 2.768 0 N-CA-C 112.52 0.563 . . . . 0.0 112.52 179.325 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 253' ' ' ASP . . . . . . . . . . . . . 74.6 m-20 52.64 50.68 17.63 Favored 'General case' 0 N--CA 1.506 2.346 0 O-C-N 121.615 -0.678 . . . . 0.0 110.858 -179.878 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 254' ' ' ALA . . . . . 0.534 ' HB3' ' OD2' ' B' ' 251' ' ' ASP . . . -66.44 -29.62 69.79 Favored 'General case' 0 N--CA 1.5 2.042 0 O-C-N 121.635 -0.665 . . . . 0.0 110.616 -179.27 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 255' ' ' ASP . . . . . . . . . . . . . 74.5 m-20 -72.09 -31.47 66.1 Favored 'General case' 0 N--CA 1.498 1.958 0 O-C-N 121.575 -0.703 . . . . 0.0 110.289 -179.171 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 256' ' ' ALA . . . . . . . . . . . . . . . -64.67 -40.51 95.53 Favored 'General case' 0 N--CA 1.5 2.074 0 O-C-N 121.498 -0.751 . . . . 0.0 110.279 177.687 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 257' ' ' SER . . . . . . . . . . . . . 36.8 m -56.65 -38.43 72.17 Favored 'General case' 0 N--CA 1.503 2.195 0 O-C-N 121.683 -0.635 . . . . 0.0 110.659 179.92 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 258' ' ' SER . . . . . . . . . . . . . 59.8 p -69.85 -29.63 66.92 Favored 'General case' 0 N--CA 1.5 2.039 0 C-N-CA 120.268 -0.573 . . . . 0.0 110.468 -178.225 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 259' ' ' GLN . . . . . . . . . . . . . 98.8 mt-30 -64.0 -38.77 92.28 Favored 'General case' 0 N--CA 1.502 2.126 0 O-C-N 121.547 -0.721 . . . . 0.0 110.487 -179.698 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 260' ' ' LEU . . . . . 0.485 ' HA ' HD12 ' B' ' 263' ' ' LEU . 81.3 mt -67.77 -44.29 77.8 Favored 'General case' 0 N--CA 1.501 2.076 0 O-C-N 121.608 -0.682 . . . . 0.0 110.246 179.713 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 261' ' ' LEU . . . . . . . . . . . . . 22.8 tp -68.61 -35.94 78.0 Favored 'General case' 0 N--CA 1.497 1.899 0 O-C-N 121.652 -0.655 . . . . 0.0 109.799 176.778 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 262' ' ' SER . . . . . . . . . . . . . 23.0 t -62.3 -36.72 83.02 Favored 'General case' 0 N--CA 1.5 2.064 0 O-C-N 121.753 -0.592 . . . . 0.0 110.457 177.521 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 263' ' ' LEU . . . . . 0.485 HD12 ' HA ' ' B' ' 260' ' ' LEU . 23.2 mt -65.37 -46.05 81.68 Favored 'General case' 0 N--CA 1.501 2.109 0 O-C-N 121.703 -0.623 . . . . 0.0 110.099 179.582 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 264' ' ' LEU . . . . . 0.46 HD13 HD12 ' A' ' 52' ' ' ILE . 81.8 mt -63.53 -37.33 86.91 Favored 'General case' 0 N--CA 1.502 2.127 0 O-C-N 121.775 -0.578 . . . . 0.0 110.585 178.571 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 265' ' ' LYS . . . . . . . . . . . . . 51.3 tttm -76.42 -44.97 33.62 Favored 'General case' 0 N--CA 1.498 1.928 0 O-C-N 121.701 -0.624 . . . . 0.0 110.211 -177.683 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 266' ' ' SER . . . . . . . . . . . . . 85.6 p -79.82 149.66 30.95 Favored 'General case' 0 N--CA 1.496 1.849 0 O-C-N 121.676 -0.64 . . . . 0.0 110.26 -179.625 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 267' ' ' SER . . . . . . . . . . . . . 85.2 p -156.58 135.66 11.97 Favored 'General case' 0 N--CA 1.495 1.784 0 O-C-N 121.605 -0.684 . . . . 0.0 110.258 179.079 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 268' ' ' THR . . . . . . . . . . . . . 7.9 t -164.21 31.2 0.08 Allowed 'General case' 0 N--CA 1.498 1.957 0 O-C-N 121.699 -0.625 . . . . 0.0 110.222 178.76 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 269' ' ' ALA . . . . . . . . . . . . . . . 47.7 56.64 17.69 Favored Pre-proline 0 N--CA 1.505 2.325 0 O-C-N 121.774 -0.579 . . . . 0.0 111.179 -177.283 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 270' ' ' PRO . . . . . . . . . . . . . 28.7 Cg_endo -67.53 125.16 12.93 Favored 'Trans proline' 0 N--CA 1.487 1.145 0 O-C-N 123.532 1.28 . . . . 0.0 110.383 -178.789 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 271' ' ' SER . . . . . . . . . . . . . 49.5 m -130.31 144.7 51.54 Favored 'General case' 0 N--CA 1.495 1.777 0 O-C-N 121.677 -0.64 . . . . 0.0 110.213 179.05 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 272' ' ' ASP . . . . . . . . . . . . . 26.4 t0 -143.71 137.16 27.96 Favored 'General case' 0 N--CA 1.494 1.772 0 O-C-N 121.641 -0.662 . . . . 0.0 110.134 179.37 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 273' ' ' LEU . . . . . . . . . . . . . 82.8 mt 51.79 94.22 0.02 OUTLIER 'General case' 0 N--CA 1.506 2.342 0 O-C-N 121.61 -0.681 . . . . 0.0 111.092 -179.338 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 274' ' ' ALA . . . . . . . . . . . . . . . 50.76 -172.19 0.02 OUTLIER 'General case' 0 N--CA 1.505 2.313 0 O-C-N 121.604 -0.685 . . . . 0.0 111.186 -178.389 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 275' ' ' THR . . . . . . . . . . . . . 31.0 p -131.58 165.56 34.62 Favored Pre-proline 0 N--CA 1.496 1.837 0 O-C-N 121.747 -0.596 . . . . 0.0 110.252 -179.655 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 276' ' ' PRO . . . . . . . . . . . . . 20.3 Cg_exo -62.3 148.54 93.08 Favored 'Trans proline' 0 N--CA 1.49 1.275 0 O-C-N 123.656 1.345 . . . . 0.0 110.607 179.811 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 277' ' ' GLN . . . . . . . . . . . . . 22.7 mt-30 -97.48 158.92 32.3 Favored Pre-proline 0 N--CA 1.494 1.742 0 O-C-N 121.612 -0.68 . . . . 0.0 110.319 -179.845 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 278' ' ' PRO . . . . . . . . . . . . . 27.3 Cg_endo -66.8 151.1 83.08 Favored 'Trans proline' 0 N--CA 1.488 1.157 0 O-C-N 123.679 1.357 . . . . 0.0 110.424 -179.962 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 279' ' ' SER . . . . . . . . . . . . . 22.7 t -64.46 -32.98 74.83 Favored 'General case' 0 N--CA 1.501 2.092 0 O-C-N 121.691 -0.631 . . . . 0.0 110.436 179.898 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 280' ' ' THR . . . . . . . . . . . . . 24.6 m -114.47 139.59 49.41 Favored 'General case' 0 N--CA 1.496 1.845 0 O-C-N 121.699 -0.625 . . . . 0.0 110.029 179.824 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 281' ' ' PHE . . . . . . . . . . . . . 16.1 p90 -129.75 154.89 81.07 Favored Pre-proline 0 N--CA 1.496 1.872 0 O-C-N 121.731 -0.605 . . . . 0.0 110.249 -179.384 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 282' ' ' PRO . . . . . . . . . . . . . 36.3 Cg_endo -70.39 -50.76 0.37 Allowed 'Trans proline' 0 N--CA 1.487 1.116 0 O-C-N 123.728 1.383 . . . . 0.0 110.363 179.367 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 283' ' ' GLN . . . . . . . . . . . . . 16.2 mm100 -125.74 161.54 50.33 Favored Pre-proline 0 N--CA 1.496 1.858 0 O-C-N 121.732 -0.605 . . . . 0.0 110.163 -179.62 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 284' ' ' PRO . . . . . . . . . . . . . 27.5 Cg_endo -66.78 153.83 76.6 Favored 'Trans proline' 0 N--CA 1.488 1.186 0 O-C-N 123.682 1.359 . . . . 0.0 110.42 -178.878 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 285' ' ' PRO . . . . . . . . . . . . . 29.3 Cg_endo -67.67 150.28 79.37 Favored 'Trans proline' 0 N--CA 1.488 1.201 0 O-C-N 123.623 1.328 . . . . 0.0 110.421 -179.213 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 286' ' ' VAL . . . . . . . . . . . . . 61.0 t -111.9 135.04 52.43 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.925 0 O-C-N 121.634 -0.666 . . . . 0.0 109.608 179.098 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 287' ' ' GLU . . . . . . . . . . . . . 41.3 tt0 -66.31 -40.38 89.92 Favored 'General case' 0 N--CA 1.5 2.048 0 O-C-N 121.709 -0.619 . . . . 0.0 110.253 -178.786 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 288' ' ' SER . . . . . . . . . . . . . 49.0 m -130.4 142.29 50.52 Favored 'General case' 0 N--CA 1.496 1.862 0 O-C-N 121.647 -0.658 . . . . 0.0 110.206 179.486 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 289' ' ' HIS . . . . . . . . . . . . . 77.6 m80 -104.59 -33.28 8.57 Favored 'General case' 0 N--CA 1.495 1.777 0 O-C-N 121.76 -0.587 . . . . 0.0 110.278 179.004 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 290' ' ' SER . . . . . . . . . . . . . 23.4 m -66.02 -34.68 78.65 Favored 'General case' 0 N--CA 1.498 1.972 0 O-C-N 121.672 -0.642 . . . . 0.0 110.397 179.839 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 291' ' ' SER . . . . . . . . . . . . . 39.1 m . . . . . 0 N--CA 1.495 1.796 0 CA-C-O 118.031 -0.985 . . . . 0.0 110.217 -179.849 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' -1' ' ' MET . . . . . . . . . . . . . 74.0 mtm . . . . . 0 N--CA 1.493 1.696 0 CA-C-O 120.952 0.405 . . . . 0.0 110.219 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 0' ' ' GLY . . . . . . . . . . . . . . . -151.46 -176.13 23.95 Favored Glycine 0 N--CA 1.494 2.512 0 N-CA-C 109.608 -1.397 . . . . 0.0 109.608 -179.784 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 14.2 ptm -144.14 68.77 1.27 Allowed 'General case' 0 N--CA 1.496 1.845 0 O-C-N 121.717 -0.872 . . . . 0.0 110.232 -179.821 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 69.8 m -92.18 172.94 8.09 Favored 'General case' 0 N--CA 1.495 1.81 0 O-C-N 121.413 -0.805 . . . . 0.0 110.167 -179.033 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 3' ' ' VAL . . . . . 0.449 HG12 ' CE1' ' A' ' 7' ' ' TYR . 65.7 t -66.45 -27.8 41.46 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.054 0 O-C-N 121.761 -0.587 . . . . 0.0 110.274 -179.368 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -55.3 -31.11 61.37 Favored 'General case' 0 N--CA 1.504 2.231 0 O-C-N 121.376 -0.828 . . . . 0.0 110.388 -179.033 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 9.7 m-20 -68.66 -31.13 70.04 Favored 'General case' 0 N--CA 1.499 1.985 0 O-C-N 121.821 -0.549 . . . . 0.0 110.222 174.647 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 96.4 m-85 -95.67 10.07 38.1 Favored 'General case' 0 N--CA 1.497 1.908 0 O-C-N 121.585 -0.697 . . . . 0.0 111.531 -178.955 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 7' ' ' TYR . . . . . 0.449 ' CE1' HG12 ' A' ' 3' ' ' VAL . 3.3 m-30 -67.24 139.05 57.33 Favored 'General case' 0 N--CA 1.502 2.17 0 O-C-N 121.196 -0.94 . . . . 0.0 109.961 174.783 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 82.84 -0.32 89.68 Favored Glycine 0 N--CA 1.497 2.762 0 N-CA-C 110.602 -0.999 . . . . 0.0 110.602 -175.541 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 29.0 t -76.57 137.66 39.68 Favored 'General case' 0 N--CA 1.498 1.935 0 O-C-N 121.154 -1.204 . . . . 0.0 110.509 -179.991 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 10' ' ' ASN . . . . . 0.667 ' CG ' HG22 ' A' ' 24' ' ' VAL . 2.4 m120 -84.14 115.59 22.48 Favored 'General case' 0 N--CA 1.498 1.97 0 O-C-N 121.684 -0.635 . . . . 0.0 109.418 174.143 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 11' ' ' VAL . . . . . 0.646 HG21 HD11 ' A' ' 25' ' ' ILE . 35.7 m -141.89 162.45 20.11 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.725 0 O-C-N 121.699 -0.626 . . . . 0.0 109.769 -178.443 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 12' ' ' GLU . . . . . 0.569 ' HB2' HD11 ' A' ' 58' ' ' LEU . 47.0 tt0 -109.48 129.11 55.58 Favored 'General case' 0 N--CA 1.492 1.675 0 C-N-CA 119.914 -0.714 . . . . 0.0 110.012 177.933 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 13' ' ' VAL . . . . . 0.56 HG22 ' CD2' ' A' ' 55' ' ' LEU . 61.7 t -106.66 126.53 62.5 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.655 0 O-C-N 121.614 -0.679 . . . . 0.0 109.838 -179.439 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.413 HD13 ' HG2' ' A' ' 20' ' ' LYS . 28.5 tp -95.86 126.63 41.25 Favored 'General case' 0 N--CA 1.493 1.703 0 N-CA-C 109.155 -0.683 . . . . 0.0 109.155 175.14 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 86.8 mt -96.39 167.11 11.37 Favored 'General case' 0 N--CA 1.496 1.836 0 O-C-N 121.587 -0.696 . . . . 0.0 111.076 -172.822 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 24.3 p30 -58.54 -21.81 53.6 Favored 'General case' 0 N--CA 1.504 2.263 0 O-C-N 121.82 -0.55 . . . . 0.0 111.685 -176.96 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 41.8 p-10 -92.76 23.51 4.09 Favored 'General case' 0 N--CA 1.497 1.924 0 O-C-N 121.531 -0.731 . . . . 0.0 110.899 -176.191 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 74.3 m-20 58.73 27.57 16.13 Favored 'General case' 0 N--CA 1.505 2.307 0 O-C-N 121.472 -0.767 . . . . 0.0 110.606 176.06 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 50.6 m -106.37 144.57 32.87 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.527 -0.733 . . . . 0.0 109.485 172.741 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 20' ' ' LYS . . . . . 0.413 ' HG2' HD13 ' A' ' 14' ' ' LEU . 74.4 mttt -109.64 148.83 30.64 Favored 'General case' 0 N--CA 1.496 1.836 0 O-C-N 121.582 -0.699 . . . . 0.0 110.557 -176.305 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -153.05 153.56 33.1 Favored 'General case' 0 N--CA 1.496 1.869 0 O-C-N 121.717 -0.614 . . . . 0.0 110.248 176.123 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 22' ' ' ARG . . . . . 0.503 ' O ' HD13 ' A' ' 39' ' ' LEU . 31.1 ptt180 -144.0 143.25 31.12 Favored 'General case' 0 N--CA 1.498 1.951 0 O-C-N 121.663 -0.648 . . . . 0.0 110.533 178.265 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -171.78 171.45 44.11 Favored Glycine 0 N--CA 1.494 2.51 0 N-CA-C 108.878 -1.689 . . . . 0.0 108.878 -174.986 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 24' ' ' VAL . . . . . 0.667 HG22 ' CG ' ' A' ' 10' ' ' ASN . 39.5 t -94.54 118.37 40.42 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.916 0 O-C-N 121.468 -1.019 . . . . 0.0 109.382 -176.461 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 25' ' ' ILE . . . . . 0.646 HD11 HG21 ' A' ' 11' ' ' VAL . 76.5 mt -63.72 143.27 15.81 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.122 0 O-C-N 121.657 -0.652 . . . . 0.0 110.442 -172.064 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 26' ' ' THR . . . . . 0.623 HG21 ' HB2' ' A' ' 38' ' ' ARG . 7.0 p -121.2 -27.76 4.83 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.733 -0.604 . . . . 0.0 111.283 -179.664 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 7.3 t-20 -161.94 158.25 24.98 Favored 'General case' 0 N--CA 1.499 2.012 0 C-N-CA 119.004 -1.078 . . . . 0.0 111.594 -177.622 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 28' ' ' PHE . . . . . 0.512 ' CE1' HG21 ' A' ' 49' ' ' THR . 77.1 t80 -150.1 126.71 10.92 Favored 'General case' 0 N--CA 1.498 1.936 0 N-CA-C 109.235 -0.654 . . . . 0.0 109.235 170.17 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 17.8 t70 -100.31 130.98 46.49 Favored 'General case' 0 N--CA 1.491 1.594 0 N-CA-C 109.095 -0.705 . . . . 0.0 109.095 -177.711 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 19.5 m -68.55 -48.69 63.62 Favored 'General case' 0 N--CA 1.498 1.975 0 C-N-CA 120.031 -0.668 . . . . 0.0 110.629 -175.703 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 25.2 m -59.49 -44.16 93.15 Favored 'General case' 0 N--CA 1.503 2.206 0 O-C-N 121.57 -0.706 . . . . 0.0 110.859 -174.078 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 29.6 m120 -103.88 -8.84 19.4 Favored 'General case' 0 N--CA 1.497 1.882 0 O-C-N 121.622 -0.674 . . . . 0.0 111.52 -178.164 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 16.1 m 49.46 67.22 0.92 Allowed 'General case' 0 N--CA 1.507 2.387 0 O-C-N 121.141 -0.974 . . . . 0.0 110.928 -174.381 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 34' ' ' ILE . . . . . 1.076 HD12 HG22 ' A' ' 48' ' ' VAL . 45.8 mm -121.96 125.91 73.78 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.071 0 O-C-N 121.629 -0.669 . . . . 0.0 109.407 -175.679 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 7.3 tp -115.81 119.69 36.83 Favored 'General case' 0 N--CA 1.494 1.767 0 O-C-N 121.648 -0.658 . . . . 0.0 110.429 -168.847 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 98.9 mt-30 -90.98 134.25 34.63 Favored 'General case' 0 N--CA 1.49 1.544 0 C-N-CA 120.315 -0.554 . . . . 0.0 109.576 174.72 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 0.421 HD23 ' HA ' ' A' ' 25' ' ' ILE . 15.8 mt -117.79 123.83 46.91 Favored 'General case' 0 N--CA 1.495 1.787 0 O-C-N 121.939 -0.476 . . . . 0.0 109.966 174.72 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 38' ' ' ARG . . . . . 0.623 ' HB2' HG21 ' A' ' 26' ' ' THR . 74.4 ttt-85 -97.27 106.2 18.48 Favored 'General case' 0 N--CA 1.497 1.897 0 O-C-N 121.741 -0.6 . . . . 0.0 109.779 175.746 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.503 HD13 ' O ' ' A' ' 22' ' ' ARG . 18.8 tp -84.72 152.06 23.98 Favored 'General case' 0 N--CA 1.495 1.777 0 O-C-N 121.678 -0.639 . . . . 0.0 110.877 -174.227 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -68.14 -3.55 10.84 Favored 'General case' 0 N--CA 1.502 2.146 0 O-C-N 121.928 -0.482 . . . . 0.0 111.982 -172.455 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 23.2 m120 -87.05 27.56 1.01 Allowed 'General case' 0 N--CA 1.498 1.941 0 O-C-N 121.07 -1.019 . . . . 0.0 110.923 173.545 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 14.8 t0 63.11 29.31 16.2 Favored 'General case' 0 N--CA 1.505 2.279 0 O-C-N 121.042 -1.036 . . . . 0.0 110.523 176.088 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 50.7 m -125.08 137.8 54.19 Favored 'General case' 0 N--CA 1.495 1.81 0 O-C-N 121.313 -0.867 . . . . 0.0 110.568 -179.267 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 9.8 t -98.11 151.04 20.8 Favored 'General case' 0 N--CA 1.496 1.845 0 O-C-N 121.817 -0.552 . . . . 0.0 110.208 175.362 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 33.6 ttmt -150.2 119.17 6.68 Favored 'General case' 0 N--CA 1.495 1.817 0 O-C-N 121.525 -0.734 . . . . 0.0 110.362 178.577 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 89.7 p -96.2 123.81 39.96 Favored 'General case' 0 N--CA 1.495 1.797 0 O-C-N 121.675 -0.64 . . . . 0.0 110.249 179.079 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 82.5 mt -129.4 135.89 60.62 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.887 0 N-CA-C 109.309 -0.626 . . . . 0.0 109.309 179.203 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 48' ' ' VAL . . . . . 1.076 HG22 HD12 ' A' ' 34' ' ' ILE . 64.0 t -81.87 127.6 39.46 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.895 0 C-N-CA 120.032 -0.667 . . . . 0.0 109.265 179.358 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 49' ' ' THR . . . . . 0.512 HG21 ' CE1' ' A' ' 28' ' ' PHE . 39.0 p -59.17 -24.85 63.42 Favored 'General case' 0 N--CA 1.504 2.239 0 O-C-N 121.668 -0.645 . . . . 0.0 112.071 -169.744 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 63.4 tttt -56.46 -24.1 43.33 Favored 'General case' 0 N--CA 1.504 2.227 0 O-C-N 121.46 -0.775 . . . . 0.0 110.981 -176.824 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 46.5 p30 -83.91 2.52 38.22 Favored 'General case' 0 N--CA 1.499 1.987 0 O-C-N 121.468 -0.77 . . . . 0.0 111.281 176.598 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 98.8 mt -75.47 127.34 36.95 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.113 0 O-C-N 121.195 -0.941 . . . . 0.0 109.987 177.978 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 50.4 tttm -92.45 -29.79 16.07 Favored 'General case' 0 N--CA 1.494 1.739 0 O-C-N 121.871 -0.518 . . . . 0.0 109.652 170.506 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 54' ' ' ASP . . . . . 0.411 ' HA ' HD22 ' B' ' 261' ' ' LEU . 5.3 m-20 -163.95 156.89 17.94 Favored 'General case' 0 N--CA 1.499 2.022 0 O-C-N 121.795 -0.566 . . . . 0.0 110.053 -178.141 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 55' ' ' LEU . . . . . 0.56 ' CD2' HG22 ' A' ' 13' ' ' VAL . 84.3 mt -133.01 148.54 52.25 Favored 'General case' 0 N--CA 1.496 1.858 0 O-C-N 121.675 -0.641 . . . . 0.0 110.513 -179.376 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 6.5 ptm180 -151.94 143.04 23.2 Favored 'General case' 0 N--CA 1.495 1.812 0 O-C-N 121.673 -0.642 . . . . 0.0 110.046 176.006 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 57' ' ' ILE . . . . . 0.504 ' HA ' HG12 ' A' ' 11' ' ' VAL . 68.7 mt -85.33 133.2 29.98 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.843 0 O-C-N 121.443 -0.786 . . . . 0.0 109.718 173.218 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 58' ' ' LEU . . . . . 0.569 HD11 ' HB2' ' A' ' 12' ' ' GLU . 59.2 mt -83.84 146.72 49.9 Favored Pre-proline 0 N--CA 1.497 1.915 0 O-C-N 121.583 -0.698 . . . . 0.0 110.164 -179.021 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 42.3 Cg_endo -73.24 102.29 1.45 Allowed 'Trans proline' 0 N--CA 1.486 1.086 0 O-C-N 123.55 1.29 . . . . 0.0 110.3 179.805 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 72.5 mttt -133.36 131.28 39.88 Favored 'General case' 0 N--CA 1.496 1.846 0 O-C-N 121.667 -0.646 . . . . 0.0 110.206 179.531 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 16.5 t-20 -117.57 125.7 51.27 Favored 'General case' 0 N--CA 1.495 1.791 0 O-C-N 121.717 -0.615 . . . . 0.0 110.273 -179.666 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 27.7 tt0 -152.34 37.08 0.53 Allowed 'General case' 0 N--CA 1.495 1.817 0 O-C-N 121.7 -0.625 . . . . 0.0 109.967 179.516 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 51.0 mm -68.99 -34.92 66.55 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.064 0 O-C-N 121.62 -0.675 . . . . 0.0 109.811 -179.4 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 64' ' ' MET . . . . . . . . . . . . . 11.6 ttm 52.22 58.85 15.1 Favored Pre-proline 0 N--CA 1.505 2.324 0 O-C-N 121.606 -0.684 . . . . 0.0 110.797 -179.292 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 28.4 Cg_endo -67.07 -28.02 41.61 Favored 'Trans proline' 0 N--CA 1.489 1.253 0 O-C-N 123.564 1.297 . . . . 0.0 110.855 -178.657 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 79.0 mttt -61.62 -45.31 94.61 Favored 'General case' 0 N--CA 1.502 2.169 0 O-C-N 121.53 -0.731 . . . . 0.0 110.763 -177.208 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 24.9 m120 -68.66 -40.64 80.11 Favored 'General case' 0 N--CA 1.499 1.978 0 O-C-N 121.594 -0.691 . . . . 0.0 110.217 179.534 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 67.89 -138.67 33.52 Favored Glycine 0 N--CA 1.495 2.602 0 N-CA-C 109.739 -1.344 . . . . 0.0 109.739 179.431 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 8.6 t -136.62 32.74 2.74 Favored 'General case' 0 N--CA 1.498 1.967 0 O-C-N 121.69 -0.888 . . . . 0.0 110.252 179.16 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 40.9 tttm -93.41 123.46 36.73 Favored 'General case' 0 N--CA 1.495 1.82 0 O-C-N 121.7 -0.625 . . . . 0.0 110.18 -179.256 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 71' ' ' SER . . . . . 0.402 ' N ' ' HD2' ' A' ' 72' ' ' PRO . 1.9 t -68.39 -56.79 9.73 Favored Pre-proline 0 N--CA 1.498 1.948 0 O-C-N 121.656 -0.652 . . . . 0.0 110.398 -179.534 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 72' ' ' PRO . . . . . 0.402 ' HD2' ' N ' ' A' ' 71' ' ' SER . 30.3 Cg_endo -68.64 143.66 57.37 Favored 'Trans proline' 0 N--CA 1.489 1.222 0 O-C-N 123.171 1.09 . . . . 0.0 110.237 178.709 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 89.3 p -125.21 156.64 38.15 Favored 'General case' 0 N--CA 1.496 1.852 0 O-C-N 121.657 -0.652 . . . . 0.0 110.21 -179.594 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 24.0 m -82.77 137.92 34.19 Favored 'General case' 0 N--CA 1.496 1.856 0 O-C-N 121.591 -0.693 . . . . 0.0 110.02 179.294 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 29.9 m120 -101.57 115.35 30.32 Favored 'General case' 0 N--CA 1.496 1.839 0 O-C-N 121.679 -0.638 . . . . 0.0 110.234 -178.718 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 4.5 t -92.37 -31.47 15.32 Favored 'General case' 0 N--CA 1.496 1.852 0 O-C-N 121.678 -0.639 . . . . 0.0 110.289 178.854 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 47.1 p -66.82 -29.67 69.66 Favored 'General case' 0 N--CA 1.5 2.073 0 O-C-N 121.591 -0.693 . . . . 0.0 110.558 179.883 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 61.3 mttm -73.15 165.95 24.05 Favored 'General case' 0 N--CA 1.498 1.944 0 O-C-N 121.551 -0.718 . . . . 0.0 110.214 -179.865 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 79' ' ' LEU . . . . . 0.523 HD21 ' O ' ' A' ' 81' ' ' SER . 8.5 tt -92.06 131.52 37.27 Favored 'General case' 0 N--CA 1.496 1.854 0 O-C-N 121.75 -0.594 . . . . 0.0 110.149 -178.449 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 38.1 ttpt -85.77 -62.62 1.48 Allowed 'General case' 0 N--CA 1.497 1.916 0 O-C-N 121.694 -0.629 . . . . 0.0 110.139 -179.336 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 81' ' ' SER . . . . . 0.523 ' O ' HD21 ' A' ' 79' ' ' LEU . 48.1 m -122.6 142.35 50.74 Favored 'General case' 0 N--CA 1.496 1.841 0 O-C-N 121.684 -0.635 . . . . 0.0 110.088 179.916 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -106.27 130.22 54.16 Favored 'General case' 0 N--CA 1.494 1.725 0 O-C-N 121.675 -0.64 . . . . 0.0 110.333 -179.419 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 13.5 mm-40 -68.39 -33.45 74.26 Favored 'General case' 0 N--CA 1.499 2.0 0 O-C-N 121.69 -0.631 . . . . 0.0 110.121 178.697 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 40.7 p -121.43 168.86 11.22 Favored 'General case' 0 N--CA 1.496 1.85 0 O-C-N 121.711 -0.618 . . . . 0.0 110.066 179.484 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 53.0 p90 -114.9 141.02 48.5 Favored 'General case' 0 N--CA 1.497 1.886 0 O-C-N 121.686 -0.634 . . . . 0.0 110.276 -179.541 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 29.9 t -150.61 157.29 42.82 Favored 'General case' 0 N--CA 1.494 1.765 0 O-C-N 121.713 -0.617 . . . . 0.0 110.269 -179.833 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 48.6 m -117.53 144.77 44.76 Favored 'General case' 0 N--CA 1.496 1.857 0 O-C-N 121.703 -0.623 . . . . 0.0 110.205 179.747 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 52.7 mttp -125.59 147.68 49.2 Favored 'General case' 0 N--CA 1.496 1.832 0 O-C-N 121.683 -0.636 . . . . 0.0 110.255 179.781 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 29.6 m120 -101.25 29.0 4.97 Favored 'General case' 0 N--CA 1.496 1.86 0 O-C-N 121.667 -0.646 . . . . 0.0 110.549 179.816 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 23.3 tptp -130.84 129.4 42.29 Favored 'General case' 0 N--CA 1.496 1.865 0 O-C-N 121.605 -0.685 . . . . 0.0 110.005 -179.819 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 91' ' ' TRP . . . . . . . . . . . . . 98.7 m95 -111.04 134.31 52.74 Favored 'General case' 0 N--CA 1.495 1.811 0 O-C-N 121.738 -0.601 . . . . 0.0 110.313 -178.909 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 23.2 t -66.94 -37.39 84.23 Favored 'General case' 0 N--CA 1.499 2.017 0 O-C-N 121.66 -0.65 . . . . 0.0 110.25 179.512 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 93' ' ' MET . . . . . . . . . . . . . 49.9 ttm -131.72 148.43 52.58 Favored 'General case' 0 N--CA 1.495 1.79 0 O-C-N 121.672 -0.643 . . . . 0.0 110.183 -179.989 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 75.1 m-20 . . . . . 0 N--CA 1.495 1.775 0 CA-C-O 117.97 -1.014 . . . . 0.0 110.218 179.976 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' B' B ' 240' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.493 2.437 0 N-CA-C 109.478 -1.449 . . . . 0.0 109.478 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' B' B ' 241' ' ' ALA . . . . . . . . . . . . . . . -67.26 -33.88 76.24 Favored 'General case' 0 N--CA 1.5 2.067 0 O-C-N 121.687 -0.89 . . . . 0.0 110.247 -179.883 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 242' ' ' THR . . . . . . . . . . . . . 42.1 p -68.91 -42.62 76.61 Favored 'General case' 0 N--CA 1.499 2.023 0 O-C-N 121.686 -0.634 . . . . 0.0 110.182 -179.952 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 243' ' ' THR . . . . . . . . . . . . . 9.8 t -152.23 151.75 31.36 Favored 'General case' 0 N--CA 1.496 1.861 0 O-C-N 121.682 -0.636 . . . . 0.0 110.428 179.37 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 244' ' ' LYS . . . . . . . . . . . . . 21.7 pttm -141.35 175.81 9.36 Favored 'General case' 0 N--CA 1.497 1.881 0 O-C-N 121.724 -0.61 . . . . 0.0 110.285 178.534 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 245' ' ' GLU . . . . . . . . . . . . . 74.8 mm-40 -65.38 -32.25 73.79 Favored 'General case' 0 N--CA 1.5 2.053 0 O-C-N 121.71 -0.618 . . . . 0.0 110.515 -179.265 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 246' ' ' LYS . . . . . . . . . . . . . 56.2 mttm -90.06 166.91 13.15 Favored 'General case' 0 N--CA 1.496 1.853 0 O-C-N 121.654 -0.654 . . . . 0.0 110.224 -179.907 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 247' ' ' ASN . . . . . . . . . . . . . 56.6 t30 54.14 58.49 4.96 Favored 'General case' 0 N--CA 1.504 2.258 0 O-C-N 121.51 -0.744 . . . . 0.0 110.862 179.453 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 248' ' ' ILE . . . . . . . . . . . . . 82.0 mt -75.59 -33.01 25.77 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.02 0 O-C-N 121.436 -0.79 . . . . 0.0 109.664 -179.766 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 249' ' ' SER . . . . . 0.411 ' C ' HG13 ' B' ' 250' ' ' VAL . 28.2 t -109.73 141.96 41.6 Favored 'General case' 0 N--CA 1.495 1.81 0 O-C-N 121.661 -0.65 . . . . 0.0 110.099 178.302 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 250' ' ' VAL . . . . . 0.411 HG13 ' C ' ' B' ' 249' ' ' SER . 29.4 m -149.64 156.65 7.04 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.011 0 O-C-N 121.687 -0.633 . . . . 0.0 110.084 -179.027 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 251' ' ' ASP . . . . . . . . . . . . . 74.5 m-20 52.27 39.2 26.64 Favored 'General case' 0 N--CA 1.506 2.342 0 O-C-N 121.716 -0.615 . . . . 0.0 110.97 -179.733 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 252' ' ' VAL . . . . . 0.427 ' O ' HG13 ' B' ' 252' ' ' VAL . 14.3 p -80.54 127.22 39.58 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.917 0 O-C-N 121.618 -0.677 . . . . 0.0 110.213 179.361 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 253' ' ' ASP . . . . . . . . . . . . . 74.5 m-20 52.43 50.13 18.95 Favored 'General case' 0 N--CA 1.506 2.336 0 O-C-N 121.588 -0.695 . . . . 0.0 110.896 -179.996 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 254' ' ' ALA . . . . . . . . . . . . . . . -66.77 -35.99 81.37 Favored 'General case' 0 N--CA 1.499 2.003 0 O-C-N 121.563 -0.711 . . . . 0.0 110.276 -179.199 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 255' ' ' ASP . . . . . . . . . . . . . 19.3 t70 -73.42 -32.93 64.68 Favored 'General case' 0 N--CA 1.498 1.935 0 O-C-N 121.757 -0.589 . . . . 0.0 110.198 179.257 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 256' ' ' ALA . . . . . . . . . . . . . . . -63.93 -39.09 93.35 Favored 'General case' 0 N--CA 1.501 2.09 0 O-C-N 121.699 -0.626 . . . . 0.0 110.316 179.523 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 257' ' ' SER . . . . . . . . . . . . . 40.5 m -55.65 -35.98 66.55 Favored 'General case' 0 N--CA 1.504 2.248 0 O-C-N 121.656 -0.652 . . . . 0.0 110.373 177.908 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 258' ' ' SER . . . . . . . . . . . . . 25.3 m -69.29 -33.23 72.87 Favored 'General case' 0 N--CA 1.499 1.983 0 C-N-CA 120.423 -0.511 . . . . 0.0 110.272 179.855 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 259' ' ' GLN . . . . . . . . . . . . . 78.2 mt-30 -63.79 -36.99 85.7 Favored 'General case' 0 N--CA 1.501 2.084 0 O-C-N 121.628 -0.67 . . . . 0.0 110.43 -179.433 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 260' ' ' LEU . . . . . 0.458 ' HA ' HD12 ' B' ' 263' ' ' LEU . 82.7 mt -66.59 -42.66 86.63 Favored 'General case' 0 N--CA 1.5 2.072 0 O-C-N 121.639 -0.663 . . . . 0.0 110.231 179.556 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 261' ' ' LEU . . . . . 0.411 HD22 ' HA ' ' A' ' 54' ' ' ASP . 22.5 tp -70.43 -37.49 74.39 Favored 'General case' 0 N--CA 1.498 1.928 0 O-C-N 121.719 -0.613 . . . . 0.0 109.749 176.511 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 262' ' ' SER . . . . . . . . . . . . . 22.8 t -62.53 -36.92 84.14 Favored 'General case' 0 N--CA 1.5 2.051 0 O-C-N 121.771 -0.581 . . . . 0.0 110.443 176.896 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 263' ' ' LEU . . . . . 0.458 HD12 ' HA ' ' B' ' 260' ' ' LEU . 24.1 mt -64.6 -40.65 95.89 Favored 'General case' 0 N--CA 1.5 2.074 0 O-C-N 121.681 -0.637 . . . . 0.0 110.28 179.691 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 264' ' ' LEU . . . . . 0.471 ' CD1' HD11 ' A' ' 55' ' ' LEU . 86.7 mt -62.42 -38.62 90.4 Favored 'General case' 0 N--CA 1.502 2.168 0 O-C-N 121.68 -0.637 . . . . 0.0 110.418 178.474 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 265' ' ' LYS . . . . . . . . . . . . . 80.3 mttt -76.37 -39.16 54.53 Favored 'General case' 0 N--CA 1.498 1.928 0 C-N-CA 120.292 -0.563 . . . . 0.0 110.156 179.576 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 266' ' ' SER . . . . . . . . . . . . . 85.6 p -80.03 158.91 26.38 Favored 'General case' 0 N--CA 1.498 1.942 0 O-C-N 121.771 -0.581 . . . . 0.0 110.251 179.894 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 267' ' ' SER . . . . . . . . . . . . . 12.0 t -91.43 -33.86 15.07 Favored 'General case' 0 N--CA 1.496 1.862 0 O-C-N 121.687 -0.633 . . . . 0.0 110.26 178.906 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 268' ' ' THR . . . . . 0.406 ' O ' ' HB3' ' B' ' 269' ' ' ALA . 66.1 p 46.01 -167.96 0.01 OUTLIER 'General case' 0 N--CA 1.509 2.511 0 CA-C-O 121.094 0.474 . . . . 0.0 111.732 179.431 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 269' ' ' ALA . . . . . 0.475 ' HB1' ' HD2' ' B' ' 270' ' ' PRO . . . 59.03 165.32 0.08 OUTLIER Pre-proline 0 N--CA 1.506 2.326 0 O-C-N 121.559 -0.713 . . . . 0.0 110.972 -178.867 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 270' ' ' PRO . . . . . 0.475 ' HD2' ' HB1' ' B' ' 269' ' ' ALA . 29.1 Cg_endo -69.33 -55.42 0.19 Allowed 'Trans proline' 0 N--CA 1.486 1.04 0 O-C-N 123.476 1.251 . . . . 0.0 110.356 179.045 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 271' ' ' SER . . . . . . . . . . . . . 87.0 p -156.64 166.13 34.29 Favored 'General case' 0 N--CA 1.495 1.777 0 O-C-N 121.665 -0.647 . . . . 0.0 110.199 179.873 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 272' ' ' ASP . . . . . . . . . . . . . 20.2 t0 -139.78 84.76 2.0 Allowed 'General case' 0 N--CA 1.495 1.775 0 O-C-N 121.716 -0.615 . . . . 0.0 110.127 178.972 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 273' ' ' LEU . . . . . 0.6 ' CD1' HG23 ' B' ' 275' ' ' THR . 3.3 pp -162.89 -39.7 0.04 OUTLIER 'General case' 0 N--CA 1.498 1.947 0 O-C-N 121.531 -0.73 . . . . 0.0 110.896 -179.839 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 274' ' ' ALA . . . . . 0.591 ' N ' HD12 ' B' ' 273' ' ' LEU . . . 51.37 94.68 0.02 OUTLIER 'General case' 0 N--CA 1.507 2.408 0 O-C-N 121.396 -0.815 . . . . 0.0 111.192 -179.221 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 275' ' ' THR . . . . . 0.6 HG23 ' CD1' ' B' ' 273' ' ' LEU . 28.2 p -76.71 161.26 74.73 Favored Pre-proline 0 N--CA 1.497 1.91 0 O-C-N 121.654 -0.654 . . . . 0.0 110.221 179.614 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 276' ' ' PRO . . . . . . . . . . . . . 25.8 Cg_endo -66.74 164.76 28.06 Favored 'Trans proline' 0 N--CA 1.488 1.148 0 O-C-N 123.571 1.301 . . . . 0.0 110.345 179.023 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 277' ' ' GLN . . . . . . . . . . . . . 27.4 mt-30 -89.17 108.85 26.78 Favored Pre-proline 0 N--CA 1.497 1.879 0 O-C-N 121.715 -0.615 . . . . 0.0 110.097 -179.775 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 278' ' ' PRO . . . . . . . . . . . . . 23.0 Cg_endo -65.61 141.99 69.06 Favored 'Trans proline' 0 N--CA 1.49 1.297 0 O-C-N 123.377 1.198 . . . . 0.0 110.466 -179.306 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 279' ' ' SER . . . . . . . . . . . . . 23.7 m -66.17 -32.72 74.32 Favored 'General case' 0 N--CA 1.5 2.052 0 O-C-N 121.731 -0.605 . . . . 0.0 110.448 179.803 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 280' ' ' THR . . . . . . . . . . . . . 24.3 m -64.11 -39.5 94.17 Favored 'General case' 0 N--CA 1.502 2.148 0 O-C-N 121.683 -0.636 . . . . 0.0 110.427 -178.899 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 281' ' ' PHE . . . . . . . . . . . . . 31.4 t80 -132.07 74.85 76.08 Favored Pre-proline 0 N--CA 1.495 1.807 0 O-C-N 121.615 -0.678 . . . . 0.0 110.208 -179.925 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 282' ' ' PRO . . . . . . . . . . . . . 16.5 Cg_exo -64.43 150.15 88.77 Favored 'Trans proline' 0 N--CA 1.489 1.256 0 O-C-N 123.49 1.258 . . . . 0.0 110.484 178.635 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 283' ' ' GLN . . . . . . . . . . . . . 1.5 mp0 -95.33 156.01 38.16 Favored Pre-proline 0 N--CA 1.495 1.803 0 O-C-N 121.709 -0.619 . . . . 0.0 110.234 179.539 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 284' ' ' PRO . . . . . . . . . . . . . 32.2 Cg_endo -69.21 115.1 3.85 Favored 'Trans proline' 0 N--CA 1.488 1.168 0 O-C-N 123.656 1.346 . . . . 0.0 110.155 179.745 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 285' ' ' PRO . . . . . . . . . . . . . 26.2 Cg_endo -66.17 149.96 85.25 Favored 'Trans proline' 0 N--CA 1.489 1.255 0 O-C-N 123.371 1.195 . . . . 0.0 110.478 179.206 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 286' ' ' VAL . . . . . . . . . . . . . 57.8 t -66.71 -39.34 83.49 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.114 0 O-C-N 121.709 -0.62 . . . . 0.0 109.83 -179.557 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 287' ' ' GLU . . . . . . . . . . . . . 78.4 mt-10 -111.27 155.84 22.4 Favored 'General case' 0 N--CA 1.496 1.862 0 O-C-N 121.684 -0.635 . . . . 0.0 110.115 179.683 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 288' ' ' SER . . . . . . . . . . . . . 49.1 m -117.57 146.42 43.62 Favored 'General case' 0 N--CA 1.494 1.763 0 O-C-N 121.669 -0.644 . . . . 0.0 110.185 -179.777 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 289' ' ' HIS . . . . . . . . . . . . . 56.7 t-80 -160.02 33.52 0.18 Allowed 'General case' 0 N--CA 1.494 1.761 0 O-C-N 121.723 -0.61 . . . . 0.0 110.236 -179.962 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 290' ' ' SER . . . . . . . . . . . . . 51.1 m -120.28 148.38 43.78 Favored 'General case' 0 N--CA 1.495 1.794 0 O-C-N 121.714 -0.616 . . . . 0.0 110.211 -179.791 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 291' ' ' SER . . . . . . . . . . . . . 27.3 t . . . . . 0 N--CA 1.494 1.767 0 CA-C-O 117.947 -1.025 . . . . 0.0 110.231 179.921 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' -1' ' ' MET . . . . . . . . . . . . . 73.9 mtm . . . . . 0 N--CA 1.493 1.7 0 CA-C-O 121.03 0.443 . . . . 0.0 110.154 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 0' ' ' GLY . . . . . . . . . . . . . . . -83.63 -171.09 47.28 Favored Glycine 0 N--CA 1.495 2.587 0 N-CA-C 109.447 -1.461 . . . . 0.0 109.447 179.87 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.6 mpp? -88.85 128.68 35.66 Favored 'General case' 0 N--CA 1.496 1.866 0 O-C-N 121.651 -0.911 . . . . 0.0 110.166 -179.98 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 69.5 m -101.03 165.84 11.11 Favored 'General case' 0 N--CA 1.495 1.791 0 O-C-N 121.71 -0.619 . . . . 0.0 110.263 -179.13 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 57.3 t -65.2 -27.99 43.48 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.164 0 O-C-N 121.702 -0.624 . . . . 0.0 110.194 179.192 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -55.19 -31.76 61.67 Favored 'General case' 0 N--CA 1.505 2.283 0 O-C-N 121.518 -0.739 . . . . 0.0 110.349 179.902 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 74.5 m-20 -68.64 -35.9 77.9 Favored 'General case' 0 N--CA 1.499 1.994 0 O-C-N 121.818 -0.551 . . . . 0.0 109.942 175.444 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 97.7 m-85 -97.67 10.0 41.12 Favored 'General case' 0 N--CA 1.497 1.892 0 O-C-N 121.708 -0.62 . . . . 0.0 111.217 178.877 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -67.41 128.63 37.15 Favored 'General case' 0 N--CA 1.501 2.082 0 O-C-N 121.257 -0.902 . . . . 0.0 110.061 179.048 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 8' ' ' GLY . . . . . 0.469 ' O ' HG13 ' A' ' 24' ' ' VAL . . . 82.24 -0.73 88.56 Favored Glycine 0 N--CA 1.497 2.716 0 N-CA-C 110.693 -0.963 . . . . 0.0 110.693 -175.794 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 30.4 t -76.61 136.67 39.21 Favored 'General case' 0 N--CA 1.497 1.883 0 O-C-N 120.989 -1.301 . . . . 0.0 110.4 177.794 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 14.3 t-20 -83.36 120.09 25.44 Favored 'General case' 0 N--CA 1.497 1.896 0 O-C-N 121.608 -0.683 . . . . 0.0 109.669 174.722 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 11' ' ' VAL . . . . . 0.529 HG12 ' HA ' ' A' ' 57' ' ' ILE . 35.0 m -142.83 164.52 16.66 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.733 0 O-C-N 121.794 -0.567 . . . . 0.0 109.505 -178.824 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 12' ' ' GLU . . . . . 0.44 ' HB2' HD11 ' A' ' 58' ' ' LEU . 36.8 tt0 -109.36 128.85 55.43 Favored 'General case' 0 N--CA 1.493 1.697 0 C-N-CA 119.87 -0.732 . . . . 0.0 109.894 176.412 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 60.4 t -106.83 126.6 62.76 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.741 0 O-C-N 121.659 -0.65 . . . . 0.0 109.857 -179.285 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.405 HD13 ' HG2' ' A' ' 20' ' ' LYS . 24.1 tp -95.84 127.92 42.29 Favored 'General case' 0 N--CA 1.494 1.74 0 N-CA-C 109.263 -0.643 . . . . 0.0 109.263 175.483 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 83.6 mt -96.1 161.87 13.78 Favored 'General case' 0 N--CA 1.496 1.864 0 O-C-N 121.609 -0.682 . . . . 0.0 110.923 -173.466 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 24.2 p30 -57.81 -21.76 43.79 Favored 'General case' 0 N--CA 1.506 2.327 0 O-C-N 121.855 -0.528 . . . . 0.0 111.418 179.886 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 24.8 p30 -90.91 22.49 3.61 Favored 'General case' 0 N--CA 1.5 2.073 0 O-C-N 121.618 -0.676 . . . . 0.0 111.067 -177.717 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 74.3 m-20 60.26 29.01 18.65 Favored 'General case' 0 N--CA 1.506 2.346 0 O-C-N 121.356 -0.84 . . . . 0.0 110.807 172.561 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 23.8 m -110.79 143.8 40.76 Favored 'General case' 0 N--CA 1.495 1.798 0 O-C-N 121.472 -0.767 . . . . 0.0 109.551 170.838 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 20' ' ' LYS . . . . . 0.405 ' HG2' HD13 ' A' ' 14' ' ' LEU . 34.2 mtpt -109.67 144.89 37.4 Favored 'General case' 0 N--CA 1.494 1.743 0 O-C-N 121.574 -0.704 . . . . 0.0 110.467 -176.69 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -153.09 157.93 41.14 Favored 'General case' 0 N--CA 1.497 1.905 0 O-C-N 121.8 -0.562 . . . . 0.0 110.145 177.081 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 30.7 ptt180 -143.97 152.61 41.28 Favored 'General case' 0 N--CA 1.496 1.846 0 O-C-N 121.578 -0.701 . . . . 0.0 110.441 178.081 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 23' ' ' GLY . . . . . 0.435 ' HA2' HD13 ' A' ' 39' ' ' LEU . . . -171.81 171.26 44.01 Favored Glycine 0 N--CA 1.494 2.503 0 N-CA-C 109.128 -1.589 . . . . 0.0 109.128 -179.075 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 24' ' ' VAL . . . . . 0.469 HG13 ' O ' ' A' ' 8' ' ' GLY . 43.9 t -94.64 126.06 47.14 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.918 0 O-C-N 121.59 -0.947 . . . . 0.0 109.288 176.619 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 25' ' ' ILE . . . . . 0.493 ' HA ' HD23 ' A' ' 37' ' ' LEU . 50.9 mt -61.66 137.99 22.91 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.253 0 O-C-N 121.64 -0.663 . . . . 0.0 110.896 -170.805 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 26' ' ' THR . . . . . 0.666 HG21 ' HB2' ' A' ' 38' ' ' ARG . 13.7 p -121.19 -19.06 7.23 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.922 -0.486 . . . . 0.0 111.465 -179.82 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 3.7 t-20 -166.15 158.8 14.65 Favored 'General case' 0 N--CA 1.503 2.222 0 O-C-N 120.917 -1.115 . . . . 0.0 111.751 176.046 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 65.0 t80 -150.32 124.96 9.69 Favored 'General case' 0 N--CA 1.495 1.818 0 N-CA-C 109.244 -0.651 . . . . 0.0 109.244 173.314 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 20.2 t70 -98.18 130.86 44.92 Favored 'General case' 0 N--CA 1.492 1.64 0 N-CA-C 109.004 -0.739 . . . . 0.0 109.004 -179.741 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 23.1 t -71.56 -53.76 12.71 Favored 'General case' 0 N--CA 1.498 1.956 0 C-N-CA 120.007 -0.677 . . . . 0.0 110.633 -175.845 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 22.9 m -61.93 -37.9 86.41 Favored 'General case' 0 N--CA 1.5 2.061 0 O-C-N 121.591 -0.693 . . . . 0.0 110.699 -175.819 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 91.5 m-20 -103.77 -9.85 18.74 Favored 'General case' 0 N--CA 1.498 1.942 0 O-C-N 121.746 -0.596 . . . . 0.0 111.66 -176.909 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 27.8 p 47.11 67.05 0.86 Allowed 'General case' 0 N--CA 1.508 2.434 0 O-C-N 121.408 -0.807 . . . . 0.0 111.202 -175.13 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 34' ' ' ILE . . . . . 1.055 HD12 HG22 ' A' ' 48' ' ' VAL . 46.8 mm -121.36 125.8 74.15 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.964 0 O-C-N 121.642 -0.661 . . . . 0.0 109.236 -176.433 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 11.0 tp -116.57 120.47 38.81 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.746 -0.596 . . . . 0.0 110.468 -170.3 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 57.6 mt-30 -91.02 131.94 36.31 Favored 'General case' 0 N--CA 1.49 1.551 0 N-CA-C 109.061 -0.718 . . . . 0.0 109.061 170.659 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 0.493 HD23 ' HA ' ' A' ' 25' ' ' ILE . 50.6 mt -117.82 123.56 46.23 Favored 'General case' 0 N--CA 1.494 1.761 0 C-N-CA 120.121 -0.632 . . . . 0.0 110.007 175.723 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 38' ' ' ARG . . . . . 0.666 ' HB2' HG21 ' A' ' 26' ' ' THR . 70.3 ttt180 -105.63 105.08 14.95 Favored 'General case' 0 N--CA 1.495 1.788 0 O-C-N 121.821 -0.549 . . . . 0.0 110.144 173.928 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.435 HD13 ' HA2' ' A' ' 23' ' ' GLY . 65.2 tp -83.19 157.36 22.76 Favored 'General case' 0 N--CA 1.499 1.979 0 O-C-N 121.623 -0.673 . . . . 0.0 110.518 -176.657 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -67.57 -2.97 7.5 Favored 'General case' 0 N--CA 1.503 2.179 0 O-C-N 121.857 -0.527 . . . . 0.0 112.156 -170.822 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 30.1 m120 -86.25 29.06 0.78 Allowed 'General case' 0 N--CA 1.499 1.983 0 O-C-N 120.987 -1.07 . . . . 0.0 110.822 173.503 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 73.9 m-20 60.39 31.47 20.37 Favored 'General case' 0 N--CA 1.505 2.277 0 O-C-N 121.225 -0.922 . . . . 0.0 110.326 175.468 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 69.9 m -125.91 140.77 52.36 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.483 -0.761 . . . . 0.0 110.05 177.736 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 9.8 t -128.27 147.79 50.61 Favored 'General case' 0 N--CA 1.495 1.809 0 O-C-N 121.681 -0.637 . . . . 0.0 110.018 179.785 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 81.3 tttt -150.19 135.18 17.77 Favored 'General case' 0 N--CA 1.495 1.797 0 O-C-N 121.709 -0.619 . . . . 0.0 110.545 -178.106 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 89.5 p -94.78 121.03 35.95 Favored 'General case' 0 N--CA 1.495 1.806 0 O-C-N 121.798 -0.563 . . . . 0.0 110.142 177.85 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 81.3 mt -129.25 137.29 57.4 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.868 0 O-C-N 121.671 -0.643 . . . . 0.0 109.325 -179.956 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 48' ' ' VAL . . . . . 1.055 HG22 HD12 ' A' ' 34' ' ' ILE . 60.5 t -81.53 127.78 39.28 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.846 0 O-C-N 121.566 -0.709 . . . . 0.0 109.219 179.117 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 49' ' ' THR . . . . . 0.405 ' HA ' ' CD1' ' A' ' 52' ' ' ILE . 44.3 p -58.33 -29.7 66.14 Favored 'General case' 0 N--CA 1.503 2.2 0 O-C-N 121.459 -0.776 . . . . 0.0 111.672 -170.504 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -58.56 -27.23 64.37 Favored 'General case' 0 N--CA 1.5 2.045 0 O-C-N 121.562 -0.711 . . . . 0.0 111.315 -173.261 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 4.6 p30 -82.41 0.86 40.1 Favored 'General case' 0 N--CA 1.497 1.884 0 C-N-CA 119.502 -0.879 . . . . 0.0 111.113 176.932 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 52' ' ' ILE . . . . . 0.564 HG21 HD11 ' A' ' 55' ' ' LEU . 76.1 mt -79.45 132.18 32.6 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.096 0 O-C-N 121.167 -0.958 . . . . 0.0 109.923 175.649 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 23.5 ttmt -92.42 -24.32 18.89 Favored 'General case' 0 N--CA 1.494 1.746 0 C-N-CA 120.427 -0.509 . . . . 0.0 110.22 173.278 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 54' ' ' ASP . . . . . 0.503 ' HA ' HD13 ' B' ' 261' ' ' LEU . 1.6 m-20 -164.08 152.43 13.06 Favored 'General case' 0 N--CA 1.501 2.125 0 O-C-N 121.502 -0.749 . . . . 0.0 110.489 -175.949 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 55' ' ' LEU . . . . . 0.564 HD11 HG21 ' A' ' 52' ' ' ILE . 4.7 mp -132.92 152.35 51.91 Favored 'General case' 0 N--CA 1.495 1.818 0 O-C-N 121.725 -0.609 . . . . 0.0 110.364 178.494 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 19.8 ptp180 -151.84 146.15 25.47 Favored 'General case' 0 N--CA 1.496 1.842 0 O-C-N 121.636 -0.665 . . . . 0.0 109.926 175.081 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 57' ' ' ILE . . . . . 0.529 ' HA ' HG12 ' A' ' 11' ' ' VAL . 57.5 mt -87.09 133.23 30.54 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.871 0 O-C-N 121.483 -0.761 . . . . 0.0 110.0 174.092 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 58' ' ' LEU . . . . . 0.44 HD11 ' HB2' ' A' ' 12' ' ' GLU . 78.1 mt -83.94 137.41 40.65 Favored Pre-proline 0 N--CA 1.497 1.886 0 O-C-N 121.537 -0.727 . . . . 0.0 110.018 -179.785 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 46.0 Cg_endo -74.34 99.21 1.18 Allowed 'Trans proline' 0 N--CA 1.486 1.069 0 O-C-N 123.434 1.228 . . . . 0.0 110.259 179.211 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 42.6 tptt -137.38 126.32 24.2 Favored 'General case' 0 N--CA 1.495 1.81 0 O-C-N 121.723 -0.611 . . . . 0.0 110.234 -179.466 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 89.6 m-20 53.36 41.75 32.09 Favored 'General case' 0 N--CA 1.506 2.34 0 O-C-N 121.628 -0.67 . . . . 0.0 110.973 178.235 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 45.9 tt0 -66.78 -38.26 86.2 Favored 'General case' 0 N--CA 1.501 2.08 0 O-C-N 121.563 -0.711 . . . . 0.0 110.223 179.943 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 51.6 mm -71.15 -39.28 73.54 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.033 0 O-C-N 121.581 -0.699 . . . . 0.0 109.71 179.785 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 64' ' ' MET . . . . . . . . . . . . . 8.6 tpt 51.57 57.72 16.39 Favored Pre-proline 0 N--CA 1.505 2.292 0 O-C-N 121.627 -0.671 . . . . 0.0 110.989 -179.284 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 28.6 Cg_endo -67.42 141.51 56.3 Favored 'Trans proline' 0 N--CA 1.488 1.181 0 O-C-N 123.503 1.265 . . . . 0.0 110.418 -179.664 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 97.3 mttt -127.08 143.96 51.15 Favored 'General case' 0 N--CA 1.495 1.802 0 O-C-N 121.727 -0.608 . . . . 0.0 110.151 179.131 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 38.7 p-10 -122.37 31.98 5.95 Favored 'General case' 0 N--CA 1.497 1.878 0 O-C-N 121.705 -0.622 . . . . 0.0 110.518 -179.539 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . -156.38 91.96 0.12 Allowed Glycine 0 N--CA 1.494 2.553 0 N-CA-C 109.572 -1.411 . . . . 0.0 109.572 -179.854 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 24.7 m -125.92 137.86 53.74 Favored 'General case' 0 N--CA 1.495 1.789 0 O-C-N 121.648 -0.913 . . . . 0.0 110.114 179.358 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 93.4 mttt -112.97 142.14 46.0 Favored 'General case' 0 N--CA 1.497 1.876 0 O-C-N 121.669 -0.644 . . . . 0.0 110.207 179.856 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 2.3 t -128.34 80.66 72.0 Favored Pre-proline 0 N--CA 1.495 1.798 0 O-C-N 121.748 -0.595 . . . . 0.0 110.074 179.468 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 27.5 Cg_endo -66.7 -33.08 36.24 Favored 'Trans proline' 0 N--CA 1.488 1.187 0 O-C-N 123.513 1.27 . . . . 0.0 110.517 -179.602 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 49.6 m -122.52 147.24 46.6 Favored 'General case' 0 N--CA 1.496 1.853 0 O-C-N 121.695 -0.628 . . . . 0.0 110.204 -179.911 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 24.2 m -66.52 -38.75 87.86 Favored 'General case' 0 N--CA 1.499 2.019 0 O-C-N 121.649 -0.657 . . . . 0.0 110.277 179.818 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 29.8 m120 -108.7 125.04 51.46 Favored 'General case' 0 N--CA 1.496 1.835 0 O-C-N 121.622 -0.674 . . . . 0.0 110.112 179.728 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 3.0 m -138.65 33.53 2.23 Favored 'General case' 0 N--CA 1.494 1.773 0 O-C-N 121.683 -0.636 . . . . 0.0 110.258 179.853 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 24.4 m -120.24 138.66 53.53 Favored 'General case' 0 N--CA 1.495 1.813 0 O-C-N 121.657 -0.652 . . . . 0.0 110.183 -179.709 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 98.0 mttt -122.72 149.16 44.45 Favored 'General case' 0 N--CA 1.495 1.815 0 O-C-N 121.687 -0.633 . . . . 0.0 110.241 -179.933 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 83.4 mt -92.41 150.55 20.74 Favored 'General case' 0 N--CA 1.497 1.914 0 O-C-N 121.746 -0.596 . . . . 0.0 110.103 179.518 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 17.3 ttmm -62.61 -39.19 93.0 Favored 'General case' 0 N--CA 1.503 2.176 0 O-C-N 121.673 -0.642 . . . . 0.0 110.586 -178.747 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 89.3 p -130.12 142.56 50.58 Favored 'General case' 0 N--CA 1.495 1.813 0 O-C-N 121.639 -0.663 . . . . 0.0 110.33 179.756 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -162.47 149.2 13.22 Favored 'General case' 0 N--CA 1.495 1.821 0 O-C-N 121.691 -0.631 . . . . 0.0 110.061 178.821 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 42.3 tt0 -160.28 -63.97 0.07 Allowed 'General case' 0 N--CA 1.495 1.776 0 O-C-N 121.688 -0.633 . . . . 0.0 110.258 179.269 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 9.9 t -147.03 163.87 34.83 Favored 'General case' 0 N--CA 1.496 1.855 0 O-C-N 121.599 -0.688 . . . . 0.0 110.462 -178.494 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 36.8 t80 57.74 167.22 0.04 OUTLIER 'General case' 0 N--CA 1.507 2.38 0 O-C-N 121.712 -0.618 . . . . 0.0 111.045 -179.864 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 9.6 t -119.5 145.86 45.95 Favored 'General case' 0 N--CA 1.495 1.797 0 O-C-N 121.539 -0.726 . . . . 0.0 110.222 179.82 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 24.2 t -93.24 169.44 10.39 Favored 'General case' 0 N--CA 1.496 1.826 0 O-C-N 121.75 -0.594 . . . . 0.0 110.33 -178.717 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 49.5 mttp 54.53 39.71 31.31 Favored 'General case' 0 N--CA 1.505 2.297 0 O-C-N 121.682 -0.636 . . . . 0.0 110.961 178.937 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 14.9 m120 -130.37 34.36 4.19 Favored 'General case' 0 N--CA 1.494 1.764 0 O-C-N 121.655 -0.653 . . . . 0.0 110.191 178.81 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 88.1 mttt -87.14 142.21 28.08 Favored 'General case' 0 N--CA 1.497 1.903 0 O-C-N 121.652 -0.655 . . . . 0.0 110.166 -179.368 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 91' ' ' TRP . . . . . . . . . . . . . 60.6 t-105 -64.63 -35.04 79.72 Favored 'General case' 0 N--CA 1.501 2.089 0 O-C-N 121.721 -0.612 . . . . 0.0 110.455 -179.857 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 27.7 m -63.56 -33.81 76.41 Favored 'General case' 0 N--CA 1.503 2.181 0 O-C-N 121.715 -0.615 . . . . 0.0 110.474 -179.237 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 93' ' ' MET . . . . . . . . . . . . . 88.7 mmm -103.27 148.28 26.02 Favored 'General case' 0 N--CA 1.495 1.81 0 O-C-N 121.736 -0.602 . . . . 0.0 110.156 -179.977 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 20.4 t70 . . . . . 0 N--CA 1.495 1.784 0 CA-C-O 118.027 -0.987 . . . . 0.0 110.129 -179.567 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' B' B ' 240' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.343 0 N-CA-C 109.599 -1.4 . . . . 0.0 109.599 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' B' B ' 241' ' ' ALA . . . . . . . . . . . . . . . -105.48 148.31 27.35 Favored 'General case' 0 N--CA 1.494 1.757 0 O-C-N 121.63 -0.923 . . . . 0.0 110.265 -179.937 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 242' ' ' THR . . . . . . . . . . . . . 24.8 m -114.35 132.43 56.2 Favored 'General case' 0 N--CA 1.495 1.807 0 O-C-N 121.642 -0.661 . . . . 0.0 110.081 179.834 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 243' ' ' THR . . . . . . . . . . . . . 23.5 m -68.79 -42.15 77.75 Favored 'General case' 0 N--CA 1.498 1.933 0 O-C-N 121.604 -0.685 . . . . 0.0 110.246 -179.757 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 244' ' ' LYS . . . . . . . . . . . . . 72.5 mttt -133.04 145.12 50.53 Favored 'General case' 0 N--CA 1.496 1.86 0 O-C-N 121.639 -0.663 . . . . 0.0 110.223 -179.395 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 245' ' ' GLU . . . . . . . . . . . . . 51.0 mt-10 -112.87 133.89 54.64 Favored 'General case' 0 N--CA 1.496 1.836 0 O-C-N 121.667 -0.645 . . . . 0.0 110.119 178.992 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 246' ' ' LYS . . . . . . . . . . . . . 58.8 mttm -89.08 -32.92 17.31 Favored 'General case' 0 N--CA 1.497 1.919 0 O-C-N 121.672 -0.643 . . . . 0.0 110.287 179.86 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 247' ' ' ASN . . . . . . . . . . . . . 90.6 m-20 -66.48 -34.54 78.15 Favored 'General case' 0 N--CA 1.5 2.066 0 O-C-N 121.588 -0.695 . . . . 0.0 110.307 179.822 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 248' ' ' ILE . . . . . 0.42 HG22 ' N ' ' B' ' 249' ' ' SER . 47.5 mm 57.87 164.33 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.509 2.518 0 O-C-N 121.777 -0.577 . . . . 0.0 110.773 -178.729 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 249' ' ' SER . . . . . 0.682 ' OG ' ' HB1' ' B' ' 254' ' ' ALA . 54.6 p -121.8 148.98 43.98 Favored 'General case' 0 N--CA 1.495 1.801 0 O-C-N 121.499 -0.751 . . . . 0.0 110.236 -179.963 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 250' ' ' VAL . . . . . 0.606 HG23 ' OD1' ' B' ' 251' ' ' ASP . 26.1 m -151.58 -169.5 0.12 Allowed 'Isoleucine or valine' 0 N--CA 1.5 2.061 0 O-C-N 121.687 -0.633 . . . . 0.0 110.118 -178.631 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 251' ' ' ASP . . . . . 0.606 ' OD1' HG23 ' B' ' 250' ' ' VAL . 9.9 m-20 54.08 43.99 29.91 Favored 'General case' 0 N--CA 1.505 2.278 0 O-C-N 121.609 -0.682 . . . . 0.0 111.178 178.063 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 252' ' ' VAL . . . . . 0.448 HG12 ' N ' ' B' ' 253' ' ' ASP . 43.0 t 58.64 165.84 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.51 2.54 0 O-C-N 121.66 -0.65 . . . . 0.0 110.747 177.593 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 253' ' ' ASP . . . . . 0.448 ' N ' HG12 ' B' ' 252' ' ' VAL . 74.5 m-20 53.26 48.59 21.73 Favored 'General case' 0 N--CA 1.506 2.347 0 O-C-N 121.534 -0.729 . . . . 0.0 110.812 178.9 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 254' ' ' ALA . . . . . 0.682 ' HB1' ' OG ' ' B' ' 249' ' ' SER . . . -67.66 -47.4 69.62 Favored 'General case' 0 N--CA 1.498 1.958 0 O-C-N 121.698 -0.626 . . . . 0.0 110.36 -178.635 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 255' ' ' ASP . . . . . . . . . . . . . 74.4 m-20 -74.04 -35.39 64.32 Favored 'General case' 0 N--CA 1.499 1.993 0 O-C-N 121.7 -0.625 . . . . 0.0 110.293 -178.564 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 256' ' ' ALA . . . . . . . . . . . . . . . -63.88 -45.06 91.09 Favored 'General case' 0 N--CA 1.5 2.046 0 O-C-N 121.665 -0.647 . . . . 0.0 110.355 -179.35 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 257' ' ' SER . . . . . . . . . . . . . 33.7 m -55.68 -35.31 65.89 Favored 'General case' 0 N--CA 1.502 2.17 0 O-C-N 121.586 -0.696 . . . . 0.0 110.487 177.745 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 258' ' ' SER . . . . . . . . . . . . . 22.6 t -69.67 -32.82 71.69 Favored 'General case' 0 N--CA 1.498 1.932 0 O-C-N 121.862 -0.524 . . . . 0.0 110.419 -179.401 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 259' ' ' GLN . . . . . . . . . . . . . 99.5 mt-30 -63.22 -37.96 89.29 Favored 'General case' 0 N--CA 1.501 2.082 0 O-C-N 121.57 -0.706 . . . . 0.0 110.634 -178.442 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 260' ' ' LEU . . . . . . . . . . . . . 84.1 mt -69.43 -41.72 75.94 Favored 'General case' 0 N--CA 1.499 1.981 0 O-C-N 121.535 -0.728 . . . . 0.0 110.296 179.915 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 261' ' ' LEU . . . . . 0.503 HD13 ' HA ' ' A' ' 54' ' ' ASP . 32.8 tp -70.26 -40.21 74.53 Favored 'General case' 0 N--CA 1.496 1.872 0 O-C-N 121.572 -0.705 . . . . 0.0 109.915 177.83 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 262' ' ' SER . . . . . . . . . . . . . 86.8 p -63.18 -35.9 81.85 Favored 'General case' 0 N--CA 1.5 2.06 0 O-C-N 121.675 -0.64 . . . . 0.0 110.484 177.374 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 263' ' ' LEU . . . . . . . . . . . . . 25.2 mt -65.7 -41.39 92.42 Favored 'General case' 0 N--CA 1.499 2.005 0 O-C-N 121.631 -0.668 . . . . 0.0 110.456 179.214 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 264' ' ' LEU . . . . . 0.425 HD12 ' HA ' ' B' ' 261' ' ' LEU . 49.5 mt -62.44 -35.87 80.62 Favored 'General case' 0 N--CA 1.502 2.127 0 O-C-N 121.71 -0.618 . . . . 0.0 110.515 178.841 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 265' ' ' LYS . . . . . . . . . . . . . 84.7 tttt -75.88 -45.06 37.47 Favored 'General case' 0 N--CA 1.498 1.947 0 O-C-N 121.642 -0.662 . . . . 0.0 109.988 179.753 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 266' ' ' SER . . . . . . . . . . . . . 85.1 p -82.4 59.16 4.44 Favored 'General case' 0 N--CA 1.497 1.914 0 O-C-N 121.672 -0.642 . . . . 0.0 110.338 178.536 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 267' ' ' SER . . . . . . . . . . . . . 36.2 m -96.73 -65.05 0.99 Allowed 'General case' 0 N--CA 1.495 1.812 0 O-C-N 121.446 -0.784 . . . . 0.0 110.328 -178.555 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 268' ' ' THR . . . . . . . . . . . . . 38.1 p -88.97 -33.15 17.32 Favored 'General case' 0 N--CA 1.497 1.883 0 O-C-N 121.751 -0.593 . . . . 0.0 110.419 -179.269 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 269' ' ' ALA . . . . . . . . . . . . . . . 48.7 62.96 11.2 Favored Pre-proline 0 N--CA 1.507 2.381 0 O-C-N 121.696 -0.627 . . . . 0.0 111.166 -178.348 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 270' ' ' PRO . . . . . . . . . . . . . 29.6 Cg_endo -67.73 148.76 78.13 Favored 'Trans proline' 0 N--CA 1.487 1.143 0 O-C-N 123.555 1.292 . . . . 0.0 110.423 -179.141 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 271' ' ' SER . . . . . . . . . . . . . 73.5 m -94.37 18.74 10.6 Favored 'General case' 0 N--CA 1.497 1.881 0 O-C-N 121.73 -0.606 . . . . 0.0 111.066 179.073 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 272' ' ' ASP . . . . . . . . . . . . . 74.6 m-20 -101.06 31.31 3.68 Favored 'General case' 0 N--CA 1.495 1.819 0 O-C-N 121.306 -0.871 . . . . 0.0 110.317 -179.893 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 273' ' ' LEU . . . . . . . . . . . . . 22.5 tp 59.65 -79.86 0.02 OUTLIER 'General case' 0 N--CA 1.506 2.339 0 O-C-N 121.918 -0.489 . . . . 0.0 111.076 -177.966 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 274' ' ' ALA . . . . . . . . . . . . . . . -166.66 159.74 14.34 Favored 'General case' 0 N--CA 1.498 1.974 0 O-C-N 121.17 -0.956 . . . . 0.0 110.14 -178.509 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 275' ' ' THR . . . . . . . . . . . . . 20.9 m -121.9 81.96 42.61 Favored Pre-proline 0 N--CA 1.496 1.834 0 O-C-N 121.738 -0.601 . . . . 0.0 110.06 178.841 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 276' ' ' PRO . . . . . . . . . . . . . 27.6 Cg_endo -67.05 146.22 76.26 Favored 'Trans proline' 0 N--CA 1.488 1.153 0 O-C-N 123.481 1.253 . . . . 0.0 110.482 -178.509 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 277' ' ' GLN . . . . . . . . . . . . . 13.7 tt0 52.56 57.82 15.04 Favored Pre-proline 0 N--CA 1.505 2.314 0 O-C-N 121.699 -0.626 . . . . 0.0 111.041 179.151 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 278' ' ' PRO . . . . . . . . . . . . . 36.0 Cg_endo -70.4 107.45 1.98 Allowed 'Trans proline' 0 N--CA 1.487 1.093 0 O-C-N 123.475 1.25 . . . . 0.0 110.169 178.175 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 279' ' ' SER . . . . . . . . . . . . . 50.5 m -126.31 141.43 51.91 Favored 'General case' 0 N--CA 1.495 1.781 0 O-C-N 121.631 -0.668 . . . . 0.0 110.318 -179.727 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 280' ' ' THR . . . . . . . . . . . . . 25.0 m -133.67 136.26 44.62 Favored 'General case' 0 N--CA 1.495 1.798 0 O-C-N 121.743 -0.598 . . . . 0.0 110.157 178.651 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 281' ' ' PHE . . . . . . . . . . . . . 51.1 m-85 -145.18 154.15 53.7 Favored Pre-proline 0 N--CA 1.495 1.779 0 O-C-N 121.617 -0.677 . . . . 0.0 110.254 179.856 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 282' ' ' PRO . . . . . . . . . . . . . 32.6 Cg_endo -68.96 151.5 73.57 Favored 'Trans proline' 0 N--CA 1.488 1.199 0 O-C-N 123.662 1.348 . . . . 0.0 110.325 179.244 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 283' ' ' GLN . . . . . . . . . . . . . 51.7 mt-30 -95.95 126.93 42.86 Favored Pre-proline 0 N--CA 1.495 1.795 0 O-C-N 121.594 -0.691 . . . . 0.0 110.047 179.195 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 284' ' ' PRO . . . . . . . . . . . . . 31.8 Cg_endo -68.65 153.16 73.93 Favored 'Trans proline' 0 N--CA 1.488 1.175 0 O-C-N 123.369 1.194 . . . . 0.0 110.292 -179.003 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 285' ' ' PRO . . . . . . . . . . . . . 30.5 Cg_endo -68.34 147.98 72.93 Favored 'Trans proline' 0 N--CA 1.487 1.13 0 O-C-N 123.672 1.354 . . . . 0.0 110.366 179.804 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 286' ' ' VAL . . . . . . . . . . . . . 12.5 p -131.1 138.24 53.86 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.864 0 O-C-N 121.725 -0.609 . . . . 0.0 110.076 179.3 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 287' ' ' GLU . . . . . . . . . . . . . 41.7 tt0 -90.51 -53.11 4.58 Favored 'General case' 0 N--CA 1.495 1.823 0 O-C-N 121.718 -0.614 . . . . 0.0 110.172 -179.873 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 288' ' ' SER . . . . . . . . . . . . . 50.5 m -126.53 151.41 47.92 Favored 'General case' 0 N--CA 1.495 1.792 0 O-C-N 121.674 -0.641 . . . . 0.0 110.294 -179.506 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 289' ' ' HIS . . . . . . . . . . . . . 99.2 m-70 -64.92 -33.49 76.16 Favored 'General case' 0 N--CA 1.5 2.041 0 O-C-N 121.589 -0.695 . . . . 0.0 110.337 179.59 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 290' ' ' SER . . . . . . . . . . . . . 93.2 p -120.72 155.15 34.52 Favored 'General case' 0 N--CA 1.495 1.816 0 O-C-N 121.715 -0.616 . . . . 0.0 110.232 179.871 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 291' ' ' SER . . . . . . . . . . . . . 46.5 m . . . . . 0 N--CA 1.496 1.833 0 CA-C-O 117.994 -1.003 . . . . 0.0 110.169 -179.934 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' -1' ' ' MET . . . . . . . . . . . . . 67.7 mmm . . . . . 0 N--CA 1.491 1.611 0 CA-C-O 121.048 0.451 . . . . 0.0 110.18 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 0' ' ' GLY . . . . . . . . . . . . . . . -174.26 102.62 0.17 Allowed Glycine 0 N--CA 1.493 2.496 0 N-CA-C 109.548 -1.421 . . . . 0.0 109.548 179.829 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 44.7 ttm -101.07 122.23 43.21 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.63 -0.923 . . . . 0.0 109.986 179.607 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 74.3 m -100.99 178.76 4.58 Favored 'General case' 0 N--CA 1.494 1.768 0 O-C-N 121.635 -0.666 . . . . 0.0 110.533 -176.945 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 56.7 t -64.67 -27.97 43.76 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.24 0 O-C-N 121.699 -0.626 . . . . 0.0 110.279 179.716 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -55.06 -30.96 60.72 Favored 'General case' 0 N--CA 1.504 2.235 0 O-C-N 121.452 -0.78 . . . . 0.0 110.393 -179.669 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 74.5 m-20 -68.73 -35.26 76.89 Favored 'General case' 0 N--CA 1.498 1.95 0 C-N-CA 120.413 -0.515 . . . . 0.0 109.968 174.658 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 6' ' ' PHE . . . . . 0.509 ' CE1' HD21 ' B' ' 260' ' ' LEU . 95.0 m-85 -98.05 9.86 41.81 Favored 'General case' 0 N--CA 1.498 1.931 0 O-C-N 121.782 -0.574 . . . . 0.0 111.263 179.072 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -67.48 128.48 36.6 Favored 'General case' 0 N--CA 1.5 2.071 0 O-C-N 121.198 -0.939 . . . . 0.0 110.046 179.533 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 8' ' ' GLY . . . . . 0.471 ' O ' HG13 ' A' ' 24' ' ' VAL . . . 81.98 -0.59 88.35 Favored Glycine 0 N--CA 1.495 2.623 0 N-CA-C 110.757 -0.937 . . . . 0.0 110.757 -175.594 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 49.1 m -76.3 137.34 39.82 Favored 'General case' 0 N--CA 1.497 1.904 0 O-C-N 120.958 -1.319 . . . . 0.0 110.469 178.042 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 14.0 t-20 -84.51 119.12 24.8 Favored 'General case' 0 N--CA 1.497 1.886 0 O-C-N 121.683 -0.636 . . . . 0.0 109.774 174.567 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 11' ' ' VAL . . . . . 0.503 HG12 ' HA ' ' A' ' 57' ' ' ILE . 35.8 m -142.12 162.46 19.53 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.808 0 O-C-N 121.847 -0.533 . . . . 0.0 109.636 -179.872 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 12' ' ' GLU . . . . . 0.454 ' HB2' HD11 ' A' ' 58' ' ' LEU . 48.4 tt0 -109.42 128.45 55.14 Favored 'General case' 0 N--CA 1.494 1.765 0 C-N-CA 119.914 -0.714 . . . . 0.0 110.01 178.05 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 13' ' ' VAL . . . . . 0.582 HG22 ' CD2' ' A' ' 55' ' ' LEU . 60.8 t -106.74 127.71 62.04 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.765 0 O-C-N 121.642 -0.661 . . . . 0.0 109.893 -178.882 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.422 HD13 ' HG2' ' A' ' 20' ' ' LYS . 27.0 tp -95.83 125.87 40.7 Favored 'General case' 0 N--CA 1.493 1.7 0 N-CA-C 109.14 -0.689 . . . . 0.0 109.14 174.327 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 86.6 mt -95.08 167.33 11.45 Favored 'General case' 0 N--CA 1.496 1.828 0 O-C-N 121.6 -0.687 . . . . 0.0 111.102 -172.561 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 24.2 p30 -58.54 -21.9 53.91 Favored 'General case' 0 N--CA 1.507 2.4 0 O-C-N 121.933 -0.479 . . . . 0.0 111.575 -176.786 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 39.2 p-10 -93.06 23.76 4.12 Favored 'General case' 0 N--CA 1.498 1.936 0 O-C-N 121.6 -0.688 . . . . 0.0 110.878 -176.354 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 10.4 m-20 59.09 27.66 16.7 Favored 'General case' 0 N--CA 1.506 2.367 0 O-C-N 121.483 -0.76 . . . . 0.0 110.611 175.579 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 50.9 m -106.52 142.57 35.96 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.492 -0.755 . . . . 0.0 109.61 172.975 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 20' ' ' LYS . . . . . 0.422 ' HG2' HD13 ' A' ' 14' ' ' LEU . 95.0 mttt -109.66 143.68 39.07 Favored 'General case' 0 N--CA 1.494 1.748 0 O-C-N 121.594 -0.691 . . . . 0.0 110.731 -176.668 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -153.1 156.06 37.96 Favored 'General case' 0 N--CA 1.497 1.907 0 O-C-N 121.752 -0.593 . . . . 0.0 110.018 175.96 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 22' ' ' ARG . . . . . 0.436 ' NH1' HD11 ' A' ' 39' ' ' LEU . 40.5 ptt85 -142.64 153.51 43.51 Favored 'General case' 0 N--CA 1.496 1.862 0 O-C-N 121.515 -0.74 . . . . 0.0 110.482 178.545 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 23' ' ' GLY . . . . . 0.438 ' HA2' HD13 ' A' ' 39' ' ' LEU . . . -171.81 171.17 43.96 Favored Glycine 0 N--CA 1.494 2.517 0 N-CA-C 109.051 -1.62 . . . . 0.0 109.051 -178.965 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 24' ' ' VAL . . . . . 0.471 HG13 ' O ' ' A' ' 8' ' ' GLY . 44.6 t -94.65 127.12 46.88 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.898 0 O-C-N 121.604 -0.939 . . . . 0.0 109.305 176.943 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 25' ' ' ILE . . . . . 0.485 ' HA ' HD23 ' A' ' 37' ' ' LEU . 49.2 mt -61.5 138.31 22.32 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.227 0 O-C-N 121.632 -0.668 . . . . 0.0 110.864 -171.01 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 26' ' ' THR . . . . . 0.673 HG21 ' HB2' ' A' ' 38' ' ' ARG . 12.5 p -121.16 -20.53 6.73 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.875 -0.515 . . . . 0.0 111.485 -179.699 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 1.6 t-20 -165.77 158.58 15.32 Favored 'General case' 0 N--CA 1.504 2.262 0 O-C-N 120.902 -1.124 . . . . 0.0 111.798 176.764 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 66.8 t80 -150.27 123.08 8.68 Favored 'General case' 0 N--CA 1.494 1.761 0 N-CA-C 109.177 -0.675 . . . . 0.0 109.177 173.217 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 17.9 t70 -98.05 130.16 44.87 Favored 'General case' 0 N--CA 1.493 1.689 0 N-CA-C 109.106 -0.702 . . . . 0.0 109.106 -177.849 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 23.2 t -69.63 -51.82 31.5 Favored 'General case' 0 N--CA 1.498 1.963 0 C-N-CA 119.981 -0.688 . . . . 0.0 110.648 -175.985 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 22.1 t -59.94 -41.58 92.13 Favored 'General case' 0 N--CA 1.501 2.099 0 O-C-N 121.624 -0.672 . . . . 0.0 110.938 -174.652 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 91.6 m-20 -104.17 -9.88 18.35 Favored 'General case' 0 N--CA 1.497 1.894 0 O-C-N 121.668 -0.645 . . . . 0.0 111.663 -177.453 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 3.7 m 50.13 67.35 0.93 Allowed 'General case' 0 N--CA 1.508 2.431 0 O-C-N 120.971 -1.08 . . . . 0.0 110.85 -174.43 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 34' ' ' ILE . . . . . 1.103 HD12 HG22 ' A' ' 48' ' ' VAL . 44.6 mm -120.67 125.8 74.5 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.024 0 O-C-N 121.598 -0.688 . . . . 0.0 109.332 -175.827 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 10.8 tp -115.9 119.47 36.05 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.691 -0.631 . . . . 0.0 110.548 -169.699 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 44.5 mt-30 -91.0 132.51 35.94 Favored 'General case' 0 N--CA 1.489 1.504 0 N-CA-C 109.304 -0.628 . . . . 0.0 109.304 171.441 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 0.485 HD23 ' HA ' ' A' ' 25' ' ' ILE . 51.4 mt -117.79 123.54 46.21 Favored 'General case' 0 N--CA 1.495 1.789 0 C-N-CA 120.129 -0.628 . . . . 0.0 110.001 175.81 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 38' ' ' ARG . . . . . 0.673 ' HB2' HG21 ' A' ' 26' ' ' THR . 57.1 ttt85 -105.86 106.18 16.57 Favored 'General case' 0 N--CA 1.496 1.85 0 O-C-N 121.753 -0.592 . . . . 0.0 110.191 173.885 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.438 HD13 ' HA2' ' A' ' 23' ' ' GLY . 65.4 tp -83.78 156.76 22.36 Favored 'General case' 0 N--CA 1.499 1.978 0 O-C-N 121.678 -0.639 . . . . 0.0 110.587 -177.138 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -68.19 -3.02 9.23 Favored 'General case' 0 N--CA 1.504 2.226 0 O-C-N 121.903 -0.498 . . . . 0.0 112.178 -170.804 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 91.7 m-20 -86.96 29.1 0.84 Allowed 'General case' 0 N--CA 1.498 1.963 0 O-C-N 121.04 -1.038 . . . . 0.0 110.682 173.84 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 73.1 m-20 60.74 31.67 20.14 Favored 'General case' 0 N--CA 1.505 2.316 0 O-C-N 121.242 -0.911 . . . . 0.0 110.271 175.82 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 73.5 m -125.78 138.33 53.84 Favored 'General case' 0 N--CA 1.494 1.739 0 O-C-N 121.457 -0.777 . . . . 0.0 110.006 177.212 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 9.3 t -128.18 148.88 50.63 Favored 'General case' 0 N--CA 1.497 1.881 0 O-C-N 121.659 -0.651 . . . . 0.0 110.042 179.955 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 45' ' ' LYS . . . . . 0.445 ' HD3' HD11 ' A' ' 47' ' ' ILE . 79.2 tttt -150.37 136.09 18.28 Favored 'General case' 0 N--CA 1.495 1.822 0 O-C-N 121.718 -0.614 . . . . 0.0 110.584 -178.32 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 89.8 p -94.39 121.49 35.98 Favored 'General case' 0 N--CA 1.494 1.769 0 O-C-N 121.718 -0.614 . . . . 0.0 110.073 176.935 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 47' ' ' ILE . . . . . 0.445 HD11 ' HD3' ' A' ' 45' ' ' LYS . 79.7 mt -129.2 135.09 62.71 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.837 0 O-C-N 121.602 -0.686 . . . . 0.0 109.44 -179.424 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 48' ' ' VAL . . . . . 1.103 HG22 HD12 ' A' ' 34' ' ' ILE . 62.1 t -82.31 127.63 39.46 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.929 0 N-CA-C 109.265 -0.643 . . . . 0.0 109.265 179.032 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 57.7 p -58.36 -25.0 61.51 Favored 'General case' 0 N--CA 1.507 2.382 0 O-C-N 121.533 -0.729 . . . . 0.0 111.814 -169.148 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 49.0 tptt -56.87 -26.1 57.98 Favored 'General case' 0 N--CA 1.5 2.061 0 O-C-N 121.414 -0.804 . . . . 0.0 111.069 -177.049 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 5.3 p30 -84.64 5.88 26.27 Favored 'General case' 0 N--CA 1.499 2.009 0 C-N-CA 119.676 -0.809 . . . . 0.0 111.33 176.501 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 98.7 mt -75.32 126.46 36.11 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.107 0 O-C-N 121.184 -0.948 . . . . 0.0 109.988 175.726 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 77.0 tttt -92.91 -29.35 15.96 Favored 'General case' 0 N--CA 1.494 1.768 0 O-C-N 121.803 -0.561 . . . . 0.0 109.887 170.708 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 54' ' ' ASP . . . . . 0.408 ' HA ' HD22 ' B' ' 261' ' ' LEU . 5.4 m-20 -163.63 154.6 16.24 Favored 'General case' 0 N--CA 1.5 2.075 0 O-C-N 121.76 -0.587 . . . . 0.0 110.168 -177.926 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 55' ' ' LEU . . . . . 0.582 ' CD2' HG22 ' A' ' 13' ' ' VAL . 83.9 mt -132.98 150.5 52.16 Favored 'General case' 0 N--CA 1.497 1.899 0 O-C-N 121.71 -0.619 . . . . 0.0 110.424 -179.163 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 4.5 ptm180 -152.66 141.91 21.48 Favored 'General case' 0 N--CA 1.495 1.791 0 O-C-N 121.757 -0.589 . . . . 0.0 109.869 174.83 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 57' ' ' ILE . . . . . 0.503 ' HA ' HG12 ' A' ' 11' ' ' VAL . 69.4 mt -85.19 133.34 29.61 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.883 0 O-C-N 121.453 -0.779 . . . . 0.0 109.864 174.472 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 58' ' ' LEU . . . . . 0.454 HD11 ' HB2' ' A' ' 12' ' ' GLU . 63.9 mt -82.27 163.03 54.55 Favored Pre-proline 0 N--CA 1.497 1.923 0 O-C-N 121.591 -0.693 . . . . 0.0 110.113 -179.031 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 21.4 Cg_exo -61.35 -62.38 0.13 Allowed 'Trans proline' 0 N--CA 1.49 1.285 0 O-C-N 123.635 1.334 . . . . 0.0 110.882 -176.992 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 82.7 tttt 58.66 -78.26 0.02 OUTLIER 'General case' 0 N--CA 1.507 2.401 0 O-C-N 122.012 -0.43 . . . . 0.0 111.098 -177.048 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 15.4 t-20 53.73 47.48 23.65 Favored 'General case' 0 N--CA 1.505 2.276 0 O-C-N 121.083 -1.011 . . . . 0.0 110.965 179.98 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 41.9 tt0 -92.02 128.53 37.9 Favored 'General case' 0 N--CA 1.496 1.837 0 O-C-N 121.555 -0.715 . . . . 0.0 110.023 179.751 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 84.0 mt -69.53 -34.14 60.35 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.033 0 O-C-N 121.744 -0.598 . . . . 0.0 109.9 -179.477 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 64' ' ' MET . . . . . . . . . . . . . 41.3 mtp 57.87 160.75 0.09 OUTLIER Pre-proline 0 N--CA 1.508 2.447 0 O-C-N 121.866 -0.521 . . . . 0.0 111.161 -178.322 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 38.3 Cg_endo -71.91 66.86 3.22 Favored 'Trans proline' 0 N--CA 1.487 1.122 0 O-C-N 123.34 1.179 . . . . 0.0 110.398 179.482 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 59.2 tttt -149.33 125.67 10.85 Favored 'General case' 0 N--CA 1.496 1.826 0 O-C-N 121.499 -0.75 . . . . 0.0 110.046 179.441 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 91.7 m-20 -134.23 -63.71 0.71 Allowed 'General case' 0 N--CA 1.495 1.805 0 O-C-N 121.725 -0.61 . . . . 0.0 110.09 178.991 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . -156.93 -49.49 0.01 OUTLIER Glycine 0 N--CA 1.493 2.477 0 N-CA-C 109.343 -1.503 . . . . 0.0 109.343 179.244 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 9.3 t -136.62 158.54 44.19 Favored 'General case' 0 N--CA 1.496 1.868 0 O-C-N 121.707 -0.878 . . . . 0.0 110.297 179.194 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 82.8 tttt -90.51 134.35 34.43 Favored 'General case' 0 N--CA 1.496 1.844 0 O-C-N 121.719 -0.613 . . . . 0.0 110.138 179.39 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 18.7 p -83.48 154.66 65.95 Favored Pre-proline 0 N--CA 1.498 1.937 0 O-C-N 121.773 -0.579 . . . . 0.0 110.214 -179.225 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 29.0 Cg_endo -67.46 149.87 80.33 Favored 'Trans proline' 0 N--CA 1.488 1.151 0 O-C-N 123.67 1.352 . . . . 0.0 110.426 -179.695 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 87.4 p -91.69 161.7 14.79 Favored 'General case' 0 N--CA 1.496 1.831 0 O-C-N 121.615 -0.678 . . . . 0.0 110.103 179.162 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 44.1 p -127.24 -42.59 1.68 Allowed 'General case' 0 N--CA 1.497 1.924 0 O-C-N 121.648 -0.658 . . . . 0.0 110.502 -178.792 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 91.7 m-20 -94.29 143.46 26.37 Favored 'General case' 0 N--CA 1.495 1.804 0 O-C-N 121.605 -0.684 . . . . 0.0 110.22 -179.645 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 73.3 p -112.06 150.72 30.27 Favored 'General case' 0 N--CA 1.496 1.842 0 O-C-N 121.693 -0.63 . . . . 0.0 110.277 -179.494 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 42.6 p -76.98 -33.61 57.6 Favored 'General case' 0 N--CA 1.498 1.948 0 O-C-N 121.712 -0.618 . . . . 0.0 110.248 -179.697 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 16.4 pttp -157.16 44.71 0.37 Allowed 'General case' 0 N--CA 1.496 1.869 0 O-C-N 121.583 -0.698 . . . . 0.0 110.444 -179.568 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 79' ' ' LEU . . . . . 0.444 HD13 ' HA ' ' A' ' 79' ' ' LEU . 4.6 mm? 52.09 -172.43 0.03 OUTLIER 'General case' 0 N--CA 1.506 2.356 0 O-C-N 121.538 -0.726 . . . . 0.0 111.003 -179.596 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 73.1 tttt -131.51 136.25 47.73 Favored 'General case' 0 N--CA 1.496 1.829 0 O-C-N 121.628 -0.67 . . . . 0.0 110.206 -179.943 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 94.6 p -119.09 154.38 33.29 Favored 'General case' 0 N--CA 1.495 1.81 0 O-C-N 121.64 -0.662 . . . . 0.0 110.075 179.54 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -124.42 -45.01 1.97 Allowed 'General case' 0 N--CA 1.494 1.771 0 O-C-N 121.594 -0.691 . . . . 0.0 110.298 -179.381 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 54.8 mt-10 -104.35 157.24 17.28 Favored 'General case' 0 N--CA 1.495 1.776 0 O-C-N 121.64 -0.663 . . . . 0.0 110.233 -179.1 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 24.1 m -86.12 135.17 33.71 Favored 'General case' 0 N--CA 1.497 1.893 0 O-C-N 121.763 -0.586 . . . . 0.0 109.98 179.56 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 41.1 p90 -149.21 160.03 43.74 Favored 'General case' 0 N--CA 1.495 1.805 0 O-C-N 121.666 -0.646 . . . . 0.0 110.377 -178.071 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 15.4 m -84.7 -35.89 22.23 Favored 'General case' 0 N--CA 1.497 1.877 0 O-C-N 121.708 -0.62 . . . . 0.0 109.958 177.006 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 90.3 p -150.45 162.19 41.07 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.772 -0.58 . . . . 0.0 110.152 178.88 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 40.5 mtmt -99.88 125.03 45.79 Favored 'General case' 0 N--CA 1.495 1.789 0 O-C-N 121.67 -0.644 . . . . 0.0 110.369 -179.891 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 92.2 m-20 -133.75 27.88 3.94 Favored 'General case' 0 N--CA 1.496 1.858 0 O-C-N 121.686 -0.633 . . . . 0.0 110.449 177.391 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 72.2 mttt -139.08 149.3 44.41 Favored 'General case' 0 N--CA 1.496 1.835 0 O-C-N 121.624 -0.673 . . . . 0.0 110.107 -179.56 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 91' ' ' TRP . . . . . . . . . . . . . 62.3 p-90 -147.7 32.86 0.86 Allowed 'General case' 0 N--CA 1.497 1.88 0 O-C-N 121.633 -0.667 . . . . 0.0 110.323 179.733 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 88.4 p -129.42 153.01 48.34 Favored 'General case' 0 N--CA 1.495 1.811 0 O-C-N 121.606 -0.684 . . . . 0.0 110.255 -179.799 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 93' ' ' MET . . . . . . . . . . . . . 89.4 mtp -67.38 -35.07 78.59 Favored 'General case' 0 N--CA 1.499 2.011 0 O-C-N 121.68 -0.637 . . . . 0.0 110.29 179.583 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 74.4 m-20 . . . . . 0 N--CA 1.495 1.802 0 CA-C-O 118.021 -0.99 . . . . 0.0 110.256 -179.831 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' B' B ' 240' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.272 0 N-CA-C 109.536 -1.426 . . . . 0.0 109.536 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' B' B ' 241' ' ' ALA . . . . . . . . . . . . . . . -68.07 -37.67 81.54 Favored 'General case' 0 N--CA 1.499 2.002 0 O-C-N 121.702 -0.881 . . . . 0.0 110.272 -179.651 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 242' ' ' THR . . . . . 0.494 HG22 ' O ' ' B' ' 244' ' ' LYS . 22.6 m -125.61 130.31 51.39 Favored 'General case' 0 N--CA 1.496 1.832 0 O-C-N 121.713 -0.617 . . . . 0.0 110.237 179.812 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 243' ' ' THR . . . . . . . . . . . . . 22.6 m -70.86 -40.69 72.16 Favored 'General case' 0 N--CA 1.499 1.981 0 O-C-N 121.67 -0.643 . . . . 0.0 110.27 -179.236 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 244' ' ' LYS . . . . . 0.494 ' O ' HG22 ' B' ' 242' ' ' THR . 78.7 mttt -118.07 157.33 27.04 Favored 'General case' 0 N--CA 1.496 1.856 0 O-C-N 121.671 -0.643 . . . . 0.0 110.265 -178.275 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 245' ' ' GLU . . . . . . . . . . . . . 78.8 mt-10 -94.11 67.09 3.59 Favored 'General case' 0 N--CA 1.496 1.85 0 O-C-N 121.748 -0.595 . . . . 0.0 110.237 -179.019 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 246' ' ' LYS . . . . . . . . . . . . . 50.7 tptt 53.31 94.9 0.02 OUTLIER 'General case' 0 N--CA 1.505 2.304 0 O-C-N 121.454 -0.779 . . . . 0.0 111.025 179.436 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 247' ' ' ASN . . . . . . . . . . . . . 30.1 m120 -78.38 -177.37 5.19 Favored 'General case' 0 N--CA 1.499 1.978 0 O-C-N 121.657 -0.652 . . . . 0.0 110.206 -179.204 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 248' ' ' ILE . . . . . . . . . . . . . 84.3 mt 58.82 -81.77 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.508 2.431 0 O-C-N 122.017 -0.427 . . . . 0.0 110.84 -179.476 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 249' ' ' SER . . . . . . . . . . . . . 33.0 t -112.29 144.08 42.3 Favored 'General case' 0 N--CA 1.495 1.805 0 O-C-N 121.152 -0.968 . . . . 0.0 110.342 -177.411 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 250' ' ' VAL . . . . . . . . . . . . . 58.4 t -85.61 -32.39 7.08 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.983 0 O-C-N 121.71 -0.619 . . . . 0.0 109.735 178.73 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 251' ' ' ASP . . . . . 0.528 ' OD1' HG23 ' B' ' 252' ' ' VAL . 12.7 t70 -161.18 164.72 30.31 Favored 'General case' 0 N--CA 1.494 1.754 0 O-C-N 121.661 -0.649 . . . . 0.0 110.03 179.366 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 252' ' ' VAL . . . . . 0.528 HG23 ' OD1' ' B' ' 251' ' ' ASP . 40.1 t 58.0 164.18 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.509 2.486 0 O-C-N 121.719 -0.613 . . . . 0.0 110.563 -177.955 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 253' ' ' ASP . . . . . 0.422 ' N ' HG12 ' B' ' 252' ' ' VAL . 1.3 m-20 -157.63 166.88 31.67 Favored 'General case' 0 N--CA 1.496 1.842 0 O-C-N 121.526 -0.734 . . . . 0.0 110.037 -178.048 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 254' ' ' ALA . . . . . . . . . . . . . . . -66.66 -29.48 69.51 Favored 'General case' 0 N--CA 1.502 2.145 0 O-C-N 121.78 -0.575 . . . . 0.0 110.492 179.733 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 255' ' ' ASP . . . . . . . . . . . . . 74.4 m-20 -72.13 -29.04 63.66 Favored 'General case' 0 N--CA 1.499 1.977 0 O-C-N 121.634 -0.666 . . . . 0.0 110.396 179.937 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 256' ' ' ALA . . . . . . . . . . . . . . . -62.77 -30.65 71.61 Favored 'General case' 0 N--CA 1.501 2.091 0 O-C-N 121.557 -0.714 . . . . 0.0 110.303 177.777 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 257' ' ' SER . . . . . . . . . . . . . 69.2 m -54.36 -34.93 62.15 Favored 'General case' 0 N--CA 1.503 2.186 0 O-C-N 121.682 -0.636 . . . . 0.0 110.48 176.728 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 258' ' ' SER . . . . . . . . . . . . . 27.6 m -68.27 -31.43 70.88 Favored 'General case' 0 N--CA 1.499 2.009 0 C-N-CA 120.438 -0.505 . . . . 0.0 110.296 179.186 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 259' ' ' GLN . . . . . . . . . . . . . 58.4 tp60 -63.59 -37.31 86.85 Favored 'General case' 0 N--CA 1.501 2.075 0 O-C-N 121.638 -0.664 . . . . 0.0 110.64 -179.472 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 260' ' ' LEU . . . . . 0.509 HD21 ' CE1' ' A' ' 6' ' ' PHE . 83.2 mt -70.89 -43.86 67.48 Favored 'General case' 0 N--CA 1.499 1.983 0 O-C-N 121.524 -0.735 . . . . 0.0 110.214 179.946 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 261' ' ' LEU . . . . . 0.408 HD22 ' HA ' ' A' ' 54' ' ' ASP . 24.2 tp -69.1 -39.04 79.24 Favored 'General case' 0 N--CA 1.498 1.963 0 O-C-N 121.737 -0.602 . . . . 0.0 109.844 178.023 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 262' ' ' SER . . . . . . . . . . . . . 84.9 p -62.99 -34.78 78.28 Favored 'General case' 0 N--CA 1.499 2.019 0 O-C-N 121.687 -0.633 . . . . 0.0 110.611 177.539 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 263' ' ' LEU . . . . . . . . . . . . . 23.5 mt -65.45 -41.84 92.99 Favored 'General case' 0 N--CA 1.501 2.105 0 O-C-N 121.58 -0.7 . . . . 0.0 110.357 179.409 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 264' ' ' LEU . . . . . 0.482 ' CD1' HD11 ' A' ' 55' ' ' LEU . 84.1 mt -62.28 -37.8 86.89 Favored 'General case' 0 N--CA 1.501 2.123 0 O-C-N 121.624 -0.673 . . . . 0.0 110.421 178.224 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 265' ' ' LYS . . . . . . . . . . . . . 75.8 mttt -76.47 -33.17 58.7 Favored 'General case' 0 N--CA 1.497 1.897 0 O-C-N 121.747 -0.596 . . . . 0.0 110.235 179.392 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 266' ' ' SER . . . . . . . . . . . . . 84.7 p -78.93 164.77 24.15 Favored 'General case' 0 N--CA 1.498 1.966 0 O-C-N 121.744 -0.597 . . . . 0.0 110.213 -179.716 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 267' ' ' SER . . . . . . . . . . . . . 85.8 p -75.86 165.68 24.64 Favored 'General case' 0 N--CA 1.499 1.979 0 O-C-N 121.731 -0.606 . . . . 0.0 110.185 -179.742 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 268' ' ' THR . . . . . . . . . . . . . 40.1 p -118.68 168.66 10.51 Favored 'General case' 0 N--CA 1.496 1.856 0 O-C-N 121.71 -0.619 . . . . 0.0 110.115 -179.629 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 269' ' ' ALA . . . . . . . . . . . . . . . 49.46 88.05 0.12 Allowed Pre-proline 0 N--CA 1.506 2.338 0 O-C-N 121.679 -0.638 . . . . 0.0 111.19 -178.568 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 270' ' ' PRO . . . . . . . . . . . . . 20.6 Cg_exo -62.18 147.24 95.39 Favored 'Trans proline' 0 N--CA 1.491 1.333 0 O-C-N 123.553 1.291 . . . . 0.0 110.66 -179.98 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 271' ' ' SER . . . . . . . . . . . . . 88.7 p -66.49 -29.76 69.94 Favored 'General case' 0 N--CA 1.5 2.042 0 O-C-N 121.651 -0.656 . . . . 0.0 110.595 179.773 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 272' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -63.05 -32.71 74.15 Favored 'General case' 0 N--CA 1.501 2.125 0 O-C-N 121.589 -0.694 . . . . 0.0 110.549 -179.819 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 273' ' ' LEU . . . . . . . . . . . . . 81.2 mt 52.63 -168.66 0.05 OUTLIER 'General case' 0 N--CA 1.507 2.375 0 O-C-N 121.693 -0.629 . . . . 0.0 110.987 179.976 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 274' ' ' ALA . . . . . . . . . . . . . . . -165.54 165.11 19.19 Favored 'General case' 0 N--CA 1.497 1.887 0 O-C-N 121.637 -0.665 . . . . 0.0 110.008 -179.722 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 275' ' ' THR . . . . . . . . . . . . . 23.7 p -117.31 87.37 24.1 Favored Pre-proline 0 N--CA 1.494 1.761 0 O-C-N 121.674 -0.641 . . . . 0.0 110.186 -179.117 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 276' ' ' PRO . . . . . . . . . . . . . 25.1 Cg_endo -66.0 -29.34 49.02 Favored 'Trans proline' 0 N--CA 1.489 1.247 0 O-C-N 123.537 1.283 . . . . 0.0 110.728 179.35 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 277' ' ' GLN . . . . . . . . . . . . . 9.2 pt20 -65.05 157.66 75.35 Favored Pre-proline 0 N--CA 1.501 2.102 0 O-C-N 121.495 -0.753 . . . . 0.0 110.584 -179.263 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 278' ' ' PRO . . . . . . . . . . . . . 26.7 Cg_endo -66.5 161.21 42.21 Favored 'Trans proline' 0 N--CA 1.488 1.19 0 O-C-N 123.698 1.367 . . . . 0.0 110.49 -179.602 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 279' ' ' SER . . . . . . . . . . . . . 29.9 t -97.24 151.41 19.88 Favored 'General case' 0 N--CA 1.496 1.845 0 O-C-N 121.772 -0.58 . . . . 0.0 110.206 -179.826 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 280' ' ' THR . . . . . . . . . . . . . 42.6 p -81.71 160.8 23.58 Favored 'General case' 0 N--CA 1.498 1.946 0 O-C-N 121.742 -0.599 . . . . 0.0 110.164 -179.147 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 281' ' ' PHE . . . . . . . . . . . . . 9.9 t80 -141.64 144.59 33.79 Favored Pre-proline 0 N--CA 1.495 1.785 0 O-C-N 121.673 -0.642 . . . . 0.0 109.977 -179.415 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 282' ' ' PRO . . . . . . . . . . . . . 19.2 Cg_endo -64.02 -50.61 2.83 Favored 'Trans proline' 0 N--CA 1.49 1.319 0 O-C-N 123.453 1.239 . . . . 0.0 110.601 -178.864 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 283' ' ' GLN . . . . . . . . . . . . . 31.2 mt-30 -79.08 162.57 63.91 Favored Pre-proline 0 N--CA 1.497 1.897 0 O-C-N 121.68 -0.638 . . . . 0.0 110.077 178.572 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 284' ' ' PRO . . . . . . . . . . . . . 17.6 Cg_exo -62.95 151.96 81.73 Favored 'Trans proline' 0 N--CA 1.489 1.248 0 O-C-N 123.605 1.318 . . . . 0.0 110.595 -178.932 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 285' ' ' PRO . . . . . . . . . . . . . 31.3 Cg_endo -68.55 161.13 46.39 Favored 'Trans proline' 0 N--CA 1.488 1.177 0 O-C-N 123.604 1.318 . . . . 0.0 110.346 -179.963 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 286' ' ' VAL . . . . . . . . . . . . . 60.5 t -100.11 135.76 34.45 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.909 0 O-C-N 121.698 -0.626 . . . . 0.0 109.668 179.273 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 287' ' ' GLU . . . . . . . . . . . . . 13.2 pt-20 -63.16 136.06 57.53 Favored 'General case' 0 N--CA 1.502 2.134 0 O-C-N 121.698 -0.627 . . . . 0.0 110.743 -178.691 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 288' ' ' SER . . . . . . . . . . . . . 51.1 m -129.76 151.05 50.76 Favored 'General case' 0 N--CA 1.495 1.777 0 O-C-N 121.742 -0.599 . . . . 0.0 110.179 179.617 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 289' ' ' HIS . . . . . . . . . . . . . 99.1 m-70 -112.13 135.17 53.13 Favored 'General case' 0 N--CA 1.495 1.803 0 O-C-N 121.602 -0.686 . . . . 0.0 110.184 179.853 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 290' ' ' SER . . . . . . . . . . . . . 27.4 m -65.71 -34.48 78.3 Favored 'General case' 0 N--CA 1.5 2.051 0 O-C-N 121.612 -0.68 . . . . 0.0 110.384 179.932 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 291' ' ' SER . . . . . . . . . . . . . 18.7 t . . . . . 0 N--CA 1.495 1.792 0 CA-C-O 117.979 -1.01 . . . . 0.0 110.268 179.967 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' -1' ' ' MET . . . . . . . . . . . . . 49.0 ttm . . . . . 0 N--CA 1.492 1.644 0 CA-C-O 120.975 0.417 . . . . 0.0 110.211 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 0' ' ' GLY . . . . . . . . . . . . . . . -83.88 -177.71 51.6 Favored Glycine 0 N--CA 1.494 2.518 0 N-CA-C 109.509 -1.437 . . . . 0.0 109.509 179.709 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 89.9 mtp -111.97 141.04 46.12 Favored 'General case' 0 N--CA 1.496 1.85 0 O-C-N 121.703 -0.88 . . . . 0.0 110.227 -179.968 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 69.8 m -101.09 167.22 10.37 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.626 -0.671 . . . . 0.0 110.021 179.536 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 3' ' ' VAL . . . . . 0.43 HG12 ' CE1' ' A' ' 7' ' ' TYR . 79.8 t -66.67 -27.81 41.23 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.036 0 O-C-N 121.58 -0.7 . . . . 0.0 110.263 -179.684 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -55.15 -30.83 60.61 Favored 'General case' 0 N--CA 1.505 2.315 0 O-C-N 121.461 -0.774 . . . . 0.0 110.389 -178.925 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 74.6 m-20 -68.76 -30.52 69.14 Favored 'General case' 0 N--CA 1.499 2.025 0 O-C-N 121.813 -0.555 . . . . 0.0 110.223 174.821 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 96.2 m-85 -95.4 10.07 37.69 Favored 'General case' 0 N--CA 1.498 1.953 0 O-C-N 121.645 -0.659 . . . . 0.0 111.512 -178.367 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 7' ' ' TYR . . . . . 0.43 ' CE1' HG12 ' A' ' 3' ' ' VAL . 3.7 m-30 -67.18 137.82 56.53 Favored 'General case' 0 N--CA 1.502 2.16 0 O-C-N 121.131 -0.98 . . . . 0.0 110.106 173.979 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 8' ' ' GLY . . . . . 0.433 ' O ' HG13 ' A' ' 24' ' ' VAL . . . 83.07 -1.08 89.3 Favored Glycine 0 N--CA 1.496 2.694 0 N-CA-C 110.718 -0.953 . . . . 0.0 110.718 -177.352 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 68.9 m -77.2 136.82 38.58 Favored 'General case' 0 N--CA 1.499 1.979 0 O-C-N 121.031 -1.276 . . . . 0.0 110.417 177.747 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 16.1 t-20 -84.16 117.11 23.27 Favored 'General case' 0 N--CA 1.498 1.944 0 O-C-N 121.633 -0.667 . . . . 0.0 109.628 173.4 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 11' ' ' VAL . . . . . 0.522 HG12 ' HA ' ' A' ' 57' ' ' ILE . 35.7 m -142.71 162.7 17.99 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.705 0 N-CA-C 109.387 -0.597 . . . . 0.0 109.387 -178.206 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 12' ' ' GLU . . . . . 0.464 ' HB2' HD11 ' A' ' 58' ' ' LEU . 45.3 tt0 -109.34 130.3 55.5 Favored 'General case' 0 N--CA 1.492 1.661 0 C-N-CA 119.838 -0.745 . . . . 0.0 109.863 176.918 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 60.0 t -106.69 126.67 62.54 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.679 0 O-C-N 121.623 -0.673 . . . . 0.0 109.841 -179.597 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 27.1 tp -95.93 130.22 42.96 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.697 -0.627 . . . . 0.0 109.358 176.512 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 86.3 mt -97.38 160.12 14.51 Favored 'General case' 0 N--CA 1.496 1.875 0 O-C-N 121.59 -0.694 . . . . 0.0 111.067 -174.25 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 24.4 p30 -58.24 -21.87 49.95 Favored 'General case' 0 N--CA 1.506 2.345 0 O-C-N 121.756 -0.59 . . . . 0.0 111.503 -178.477 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 38.3 p-10 -93.14 23.93 4.07 Favored 'General case' 0 N--CA 1.498 1.927 0 O-C-N 121.5 -0.75 . . . . 0.0 110.778 -177.154 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 74.3 m-20 59.42 28.08 17.35 Favored 'General case' 0 N--CA 1.505 2.322 0 O-C-N 121.493 -0.754 . . . . 0.0 110.644 175.8 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 51.0 m -104.04 141.43 36.22 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.57 -0.706 . . . . 0.0 109.516 171.964 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 52.8 mttp -109.69 143.43 39.47 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.593 -0.692 . . . . 0.0 110.553 -176.013 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -153.1 154.6 35.16 Favored 'General case' 0 N--CA 1.497 1.889 0 O-C-N 121.722 -0.612 . . . . 0.0 110.3 176.477 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 31.0 ptt180 -144.07 154.98 43.78 Favored 'General case' 0 N--CA 1.498 1.947 0 O-C-N 121.705 -0.622 . . . . 0.0 110.463 177.573 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 23' ' ' GLY . . . . . 0.469 ' HA2' HD13 ' A' ' 39' ' ' LEU . . . -171.93 171.18 44.0 Favored Glycine 0 N--CA 1.494 2.522 0 N-CA-C 109.237 -1.545 . . . . 0.0 109.237 -178.967 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 24' ' ' VAL . . . . . 0.433 HG13 ' O ' ' A' ' 8' ' ' GLY . 41.0 t -94.5 119.51 42.58 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.926 0 O-C-N 121.596 -0.944 . . . . 0.0 109.02 174.252 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 25' ' ' ILE . . . . . 0.409 HD11 HG21 ' A' ' 11' ' ' VAL . 76.0 mt -63.52 143.75 15.31 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.23 0 CA-C-O 121.304 0.573 . . . . 0.0 110.66 -167.749 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 26' ' ' THR . . . . . 0.711 HG21 ' HG3' ' A' ' 38' ' ' ARG . 2.3 p -121.15 -25.87 5.21 Favored 'General case' 0 N--CA 1.494 1.768 0 O-C-N 121.831 -0.543 . . . . 0.0 111.379 179.934 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 27' ' ' ASN . . . . . 0.555 ' O ' HD12 ' A' ' 35' ' ' LEU . 7.3 t30 -163.94 160.0 21.5 Favored 'General case' 0 N--CA 1.501 2.091 0 O-C-N 120.952 -1.092 . . . . 0.0 111.774 -179.844 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 28' ' ' PHE . . . . . 0.569 ' HE1' HG21 ' A' ' 49' ' ' THR . 91.5 t80 -150.1 128.78 12.37 Favored 'General case' 0 N--CA 1.5 2.028 0 N-CA-C 109.223 -0.658 . . . . 0.0 109.223 170.279 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 20.2 t0 -98.86 130.84 45.29 Favored 'General case' 0 N--CA 1.49 1.559 0 N-CA-C 108.941 -0.763 . . . . 0.0 108.941 179.994 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 88.6 p -70.84 -51.48 26.31 Favored 'General case' 0 N--CA 1.497 1.922 0 C-N-CA 119.98 -0.688 . . . . 0.0 110.686 -175.175 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 6.3 t -61.25 -40.47 94.18 Favored 'General case' 0 N--CA 1.501 2.124 0 O-C-N 121.517 -0.74 . . . . 0.0 110.718 -175.737 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 28.8 m120 -103.27 -9.07 19.83 Favored 'General case' 0 N--CA 1.498 1.941 0 O-C-N 121.738 -0.601 . . . . 0.0 111.615 -176.877 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 28.6 p 46.79 67.13 0.83 Allowed 'General case' 0 N--CA 1.509 2.477 0 O-C-N 121.385 -0.822 . . . . 0.0 111.266 -175.009 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 34' ' ' ILE . . . . . 1.07 HD12 HG22 ' A' ' 48' ' ' VAL . 46.0 mm -122.53 125.83 73.2 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.059 0 N-CA-C 109.138 -0.69 . . . . 0.0 109.138 -176.881 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.555 HD12 ' O ' ' A' ' 27' ' ' ASN . 12.5 tp -115.98 122.25 44.69 Favored 'General case' 0 N--CA 1.495 1.776 0 O-C-N 121.677 -0.639 . . . . 0.0 110.7 -169.888 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 77.9 mt-30 -90.93 142.1 28.13 Favored 'General case' 0 N--CA 1.489 1.524 0 N-CA-C 109.358 -0.608 . . . . 0.0 109.358 171.097 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 6.4 mt -133.53 123.57 25.41 Favored 'General case' 0 N--CA 1.495 1.803 0 O-C-N 121.76 -0.588 . . . . 0.0 109.783 178.846 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 38' ' ' ARG . . . . . 0.711 ' HG3' HG21 ' A' ' 26' ' ' THR . 23.2 mtm180 -102.25 104.83 15.41 Favored 'General case' 0 N--CA 1.496 1.863 0 O-C-N 121.738 -0.601 . . . . 0.0 110.38 173.392 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.469 HD13 ' HA2' ' A' ' 23' ' ' GLY . 62.8 tp -84.19 157.33 21.68 Favored 'General case' 0 N--CA 1.497 1.901 0 O-C-N 121.509 -0.744 . . . . 0.0 110.49 -177.946 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -66.43 -2.91 5.09 Favored 'General case' 0 N--CA 1.504 2.227 0 O-C-N 121.911 -0.493 . . . . 0.0 112.126 -171.154 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 91.4 m-20 -84.87 28.98 0.65 Allowed 'General case' 0 N--CA 1.499 1.993 0 O-C-N 121.112 -0.993 . . . . 0.0 110.856 172.267 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 74.4 m-20 59.43 31.17 20.87 Favored 'General case' 0 N--CA 1.504 2.272 0 O-C-N 121.108 -0.995 . . . . 0.0 110.433 174.148 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 50.8 m -126.26 137.76 53.55 Favored 'General case' 0 N--CA 1.496 1.847 0 O-C-N 121.498 -0.751 . . . . 0.0 110.517 178.99 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 10.0 t -102.36 151.11 22.65 Favored 'General case' 0 N--CA 1.497 1.882 0 O-C-N 121.864 -0.523 . . . . 0.0 110.105 174.629 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 69.5 mttt -149.04 123.79 9.87 Favored 'General case' 0 N--CA 1.496 1.87 0 O-C-N 121.574 -0.704 . . . . 0.0 110.741 178.939 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 92.6 p -97.45 118.52 34.11 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.792 -0.568 . . . . 0.0 110.122 177.551 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 82.6 mt -129.34 140.1 50.03 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.842 0 O-C-N 121.675 -0.641 . . . . 0.0 109.369 179.665 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 48' ' ' VAL . . . . . 1.07 HG22 HD12 ' A' ' 34' ' ' ILE . 58.1 t -81.85 127.65 39.42 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.863 0 C-N-CA 119.981 -0.688 . . . . 0.0 109.164 178.694 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 49' ' ' THR . . . . . 0.569 HG21 ' HE1' ' A' ' 28' ' ' PHE . 38.7 p -60.42 -27.18 67.27 Favored 'General case' 0 N--CA 1.502 2.128 0 O-C-N 121.62 -0.675 . . . . 0.0 111.926 -171.005 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 50.3 mmtt -58.58 -25.03 62.13 Favored 'General case' 0 N--CA 1.501 2.122 0 O-C-N 121.531 -0.731 . . . . 0.0 111.363 -173.776 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 6.4 p30 -82.44 -1.16 49.3 Favored 'General case' 0 N--CA 1.498 1.967 0 C-N-CA 119.635 -0.826 . . . . 0.0 111.084 176.41 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 52' ' ' ILE . . . . . 0.624 HG21 HD11 ' A' ' 55' ' ' LEU . 75.3 mt -79.66 133.92 28.74 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.102 0 O-C-N 121.185 -0.947 . . . . 0.0 110.131 177.317 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 47.2 tptt -92.38 -27.51 17.48 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.854 -0.529 . . . . 0.0 109.928 171.412 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 54' ' ' ASP . . . . . 0.489 ' HA ' HD13 ' B' ' 261' ' ' LEU . 1.5 m-20 -164.34 155.5 15.53 Favored 'General case' 0 N--CA 1.502 2.17 0 O-C-N 121.684 -0.635 . . . . 0.0 110.47 -176.211 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 55' ' ' LEU . . . . . 0.624 HD11 HG21 ' A' ' 52' ' ' ILE . 4.7 mp -132.91 155.36 49.2 Favored 'General case' 0 N--CA 1.497 1.88 0 O-C-N 121.877 -0.514 . . . . 0.0 110.175 178.191 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 19.6 ptp180 -151.6 148.93 28.57 Favored 'General case' 0 N--CA 1.497 1.891 0 O-C-N 121.693 -0.629 . . . . 0.0 109.976 175.801 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 57' ' ' ILE . . . . . 0.522 ' HA ' HG12 ' A' ' 11' ' ' VAL . 67.5 mt -86.01 133.33 29.91 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.871 0 C-N-CA 119.944 -0.702 . . . . 0.0 109.868 172.808 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 58' ' ' LEU . . . . . 0.464 HD11 ' HB2' ' A' ' 12' ' ' GLU . 72.7 mt -82.53 148.25 58.08 Favored Pre-proline 0 N--CA 1.498 1.928 0 O-C-N 121.613 -0.68 . . . . 0.0 110.045 -178.299 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 32.1 Cg_endo -68.62 -33.4 21.98 Favored 'Trans proline' 0 N--CA 1.488 1.2 0 O-C-N 123.552 1.29 . . . . 0.0 110.45 -178.952 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 50.7 mttp -103.03 139.09 39.04 Favored 'General case' 0 N--CA 1.495 1.787 0 O-C-N 121.631 -0.668 . . . . 0.0 110.229 -179.161 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 23.1 t30 -93.62 -61.93 1.46 Allowed 'General case' 0 N--CA 1.495 1.788 0 O-C-N 121.63 -0.669 . . . . 0.0 110.22 179.411 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 41.6 tt0 -121.8 136.42 54.93 Favored 'General case' 0 N--CA 1.495 1.822 0 O-C-N 121.6 -0.688 . . . . 0.0 110.238 -179.209 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 38.7 pt -127.34 159.13 38.11 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.974 0 O-C-N 121.681 -0.637 . . . . 0.0 110.187 178.806 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 64' ' ' MET . . . . . 0.467 ' CB ' ' HD3' ' A' ' 65' ' ' PRO . 1.9 mtt -163.38 -56.11 0.01 OUTLIER Pre-proline 0 N--CA 1.498 1.946 0 O-C-N 121.651 -0.656 . . . . 0.0 110.981 -179.914 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 65' ' ' PRO . . . . . 0.467 ' HD3' ' CB ' ' A' ' 64' ' ' MET . 22.7 Cg_exo -61.16 127.87 23.44 Favored 'Trans proline' 0 N--CA 1.493 1.483 0 O-C-N 122.946 0.972 . . . . 0.0 110.733 -179.08 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 76.1 tttt -143.97 122.03 12.13 Favored 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.697 -0.627 . . . . 0.0 110.042 178.795 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 92.0 m-20 -101.32 -38.86 7.87 Favored 'General case' 0 N--CA 1.495 1.808 0 O-C-N 121.669 -0.644 . . . . 0.0 110.581 -177.391 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . -66.36 -43.45 92.66 Favored Glycine 0 N--CA 1.497 2.717 0 N-CA-C 109.904 -1.278 . . . . 0.0 109.904 -177.363 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 5.2 m 55.37 33.84 21.66 Favored 'General case' 0 N--CA 1.506 2.363 0 O-C-N 121.575 -0.956 . . . . 0.0 110.771 -178.554 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 52.7 mttp -108.57 161.11 15.38 Favored 'General case' 0 N--CA 1.497 1.884 0 O-C-N 121.599 -0.688 . . . . 0.0 110.125 177.563 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 15.5 m -68.7 159.63 81.0 Favored Pre-proline 0 N--CA 1.499 2.004 0 O-C-N 121.755 -0.591 . . . . 0.0 110.15 179.444 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 22.3 Cg_exo -61.05 -42.24 37.92 Favored 'Trans proline' 0 N--CA 1.49 1.295 0 O-C-N 123.509 1.268 . . . . 0.0 110.76 -179.094 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 49.6 m -131.38 143.52 50.54 Favored 'General case' 0 N--CA 1.495 1.801 0 O-C-N 121.661 -0.649 . . . . 0.0 110.261 179.713 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 42.0 p -80.45 -32.12 37.28 Favored 'General case' 0 N--CA 1.499 1.996 0 O-C-N 121.686 -0.634 . . . . 0.0 110.251 178.665 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 17.1 t-20 -98.55 155.2 17.4 Favored 'General case' 0 N--CA 1.494 1.769 0 O-C-N 121.596 -0.69 . . . . 0.0 110.138 179.852 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 50.0 m -110.21 151.01 27.84 Favored 'General case' 0 N--CA 1.495 1.821 0 O-C-N 121.717 -0.614 . . . . 0.0 110.214 -179.715 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 9.5 t -130.27 166.09 21.08 Favored 'General case' 0 N--CA 1.497 1.893 0 O-C-N 121.657 -0.652 . . . . 0.0 110.439 -179.37 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 90.5 mttt -86.56 137.34 32.59 Favored 'General case' 0 N--CA 1.497 1.876 0 O-C-N 121.741 -0.6 . . . . 0.0 110.161 -179.438 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 83.4 mt -68.81 -34.78 76.09 Favored 'General case' 0 N--CA 1.499 1.992 0 O-C-N 121.639 -0.663 . . . . 0.0 110.23 179.826 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 98.9 mttt -65.24 -43.9 89.93 Favored 'General case' 0 N--CA 1.5 2.063 0 O-C-N 121.638 -0.663 . . . . 0.0 110.481 -178.568 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 49.4 m -135.22 148.0 49.49 Favored 'General case' 0 N--CA 1.495 1.816 0 O-C-N 121.646 -0.659 . . . . 0.0 110.253 -179.562 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -142.65 -63.07 0.42 Allowed 'General case' 0 N--CA 1.494 1.757 0 O-C-N 121.739 -0.6 . . . . 0.0 110.207 179.478 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 13.7 pt-20 -66.22 -31.03 71.61 Favored 'General case' 0 N--CA 1.5 2.056 0 O-C-N 121.696 -0.628 . . . . 0.0 110.669 -179.954 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 23.9 m -106.71 140.5 39.47 Favored 'General case' 0 N--CA 1.495 1.802 0 O-C-N 121.628 -0.67 . . . . 0.0 110.258 -179.27 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 53.8 p90 -141.73 166.41 24.82 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.671 -0.643 . . . . 0.0 110.305 179.864 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 48.2 m -118.78 147.48 43.84 Favored 'General case' 0 N--CA 1.495 1.814 0 O-C-N 121.606 -0.684 . . . . 0.0 110.178 -179.931 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 12.6 t -90.41 -41.21 11.6 Favored 'General case' 0 N--CA 1.497 1.879 0 O-C-N 121.664 -0.648 . . . . 0.0 110.204 -179.694 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 68.7 mttt -134.92 124.68 25.34 Favored 'General case' 0 N--CA 1.495 1.792 0 O-C-N 121.716 -0.615 . . . . 0.0 110.197 179.77 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 29.9 m120 -91.16 -37.29 13.45 Favored 'General case' 0 N--CA 1.496 1.844 0 O-C-N 121.689 -0.632 . . . . 0.0 110.191 179.638 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 84.0 tttt -65.69 -39.88 91.72 Favored 'General case' 0 N--CA 1.5 2.028 0 O-C-N 121.671 -0.643 . . . . 0.0 110.398 -179.514 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 91' ' ' TRP . . . . . . . . . . . . . 75.0 t-105 -89.97 -56.9 3.05 Favored 'General case' 0 N--CA 1.497 1.88 0 O-C-N 121.665 -0.647 . . . . 0.0 110.191 -179.71 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 36.5 t 52.66 -175.37 0.03 OUTLIER 'General case' 0 N--CA 1.506 2.326 0 O-C-N 121.588 -0.695 . . . . 0.0 110.999 -179.601 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 93' ' ' MET . . . . . . . . . . . . . 89.7 mtp -119.18 152.17 37.07 Favored 'General case' 0 N--CA 1.495 1.824 0 O-C-N 121.642 -0.661 . . . . 0.0 110.162 179.904 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 18.6 t70 . . . . . 0 N--CA 1.506 2.331 0 CA-C-O 118.027 -0.987 . . . . 0.0 110.964 -179.808 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' B' B ' 240' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.357 0 N-CA-C 109.573 -1.411 . . . . 0.0 109.573 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' B' B ' 241' ' ' ALA . . . . . . . . . . . . . . . -100.26 31.63 3.31 Favored 'General case' 0 N--CA 1.495 1.802 0 O-C-N 121.628 -0.925 . . . . 0.0 110.317 179.712 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 242' ' ' THR . . . . . . . . . . . . . 40.3 p -126.25 164.61 20.62 Favored 'General case' 0 N--CA 1.497 1.882 0 O-C-N 121.63 -0.669 . . . . 0.0 110.065 179.639 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 243' ' ' THR . . . . . . . . . . . . . 36.6 p -103.21 151.53 22.53 Favored 'General case' 0 N--CA 1.495 1.804 0 O-C-N 121.682 -0.636 . . . . 0.0 110.161 179.561 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 244' ' ' LYS . . . . . . . . . . . . . 21.7 ttmt -97.6 -34.69 10.86 Favored 'General case' 0 N--CA 1.495 1.809 0 O-C-N 121.72 -0.613 . . . . 0.0 110.306 -179.168 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 245' ' ' GLU . . . . . . . . . . . . . 45.6 tt0 -65.95 -37.51 86.2 Favored 'General case' 0 N--CA 1.499 1.995 0 O-C-N 121.706 -0.621 . . . . 0.0 110.339 -178.66 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 246' ' ' LYS . . . . . . . . . . . . . 47.7 mtmt -131.1 139.5 49.86 Favored 'General case' 0 N--CA 1.496 1.85 0 O-C-N 121.705 -0.622 . . . . 0.0 110.291 -179.72 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 247' ' ' ASN . . . . . . . . . . . . . 29.8 m120 -130.58 32.38 4.41 Favored 'General case' 0 N--CA 1.496 1.845 0 O-C-N 121.573 -0.705 . . . . 0.0 110.24 178.974 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 248' ' ' ILE . . . . . . . . . . . . . 51.2 mm -77.94 -34.44 19.46 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.03 0 O-C-N 121.549 -0.719 . . . . 0.0 109.884 -178.904 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 249' ' ' SER . . . . . . . . . . . . . 24.4 m -64.69 -41.51 95.99 Favored 'General case' 0 N--CA 1.5 2.063 0 O-C-N 121.617 -0.677 . . . . 0.0 110.479 -178.685 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 250' ' ' VAL . . . . . 0.866 HG12 HG12 ' B' ' 252' ' ' VAL . 46.0 t -87.44 -51.82 12.31 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.975 0 O-C-N 121.633 -0.667 . . . . 0.0 109.545 179.449 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 251' ' ' ASP . . . . . . . . . . . . . 26.0 t0 52.18 71.28 0.48 Allowed 'General case' 0 N--CA 1.506 2.354 0 O-C-N 121.734 -0.604 . . . . 0.0 111.305 177.946 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 252' ' ' VAL . . . . . 0.866 HG12 HG12 ' B' ' 250' ' ' VAL . 13.5 p -161.6 124.22 0.36 Allowed 'Isoleucine or valine' 0 N--CA 1.497 1.899 0 O-C-N 121.51 -0.744 . . . . 0.0 110.152 176.174 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 253' ' ' ASP . . . . . . . . . . . . . 74.4 m-20 -82.87 121.04 26.43 Favored 'General case' 0 N--CA 1.496 1.862 0 O-C-N 121.635 -0.666 . . . . 0.0 110.261 178.479 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 254' ' ' ALA . . . . . . . . . . . . . . . -67.5 -36.14 80.51 Favored 'General case' 0 N--CA 1.499 2.01 0 O-C-N 121.594 -0.692 . . . . 0.0 110.305 179.36 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 255' ' ' ASP . . . . . . . . . . . . . 4.0 p30 -73.02 -28.12 62.17 Favored 'General case' 0 N--CA 1.5 2.035 0 O-C-N 121.709 -0.619 . . . . 0.0 110.652 -179.777 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 256' ' ' ALA . . . . . . . . . . . . . . . -63.02 -33.55 75.67 Favored 'General case' 0 N--CA 1.501 2.089 0 O-C-N 121.535 -0.728 . . . . 0.0 110.414 -179.561 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 257' ' ' SER . . . . . . . . . . . . . 22.0 m -55.49 -36.33 66.54 Favored 'General case' 0 N--CA 1.503 2.185 0 O-C-N 121.565 -0.709 . . . . 0.0 110.361 177.67 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 258' ' ' SER . . . . . . . . . . . . . 23.8 m -69.33 -34.28 74.41 Favored 'General case' 0 N--CA 1.498 1.95 0 C-N-CA 120.402 -0.519 . . . . 0.0 110.176 179.303 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 259' ' ' GLN . . . . . . . . . . . . . 78.2 mt-30 -64.66 -34.47 78.36 Favored 'General case' 0 N--CA 1.5 2.058 0 O-C-N 121.606 -0.684 . . . . 0.0 110.407 -179.931 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 260' ' ' LEU . . . . . 0.492 ' HA ' HD12 ' B' ' 263' ' ' LEU . 77.9 mt -66.57 -41.57 88.39 Favored 'General case' 0 N--CA 1.5 2.028 0 O-C-N 121.716 -0.615 . . . . 0.0 110.223 179.371 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 261' ' ' LEU . . . . . 0.571 HD13 HD12 ' A' ' 55' ' ' LEU . 33.5 tp -70.03 -35.67 74.49 Favored 'General case' 0 N--CA 1.498 1.973 0 C-N-CA 120.132 -0.627 . . . . 0.0 109.798 176.997 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 262' ' ' SER . . . . . . . . . . . . . 23.2 m -62.47 -37.68 86.89 Favored 'General case' 0 N--CA 1.5 2.067 0 O-C-N 121.683 -0.636 . . . . 0.0 110.468 177.241 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 263' ' ' LEU . . . . . 0.492 HD12 ' HA ' ' B' ' 260' ' ' LEU . 21.6 mt -65.02 -43.02 93.83 Favored 'General case' 0 N--CA 1.5 2.067 0 O-C-N 121.718 -0.613 . . . . 0.0 110.292 179.195 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 264' ' ' LEU . . . . . . . . . . . . . 79.7 mt -62.76 -32.75 73.95 Favored 'General case' 0 N--CA 1.502 2.145 0 O-C-N 121.744 -0.597 . . . . 0.0 110.726 179.036 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 265' ' ' LYS . . . . . . . . . . . . . 53.2 tttm -74.54 -39.44 62.32 Favored 'General case' 0 N--CA 1.498 1.928 0 O-C-N 121.677 -0.639 . . . . 0.0 110.142 -177.97 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 266' ' ' SER . . . . . . . . . . . . . 9.6 m -163.05 155.93 19.06 Favored 'General case' 0 N--CA 1.496 1.829 0 O-C-N 121.697 -0.627 . . . . 0.0 110.203 -179.829 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 267' ' ' SER . . . . . . . . . . . . . 51.0 m -121.37 154.39 36.53 Favored 'General case' 0 N--CA 1.495 1.804 0 O-C-N 121.734 -0.604 . . . . 0.0 110.099 179.455 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 268' ' ' THR . . . . . . . . . . . . . 23.5 m -69.12 134.65 49.6 Favored 'General case' 0 N--CA 1.498 1.953 0 O-C-N 121.682 -0.636 . . . . 0.0 110.119 -179.676 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 269' ' ' ALA . . . . . 0.551 ' HB1' ' HD2' ' B' ' 270' ' ' PRO . . . 54.0 178.07 0.03 OUTLIER Pre-proline 0 N--CA 1.507 2.39 0 O-C-N 121.508 -0.745 . . . . 0.0 111.088 -178.115 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 270' ' ' PRO . . . . . 0.551 ' HD2' ' HB1' ' B' ' 269' ' ' ALA . 17.7 Cg_exo -63.28 132.39 35.97 Favored 'Trans proline' 0 N--CA 1.491 1.329 0 O-C-N 123.516 1.272 . . . . 0.0 110.479 179.416 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 271' ' ' SER . . . . . . . . . . . . . 11.0 t -98.3 -47.6 5.38 Favored 'General case' 0 N--CA 1.494 1.763 0 O-C-N 121.61 -0.682 . . . . 0.0 110.242 179.812 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 272' ' ' ASP . . . . . . . . . . . . . 9.7 m-20 -67.24 -38.92 85.99 Favored 'General case' 0 N--CA 1.5 2.05 0 O-C-N 121.708 -0.62 . . . . 0.0 110.322 179.994 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 273' ' ' LEU . . . . . 0.453 ' C ' HD23 ' B' ' 273' ' ' LEU . 6.7 tt 51.15 90.6 0.02 OUTLIER 'General case' 0 N--CA 1.505 2.311 0 O-C-N 121.545 -0.722 . . . . 0.0 111.029 -179.111 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 274' ' ' ALA . . . . . . . . . . . . . . . 50.15 -171.7 0.02 OUTLIER 'General case' 0 N--CA 1.506 2.37 0 O-C-N 121.62 -0.675 . . . . 0.0 111.211 -178.687 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 275' ' ' THR . . . . . . . . . . . . . 6.0 t -123.65 61.91 23.42 Favored Pre-proline 0 N--CA 1.498 1.933 0 O-C-N 121.618 -0.676 . . . . 0.0 110.284 179.511 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 276' ' ' PRO . . . . . . . . . . . . . 29.7 Cg_endo -67.79 150.98 79.12 Favored 'Trans proline' 0 N--CA 1.487 1.144 0 O-C-N 123.531 1.279 . . . . 0.0 110.404 179.637 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 277' ' ' GLN . . . . . . . . . . . . . 40.6 mt-30 -82.37 156.19 68.83 Favored Pre-proline 0 N--CA 1.497 1.883 0 O-C-N 121.665 -0.647 . . . . 0.0 110.11 179.496 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 278' ' ' PRO . . . . . . . . . . . . . 25.8 Cg_endo -66.5 137.39 46.45 Favored 'Trans proline' 0 N--CA 1.489 1.218 0 O-C-N 123.687 1.362 . . . . 0.0 110.408 -179.232 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 279' ' ' SER . . . . . . . . . . . . . 49.8 m -123.79 144.17 49.87 Favored 'General case' 0 N--CA 1.495 1.788 0 O-C-N 121.607 -0.683 . . . . 0.0 110.272 179.492 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 280' ' ' THR . . . . . . . . . . . . . 24.7 m -128.93 140.15 51.8 Favored 'General case' 0 N--CA 1.496 1.866 0 O-C-N 121.708 -0.62 . . . . 0.0 110.124 179.792 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 281' ' ' PHE . . . . . . . . . . . . . 60.1 m-85 -127.38 154.92 77.23 Favored Pre-proline 0 N--CA 1.495 1.78 0 O-C-N 121.671 -0.643 . . . . 0.0 110.206 179.177 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 282' ' ' PRO . . . . . . . . . . . . . 30.4 Cg_endo -68.27 137.66 40.83 Favored 'Trans proline' 0 N--CA 1.486 1.074 0 O-C-N 123.636 1.335 . . . . 0.0 110.465 -179.007 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 283' ' ' GLN . . . . . . . . . . . . . 1.8 mp0 52.33 89.16 0.1 Allowed Pre-proline 0 N--CA 1.506 2.332 0 O-C-N 121.656 -0.652 . . . . 0.0 111.137 178.769 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 284' ' ' PRO . . . . . . . . . . . . . 30.4 Cg_endo -68.51 154.33 71.92 Favored 'Trans proline' 0 N--CA 1.486 1.081 0 O-C-N 123.485 1.255 . . . . 0.0 110.27 178.625 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 285' ' ' PRO . . . . . . . . . . . . . 26.2 Cg_endo -66.56 131.25 25.63 Favored 'Trans proline' 0 N--CA 1.49 1.271 0 O-C-N 123.632 1.333 . . . . 0.0 110.393 -179.323 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 286' ' ' VAL . . . . . . . . . . . . . 57.8 t -87.13 -56.38 5.36 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.912 0 O-C-N 121.686 -0.634 . . . . 0.0 109.803 179.874 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 287' ' ' GLU . . . . . . . . . . . . . 34.3 tt0 -104.61 -54.23 2.55 Favored 'General case' 0 N--CA 1.495 1.784 0 O-C-N 121.651 -0.655 . . . . 0.0 110.27 -178.851 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 288' ' ' SER . . . . . . . . . . . . . 23.3 t 54.0 178.98 0.03 OUTLIER 'General case' 0 N--CA 1.505 2.3 0 O-C-N 121.596 -0.69 . . . . 0.0 111.147 -178.82 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 289' ' ' HIS . . . . . . . . . . . . . 76.4 m80 -95.39 -49.2 5.55 Favored 'General case' 0 N--CA 1.495 1.79 0 O-C-N 121.614 -0.679 . . . . 0.0 110.268 -179.686 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 290' ' ' SER . . . . . . . . . . . . . 50.6 m -124.49 148.7 47.54 Favored 'General case' 0 N--CA 1.495 1.812 0 O-C-N 121.671 -0.643 . . . . 0.0 110.267 -179.896 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 291' ' ' SER . . . . . . . . . . . . . 1.9 t . . . . . 0 N--CA 1.506 2.346 0 CA-C-O 117.996 -1.002 . . . . 0.0 110.988 179.794 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' -1' ' ' MET . . . . . . . . . . . . . 84.0 mtp . . . . . 0 N--CA 1.492 1.666 0 CA-C-O 120.962 0.411 . . . . 0.0 110.216 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 0' ' ' GLY . . . . . . . . . . . . . . . -175.48 -172.37 40.28 Favored Glycine 0 N--CA 1.494 2.514 0 N-CA-C 109.502 -1.439 . . . . 0.0 109.502 -179.853 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 1' ' ' MET . . . . . 0.415 ' HB2' ' HE3' ' A' ' 1' ' ' MET . 74.5 mtm -110.69 170.65 7.95 Favored 'General case' 0 N--CA 1.496 1.827 0 O-C-N 121.719 -0.871 . . . . 0.0 110.149 179.92 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 63.5 m -101.03 163.68 12.17 Favored 'General case' 0 N--CA 1.495 1.79 0 O-C-N 121.701 -0.624 . . . . 0.0 110.076 -179.175 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 3' ' ' VAL . . . . . 0.429 HG12 ' CE1' ' A' ' 7' ' ' TYR . 74.6 t -66.77 -27.71 40.79 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.014 0 O-C-N 121.65 -0.656 . . . . 0.0 110.099 179.798 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -55.12 -30.94 60.79 Favored 'General case' 0 N--CA 1.504 2.228 0 O-C-N 121.434 -0.791 . . . . 0.0 110.369 -179.854 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -68.76 -30.88 69.57 Favored 'General case' 0 N--CA 1.499 1.991 0 O-C-N 121.783 -0.573 . . . . 0.0 110.24 174.676 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 91.1 m-85 -95.81 10.11 38.21 Favored 'General case' 0 N--CA 1.497 1.895 0 O-C-N 121.584 -0.697 . . . . 0.0 111.637 -178.0 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 7' ' ' TYR . . . . . 0.429 ' CE1' HG12 ' A' ' 3' ' ' VAL . 3.1 m-30 -67.35 133.36 49.48 Favored 'General case' 0 N--CA 1.502 2.174 0 O-C-N 121.088 -1.007 . . . . 0.0 110.043 173.801 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 82.38 1.88 90.51 Favored Glycine 0 N--CA 1.496 2.644 0 N-CA-C 110.625 -0.99 . . . . 0.0 110.625 -176.854 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 52.8 m -77.42 137.13 38.52 Favored 'General case' 0 N--CA 1.498 1.955 0 O-C-N 121.111 -1.229 . . . . 0.0 110.476 176.365 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 10' ' ' ASN . . . . . 0.754 ' CG ' HG22 ' A' ' 24' ' ' VAL . 2.6 m-20 -85.24 121.85 28.57 Favored 'General case' 0 N--CA 1.499 1.981 0 O-C-N 121.606 -0.684 . . . . 0.0 109.506 173.739 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 11' ' ' VAL . . . . . 0.483 HG12 ' HA ' ' A' ' 57' ' ' ILE . 30.9 m -144.0 161.08 15.77 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.774 0 C-N-CA 120.151 -0.62 . . . . 0.0 109.885 -179.403 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 12' ' ' GLU . . . . . 0.417 ' HB2' HD11 ' A' ' 58' ' ' LEU . 48.1 tt0 -109.33 147.23 33.03 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.737 -0.602 . . . . 0.0 109.6 177.124 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 13' ' ' VAL . . . . . 0.697 HG22 ' CD2' ' A' ' 55' ' ' LEU . 60.1 t -135.74 126.96 44.37 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.825 0 O-C-N 121.559 -0.713 . . . . 0.0 109.924 -173.758 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.447 HD13 ' HG2' ' A' ' 20' ' ' LYS . 26.3 tp -95.91 125.6 40.58 Favored 'General case' 0 N--CA 1.492 1.665 0 N-CA-C 109.192 -0.67 . . . . 0.0 109.192 173.955 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 87.5 mt -93.12 170.51 9.59 Favored 'General case' 0 N--CA 1.497 1.889 0 O-C-N 121.67 -0.644 . . . . 0.0 110.951 -174.372 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 24.7 p30 -57.19 -21.55 34.15 Favored 'General case' 0 N--CA 1.505 2.309 0 O-C-N 121.738 -0.601 . . . . 0.0 111.575 -178.213 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 53.1 p-10 -91.6 22.04 4.31 Favored 'General case' 0 N--CA 1.499 1.975 0 O-C-N 121.571 -0.706 . . . . 0.0 110.933 -177.989 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 74.4 m-20 58.9 27.92 16.85 Favored 'General case' 0 N--CA 1.506 2.331 0 O-C-N 121.433 -0.792 . . . . 0.0 110.714 175.399 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 50.7 m -108.98 145.84 34.85 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.494 -0.754 . . . . 0.0 109.674 173.128 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 20' ' ' LYS . . . . . 0.447 ' HG2' HD13 ' A' ' 14' ' ' LEU . 80.3 mttt -109.68 140.03 44.02 Favored 'General case' 0 N--CA 1.495 1.777 0 O-C-N 121.57 -0.706 . . . . 0.0 110.481 -177.342 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -153.14 137.83 16.95 Favored 'General case' 0 N--CA 1.497 1.878 0 O-C-N 121.785 -0.572 . . . . 0.0 110.178 177.008 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 9.7 ptp180 -124.37 158.59 32.32 Favored 'General case' 0 N--CA 1.497 1.899 0 O-C-N 121.575 -0.703 . . . . 0.0 110.197 -179.219 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 23' ' ' GLY . . . . . 0.526 ' HA2' HD13 ' A' ' 39' ' ' LEU . . . -171.82 171.24 44.01 Favored Glycine 0 N--CA 1.493 2.447 0 N-CA-C 109.087 -1.605 . . . . 0.0 109.087 -178.337 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 24' ' ' VAL . . . . . 0.754 HG22 ' CG ' ' A' ' 10' ' ' ASN . 20.0 t -94.69 122.15 45.9 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.878 0 O-C-N 121.626 -0.926 . . . . 0.0 109.162 175.803 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 25' ' ' ILE . . . . . 0.432 ' HA ' HD23 ' A' ' 37' ' ' LEU . 87.9 mt -63.05 141.39 18.18 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.272 0 O-C-N 121.508 -0.745 . . . . 0.0 110.351 -171.988 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 26' ' ' THR . . . . . 0.606 HG21 ' HB2' ' A' ' 38' ' ' ARG . 13.7 p -121.11 -26.04 5.19 Favored 'General case' 0 N--CA 1.495 1.785 0 O-C-N 121.728 -0.607 . . . . 0.0 111.304 -179.906 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 26.9 t30 -162.87 160.24 24.78 Favored 'General case' 0 N--CA 1.5 2.062 0 O-C-N 120.965 -1.084 . . . . 0.0 111.789 179.936 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 28' ' ' PHE . . . . . 0.486 ' HE1' HG21 ' A' ' 49' ' ' THR . 87.8 t80 -150.09 127.1 11.18 Favored 'General case' 0 N--CA 1.498 1.96 0 N-CA-C 109.468 -0.568 . . . . 0.0 109.468 169.804 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 21.7 t70 -97.89 127.73 44.03 Favored 'General case' 0 N--CA 1.493 1.681 0 N-CA-C 109.111 -0.7 . . . . 0.0 109.111 -178.675 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 88.3 p -65.82 -44.62 85.03 Favored 'General case' 0 N--CA 1.499 1.985 0 O-C-N 121.607 -0.683 . . . . 0.0 110.755 -174.745 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 22.4 t -58.86 -48.1 82.57 Favored 'General case' 0 N--CA 1.502 2.158 0 O-C-N 121.446 -0.784 . . . . 0.0 111.002 -173.372 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 91.4 m-20 -107.03 -2.66 20.87 Favored 'General case' 0 N--CA 1.498 1.963 0 O-C-N 121.616 -0.678 . . . . 0.0 111.62 -178.932 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 3.4 m 49.2 67.24 0.91 Allowed 'General case' 0 N--CA 1.507 2.416 0 O-C-N 121.058 -1.026 . . . . 0.0 110.903 -174.027 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 34' ' ' ILE . . . . . 1.064 HD12 HG22 ' A' ' 48' ' ' VAL . 44.8 mm -116.22 125.83 73.45 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.025 0 O-C-N 121.512 -0.743 . . . . 0.0 109.162 -175.656 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 8.1 tp -115.83 121.53 42.69 Favored 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.636 -0.665 . . . . 0.0 110.569 -167.805 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 98.5 mt-30 -91.0 133.16 35.52 Favored 'General case' 0 N--CA 1.489 1.515 0 N-CA-C 109.351 -0.611 . . . . 0.0 109.351 172.392 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 0.432 HD23 ' HA ' ' A' ' 25' ' ' ILE . 19.2 mt -117.84 123.58 46.25 Favored 'General case' 0 N--CA 1.495 1.793 0 C-N-CA 120.294 -0.562 . . . . 0.0 110.086 175.579 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 38' ' ' ARG . . . . . 0.606 ' HB2' HG21 ' A' ' 26' ' ' THR . 56.3 ttt85 -103.86 104.93 14.99 Favored 'General case' 0 N--CA 1.496 1.843 0 O-C-N 121.803 -0.561 . . . . 0.0 110.125 173.632 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.526 HD13 ' HA2' ' A' ' 23' ' ' GLY . 61.1 tp -84.38 155.66 22.2 Favored 'General case' 0 N--CA 1.498 1.938 0 O-C-N 121.577 -0.702 . . . . 0.0 110.639 -176.647 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -68.3 -2.93 9.32 Favored 'General case' 0 N--CA 1.502 2.141 0 O-C-N 121.865 -0.522 . . . . 0.0 112.213 -170.548 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 7.0 m120 -86.7 28.16 0.91 Allowed 'General case' 0 N--CA 1.497 1.925 0 O-C-N 121.039 -1.038 . . . . 0.0 110.954 174.551 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 13.4 t0 64.9 28.77 12.64 Favored 'General case' 0 N--CA 1.505 2.298 0 O-C-N 121.205 -0.934 . . . . 0.0 110.388 175.528 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 66.5 m -125.92 138.03 53.75 Favored 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.437 -0.79 . . . . 0.0 110.113 178.633 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 9.8 t -128.29 146.78 50.65 Favored 'General case' 0 N--CA 1.495 1.813 0 O-C-N 121.702 -0.624 . . . . 0.0 109.928 178.197 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 46.3 mtmt -150.18 141.84 23.6 Favored 'General case' 0 N--CA 1.497 1.894 0 C-N-CA 120.129 -0.628 . . . . 0.0 110.655 -177.812 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 89.8 p -95.84 121.95 38.11 Favored 'General case' 0 N--CA 1.495 1.799 0 O-C-N 121.839 -0.538 . . . . 0.0 110.089 176.771 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 83.1 mt -129.32 135.8 60.92 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.789 0 O-C-N 121.616 -0.677 . . . . 0.0 109.349 -179.76 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 48' ' ' VAL . . . . . 1.064 HG22 HD12 ' A' ' 34' ' ' ILE . 65.4 t -81.84 127.69 39.38 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.861 0 O-C-N 121.577 -0.702 . . . . 0.0 109.224 179.755 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 49' ' ' THR . . . . . 0.486 HG21 ' HE1' ' A' ' 28' ' ' PHE . 37.5 p -58.7 -24.87 62.21 Favored 'General case' 0 N--CA 1.505 2.298 0 O-C-N 121.547 -0.721 . . . . 0.0 111.915 -169.959 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 33.5 tttp -56.46 -23.14 36.98 Favored 'General case' 0 N--CA 1.503 2.214 0 O-C-N 121.485 -0.759 . . . . 0.0 111.09 -177.141 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 51.7 p30 -83.05 0.73 43.55 Favored 'General case' 0 N--CA 1.5 2.029 0 C-N-CA 119.762 -0.775 . . . . 0.0 111.24 176.199 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 98.8 mt -75.81 126.79 36.92 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.038 0 O-C-N 121.193 -0.942 . . . . 0.0 109.955 177.829 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 79.6 tttt -91.28 -29.5 17.13 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.829 -0.545 . . . . 0.0 109.849 171.165 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 5.4 m-20 -164.15 157.3 17.9 Favored 'General case' 0 N--CA 1.5 2.063 0 O-C-N 121.768 -0.582 . . . . 0.0 110.093 -178.585 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 55' ' ' LEU . . . . . 0.697 ' CD2' HG22 ' A' ' 13' ' ' VAL . 84.6 mt -133.01 151.24 52.09 Favored 'General case' 0 N--CA 1.497 1.894 0 O-C-N 121.674 -0.641 . . . . 0.0 110.576 -179.525 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 6.2 ptm180 -152.63 136.87 16.56 Favored 'General case' 0 N--CA 1.495 1.798 0 O-C-N 121.833 -0.542 . . . . 0.0 109.732 174.818 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 57' ' ' ILE . . . . . 0.483 ' HA ' HG12 ' A' ' 11' ' ' VAL . 64.6 mt -83.51 133.17 29.74 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.846 0 O-C-N 121.522 -0.736 . . . . 0.0 109.81 176.212 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 58' ' ' LEU . . . . . 0.417 HD11 ' HB2' ' A' ' 12' ' ' GLU . 22.6 mt -82.21 157.62 67.97 Favored Pre-proline 0 N--CA 1.497 1.915 0 O-C-N 121.633 -0.667 . . . . 0.0 109.964 -179.301 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 22.3 Cg_endo -65.39 134.23 37.94 Favored 'Trans proline' 0 N--CA 1.489 1.235 0 O-C-N 123.722 1.38 . . . . 0.0 110.585 -177.565 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 48.0 mttp -114.2 175.16 5.59 Favored 'General case' 0 N--CA 1.495 1.807 0 O-C-N 121.7 -0.625 . . . . 0.0 110.155 178.797 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 26.7 t30 -98.76 30.64 3.23 Favored 'General case' 0 N--CA 1.494 1.774 0 O-C-N 121.715 -0.616 . . . . 0.0 110.567 179.458 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 26.9 tp10 -123.55 147.47 47.24 Favored 'General case' 0 N--CA 1.495 1.783 0 O-C-N 121.578 -0.701 . . . . 0.0 110.0 179.799 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 85.9 mt -67.58 -36.2 75.47 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.088 0 O-C-N 121.654 -0.654 . . . . 0.0 109.818 -178.895 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 64' ' ' MET . . . . . . . . . . . . . 6.8 tpt 52.27 90.52 0.08 OUTLIER Pre-proline 0 N--CA 1.507 2.389 0 O-C-N 121.595 -0.691 . . . . 0.0 110.905 -179.888 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 23.2 Cg_endo -65.79 145.56 81.11 Favored 'Trans proline' 0 N--CA 1.489 1.244 0 O-C-N 123.513 1.27 . . . . 0.0 110.493 -179.668 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 50.1 tttm -119.93 146.43 45.81 Favored 'General case' 0 N--CA 1.495 1.814 0 O-C-N 121.709 -0.62 . . . . 0.0 110.123 -179.927 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 42.8 t30 -92.52 120.9 33.44 Favored 'General case' 0 N--CA 1.495 1.82 0 O-C-N 121.72 -0.612 . . . . 0.0 110.256 -179.502 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 157.3 90.19 0.08 OUTLIER Glycine 0 N--CA 1.494 2.501 0 N-CA-C 109.496 -1.442 . . . . 0.0 109.496 -179.892 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 23.9 m -66.35 -38.93 88.75 Favored 'General case' 0 N--CA 1.5 2.032 0 O-C-N 121.764 -0.845 . . . . 0.0 110.306 -179.455 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 34.6 tptt -109.11 129.12 55.47 Favored 'General case' 0 N--CA 1.495 1.794 0 O-C-N 121.672 -0.642 . . . . 0.0 110.19 -179.879 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 1.6 t -142.89 151.19 55.75 Favored Pre-proline 0 N--CA 1.494 1.766 0 O-C-N 121.65 -0.656 . . . . 0.0 110.121 179.195 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 35.8 Cg_endo -70.08 102.38 1.07 Allowed 'Trans proline' 0 N--CA 1.487 1.104 0 O-C-N 123.528 1.278 . . . . 0.0 110.285 -179.907 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 27.4 t -160.52 -65.33 0.07 Allowed 'General case' 0 N--CA 1.496 1.847 0 O-C-N 121.733 -0.605 . . . . 0.0 110.203 179.457 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 25.5 m -129.57 136.9 50.37 Favored 'General case' 0 N--CA 1.495 1.792 0 O-C-N 121.705 -0.622 . . . . 0.0 110.162 179.969 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 39.4 t30 -112.1 99.55 8.15 Favored 'General case' 0 N--CA 1.495 1.792 0 O-C-N 121.618 -0.676 . . . . 0.0 110.181 179.033 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 51.1 m -125.99 146.86 49.7 Favored 'General case' 0 N--CA 1.495 1.797 0 O-C-N 121.729 -0.607 . . . . 0.0 110.246 -179.792 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 77' ' ' THR . . . . . 0.457 HG22 ' O ' ' A' ' 77' ' ' THR . 18.9 m -119.29 31.74 6.45 Favored 'General case' 0 N--CA 1.496 1.863 0 O-C-N 121.756 -0.59 . . . . 0.0 110.312 179.203 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 53.7 tptt -83.22 -62.26 1.64 Allowed 'General case' 0 N--CA 1.497 1.888 0 O-C-N 121.608 -0.683 . . . . 0.0 110.181 -178.912 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 79' ' ' LEU . . . . . 0.695 HD22 ' N ' ' A' ' 80' ' ' LYS . 0.0 OUTLIER -161.12 179.04 8.72 Favored 'General case' 0 N--CA 1.496 1.842 0 O-C-N 121.655 -0.653 . . . . 0.0 110.596 -179.3 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 80' ' ' LYS . . . . . 0.695 ' N ' HD22 ' A' ' 79' ' ' LEU . 50.1 mttp -114.74 149.13 37.36 Favored 'General case' 0 N--CA 1.495 1.821 0 O-C-N 121.598 -0.689 . . . . 0.0 110.212 -179.896 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 27.2 t -98.94 146.08 26.37 Favored 'General case' 0 N--CA 1.495 1.808 0 O-C-N 121.751 -0.593 . . . . 0.0 110.259 -179.248 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -81.87 -173.12 4.28 Favored 'General case' 0 N--CA 1.498 1.93 0 O-C-N 121.73 -0.607 . . . . 0.0 110.161 -179.538 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 54.5 mt-10 -66.15 -33.04 74.87 Favored 'General case' 0 N--CA 1.5 2.053 0 O-C-N 121.668 -0.645 . . . . 0.0 110.435 -179.526 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 40.9 p -90.92 156.0 18.31 Favored 'General case' 0 N--CA 1.497 1.905 0 O-C-N 121.682 -0.636 . . . . 0.0 110.101 -179.598 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 70.7 t80 -135.57 142.13 45.28 Favored 'General case' 0 N--CA 1.495 1.781 0 O-C-N 121.752 -0.592 . . . . 0.0 110.186 -179.959 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 49.7 m -120.09 144.92 47.35 Favored 'General case' 0 N--CA 1.494 1.773 0 O-C-N 121.661 -0.649 . . . . 0.0 110.147 179.376 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 29.4 t -135.66 140.94 44.89 Favored 'General case' 0 N--CA 1.496 1.842 0 O-C-N 121.756 -0.59 . . . . 0.0 110.248 179.916 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 88.2 mttt -105.5 142.66 34.86 Favored 'General case' 0 N--CA 1.495 1.788 0 O-C-N 121.722 -0.611 . . . . 0.0 110.159 179.407 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 30.0 m120 -64.82 -35.59 81.61 Favored 'General case' 0 N--CA 1.501 2.111 0 O-C-N 121.679 -0.638 . . . . 0.0 110.238 179.161 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 52.5 mttp -128.28 143.8 51.06 Favored 'General case' 0 N--CA 1.494 1.765 0 O-C-N 121.704 -0.622 . . . . 0.0 110.068 178.573 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 91' ' ' TRP . . . . . . . . . . . . . 74.3 t-105 -101.84 126.5 48.74 Favored 'General case' 0 N--CA 1.494 1.751 0 O-C-N 121.672 -0.643 . . . . 0.0 110.175 179.665 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 65.0 m 51.99 -172.41 0.03 OUTLIER 'General case' 0 N--CA 1.506 2.365 0 O-C-N 121.609 -0.682 . . . . 0.0 111.055 -179.759 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 93' ' ' MET . . . . . . . . . . . . . 74.2 mtm -63.03 -34.04 76.72 Favored 'General case' 0 N--CA 1.501 2.09 0 O-C-N 121.659 -0.65 . . . . 0.0 110.413 179.755 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 3.3 p30 . . . . . 0 N--CA 1.497 1.917 0 CA-C-O 117.972 -1.013 . . . . 0.0 110.307 179.817 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' B' B ' 240' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.367 0 N-CA-C 109.576 -1.41 . . . . 0.0 109.576 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' B' B ' 241' ' ' ALA . . . . . . . . . . . . . . . -66.76 -32.99 74.64 Favored 'General case' 0 N--CA 1.501 2.093 0 O-C-N 121.696 -0.884 . . . . 0.0 110.283 179.958 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 242' ' ' THR . . . . . . . . . . . . . 24.2 m -116.13 138.23 51.43 Favored 'General case' 0 N--CA 1.496 1.827 0 O-C-N 121.676 -0.64 . . . . 0.0 110.159 179.83 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 243' ' ' THR . . . . . 0.654 HG23 ' O ' ' B' ' 245' ' ' GLU . 6.4 t -136.72 159.6 41.35 Favored 'General case' 0 N--CA 1.498 1.938 0 O-C-N 121.707 -0.62 . . . . 0.0 110.406 179.695 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 244' ' ' LYS . . . . . . . . . . . . . 51.5 tttm -65.62 -37.56 86.95 Favored 'General case' 0 N--CA 1.5 2.067 0 O-C-N 121.677 -0.639 . . . . 0.0 110.475 -178.972 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 245' ' ' GLU . . . . . 0.654 ' O ' HG23 ' B' ' 243' ' ' THR . 80.4 mt-10 -95.79 146.76 24.28 Favored 'General case' 0 N--CA 1.496 1.842 0 O-C-N 121.665 -0.647 . . . . 0.0 110.217 -178.806 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 246' ' ' LYS . . . . . . . . . . . . . 84.3 mttt -105.85 121.49 44.17 Favored 'General case' 0 N--CA 1.494 1.759 0 O-C-N 121.729 -0.607 . . . . 0.0 110.326 -179.283 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 247' ' ' ASN . . . . . . . . . . . . . 92.7 m-20 -118.62 124.03 46.44 Favored 'General case' 0 N--CA 1.496 1.845 0 O-C-N 121.69 -0.631 . . . . 0.0 109.992 177.584 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 248' ' ' ILE . . . . . . . . . . . . . 50.6 mm 52.24 93.3 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.507 2.383 0 O-C-N 121.572 -0.705 . . . . 0.0 110.51 -178.416 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 249' ' ' SER . . . . . 0.417 ' C ' HG13 ' B' ' 250' ' ' VAL . 95.1 p -101.24 152.3 20.83 Favored 'General case' 0 N--CA 1.496 1.838 0 O-C-N 121.675 -0.641 . . . . 0.0 110.291 -177.851 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 250' ' ' VAL . . . . . 0.668 ' O ' ' HB2' ' B' ' 254' ' ' ALA . 31.6 m -150.89 33.26 0.09 OUTLIER 'Isoleucine or valine' 0 N--CA 1.498 1.968 0 O-C-N 121.761 -0.587 . . . . 0.0 109.99 179.824 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 251' ' ' ASP . . . . . . . . . . . . . 74.4 m-20 51.85 37.62 21.15 Favored 'General case' 0 N--CA 1.506 2.35 0 O-C-N 121.586 -0.696 . . . . 0.0 110.992 -179.362 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 252' ' ' VAL . . . . . . . . . . . . . 53.2 t 52.69 94.37 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.508 2.451 0 O-C-N 121.588 -0.695 . . . . 0.0 110.84 179.252 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 253' ' ' ASP . . . . . . . . . . . . . 74.6 m-20 53.53 55.43 8.62 Favored 'General case' 0 N--CA 1.506 2.372 0 O-C-N 121.639 -0.663 . . . . 0.0 111.055 177.787 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 254' ' ' ALA . . . . . 0.668 ' HB2' ' O ' ' B' ' 250' ' ' VAL . . . -65.97 -32.82 74.54 Favored 'General case' 0 N--CA 1.501 2.104 0 O-C-N 121.495 -0.753 . . . . 0.0 110.236 179.53 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 255' ' ' ASP . . . . . . . . . . . . . 74.3 m-20 -73.88 -31.66 63.24 Favored 'General case' 0 N--CA 1.499 1.984 0 O-C-N 121.542 -0.724 . . . . 0.0 110.327 179.147 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 256' ' ' ALA . . . . . . . . . . . . . . . -63.67 -37.84 88.86 Favored 'General case' 0 N--CA 1.5 2.055 0 O-C-N 121.539 -0.725 . . . . 0.0 110.32 179.603 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 257' ' ' SER . . . . . . . . . . . . . 54.6 p -55.75 -36.64 67.52 Favored 'General case' 0 N--CA 1.503 2.199 0 O-C-N 121.643 -0.661 . . . . 0.0 110.462 178.551 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 258' ' ' SER . . . . . . . . . . . . . 23.8 m -70.21 -31.95 69.62 Favored 'General case' 0 N--CA 1.498 1.955 0 C-N-CA 120.383 -0.527 . . . . 0.0 110.47 -179.335 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 259' ' ' GLN . . . . . . . . . . . . . 98.6 mt-30 -63.66 -40.84 97.85 Favored 'General case' 0 N--CA 1.501 2.109 0 O-C-N 121.511 -0.743 . . . . 0.0 110.542 -178.536 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 260' ' ' LEU . . . . . . . . . . . . . 84.2 mt -72.96 -41.63 64.21 Favored 'General case' 0 N--CA 1.498 1.955 0 O-C-N 121.635 -0.666 . . . . 0.0 110.295 -179.587 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 261' ' ' LEU . . . . . . . . . . . . . 20.7 tp -69.75 -38.46 76.82 Favored 'General case' 0 N--CA 1.497 1.909 0 O-C-N 121.655 -0.653 . . . . 0.0 109.884 178.857 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 262' ' ' SER . . . . . . . . . . . . . 88.8 p -63.32 -35.5 80.58 Favored 'General case' 0 N--CA 1.499 1.987 0 O-C-N 121.71 -0.619 . . . . 0.0 110.674 177.263 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 263' ' ' LEU . . . . . . . . . . . . . 26.7 mt -64.99 -42.05 94.86 Favored 'General case' 0 N--CA 1.501 2.098 0 O-C-N 121.564 -0.71 . . . . 0.0 110.366 -179.734 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 264' ' ' LEU . . . . . 0.491 ' CD1' HD11 ' A' ' 55' ' ' LEU . 86.4 mt -62.68 -38.72 91.47 Favored 'General case' 0 N--CA 1.502 2.134 0 O-C-N 121.667 -0.646 . . . . 0.0 110.401 178.328 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 265' ' ' LYS . . . . . . . . . . . . . 92.9 mttt -76.38 -37.07 57.72 Favored 'General case' 0 N--CA 1.496 1.864 0 O-C-N 121.649 -0.657 . . . . 0.0 109.988 178.976 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 266' ' ' SER . . . . . . . . . . . . . 25.2 p 47.77 -169.06 0.02 OUTLIER 'General case' 0 N--CA 1.507 2.387 0 CA-C-O 121.049 0.452 . . . . 0.0 111.61 179.842 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 267' ' ' SER . . . . . . . . . . . . . 93.8 p -133.32 152.17 51.91 Favored 'General case' 0 N--CA 1.494 1.774 0 O-C-N 121.7 -0.625 . . . . 0.0 110.141 179.118 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 268' ' ' THR . . . . . . . . . . . . . 41.0 p -128.22 157.82 39.81 Favored 'General case' 0 N--CA 1.497 1.889 0 O-C-N 121.668 -0.645 . . . . 0.0 110.135 -179.945 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 269' ' ' ALA . . . . . 0.733 ' HB3' ' HD3' ' B' ' 270' ' ' PRO . . . -70.91 -49.34 13.61 Favored Pre-proline 0 N--CA 1.499 1.981 0 O-C-N 121.672 -0.643 . . . . 0.0 110.764 -179.804 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 270' ' ' PRO . . . . . 0.733 ' HD3' ' HB3' ' B' ' 269' ' ' ALA . 33.7 Cg_exo -57.14 151.86 48.4 Favored 'Trans proline' 0 N--CA 1.493 1.449 0 O-C-N 123.121 1.064 . . . . 0.0 110.975 179.3 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 271' ' ' SER . . . . . . . . . . . . . 86.9 p -70.68 172.26 8.99 Favored 'General case' 0 N--CA 1.498 1.931 0 O-C-N 121.721 -0.612 . . . . 0.0 110.317 -179.057 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 272' ' ' ASP . . . . . . . . . . . . . 3.9 p30 -99.03 34.21 2.17 Favored 'General case' 0 N--CA 1.497 1.891 0 O-C-N 121.73 -0.606 . . . . 0.0 110.372 -179.84 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 273' ' ' LEU . . . . . . . . . . . . . 20.8 tp -160.81 155.6 23.91 Favored 'General case' 0 N--CA 1.495 1.817 0 O-C-N 121.637 -0.664 . . . . 0.0 109.95 -179.186 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 274' ' ' ALA . . . . . . . . . . . . . . . 51.58 -167.28 0.04 OUTLIER 'General case' 0 N--CA 1.505 2.307 0 O-C-N 121.615 -0.678 . . . . 0.0 110.96 -177.95 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 275' ' ' THR . . . . . . . . . . . . . 18.3 p -68.67 151.62 97.14 Favored Pre-proline 0 N--CA 1.498 1.969 0 O-C-N 121.649 -0.657 . . . . 0.0 110.203 -178.573 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 276' ' ' PRO . . . . . . . . . . . . . 31.0 Cg_endo -68.58 155.69 68.1 Favored 'Trans proline' 0 N--CA 1.487 1.123 0 O-C-N 123.651 1.343 . . . . 0.0 110.346 -179.589 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 277' ' ' GLN . . . . . . . . . . . . . 13.6 mm100 -122.23 75.66 41.74 Favored Pre-proline 0 N--CA 1.496 1.856 0 O-C-N 121.718 -0.614 . . . . 0.0 110.067 179.262 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 278' ' ' PRO . . . . . . . . . . . . . 26.7 Cg_endo -66.68 -30.59 41.76 Favored 'Trans proline' 0 N--CA 1.489 1.228 0 O-C-N 123.492 1.259 . . . . 0.0 110.635 -179.748 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 279' ' ' SER . . . . . . . . . . . . . 33.3 t -103.27 146.56 28.26 Favored 'General case' 0 N--CA 1.494 1.766 0 O-C-N 121.619 -0.676 . . . . 0.0 110.279 -179.288 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 280' ' ' THR . . . . . . . . . . . . . 10.2 m 54.78 99.4 0.01 OUTLIER 'General case' 0 N--CA 1.506 2.349 0 O-C-N 121.734 -0.604 . . . . 0.0 110.997 -179.042 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 281' ' ' PHE . . . . . . . . . . . . . 1.9 m-85 -61.2 -48.24 92.28 Favored Pre-proline 0 N--CA 1.502 2.138 0 O-C-N 121.608 -0.682 . . . . 0.0 110.89 -179.554 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 282' ' ' PRO . . . . . . . . . . . . . 23.7 Cg_exo -59.49 144.17 99.49 Favored 'Trans proline' 0 N--CA 1.493 1.448 0 O-C-N 123.192 1.101 . . . . 0.0 110.633 175.544 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 283' ' ' GLN . . . . . . . . . . . . . 33.7 mt-30 -93.58 146.15 31.26 Favored Pre-proline 0 N--CA 1.494 1.762 0 O-C-N 121.69 -0.632 . . . . 0.0 110.165 -179.669 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 284' ' ' PRO . . . . . . . . . . . . . 40.2 Cg_endo -72.85 154.16 53.47 Favored 'Trans proline' 0 N--CA 1.486 1.078 0 O-C-N 123.597 1.314 . . . . 0.0 110.169 -179.992 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 285' ' ' PRO . . . . . . . . . . . . . 26.1 Cg_endo -67.11 142.84 62.89 Favored 'Trans proline' 0 N--CA 1.489 1.209 0 O-C-N 123.604 1.318 . . . . 0.0 110.342 178.766 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 286' ' ' VAL . . . . . . . . . . . . . 57.4 t -69.62 -34.46 61.46 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.032 0 O-C-N 121.637 -0.664 . . . . 0.0 109.871 -179.812 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 287' ' ' GLU . . . . . . . . . . . . . 55.1 mt-10 -64.82 -36.0 82.91 Favored 'General case' 0 N--CA 1.501 2.11 0 O-C-N 121.702 -0.624 . . . . 0.0 110.633 -177.096 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 288' ' ' SER . . . . . . . . . . . . . 28.2 t -138.77 144.74 39.53 Favored 'General case' 0 N--CA 1.495 1.823 0 O-C-N 121.647 -0.658 . . . . 0.0 110.364 -179.01 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 289' ' ' HIS . . . . . . . . . . . . . 50.5 p-80 -116.52 130.02 56.52 Favored 'General case' 0 N--CA 1.497 1.898 0 O-C-N 121.73 -0.606 . . . . 0.0 110.322 179.955 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 290' ' ' SER . . . . . . . . . . . . . 25.0 m -66.64 -34.4 77.8 Favored 'General case' 0 N--CA 1.5 2.074 0 O-C-N 121.729 -0.607 . . . . 0.0 110.261 179.63 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 291' ' ' SER . . . . . . . . . . . . . 49.1 m . . . . . 0 N--CA 1.495 1.781 0 CA-C-O 117.995 -1.003 . . . . 0.0 110.192 -179.658 . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' -1' ' ' MET . . . . . . . . . . . . . 56.5 ttp . . . . . 0 N--CA 1.492 1.644 0 CA-C-O 120.97 0.414 . . . . 0.0 110.161 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 0' ' ' GLY . . . . . . . . . . . . . . . 85.14 -169.09 43.53 Favored Glycine 0 N--CA 1.495 2.613 0 N-CA-C 109.376 -1.49 . . . . 0.0 109.376 -179.369 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 88.8 mtp -121.83 139.3 53.8 Favored 'General case' 0 N--CA 1.495 1.817 0 O-C-N 121.638 -0.919 . . . . 0.0 110.263 179.701 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 70.0 m -101.06 168.24 9.72 Favored 'General case' 0 N--CA 1.496 1.833 0 O-C-N 121.764 -0.585 . . . . 0.0 110.245 179.726 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 3' ' ' VAL . . . . . 0.416 HG21 ' CZ ' ' A' ' 28' ' ' PHE . 49.9 t -65.74 -27.92 42.68 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.198 0 O-C-N 121.654 -0.654 . . . . 0.0 110.138 179.595 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -55.58 -31.99 62.68 Favored 'General case' 0 N--CA 1.501 2.123 0 O-C-N 121.394 -0.816 . . . . 0.0 110.334 -179.838 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 74.2 m-20 -68.65 -35.38 77.18 Favored 'General case' 0 N--CA 1.498 1.937 0 O-C-N 121.809 -0.557 . . . . 0.0 109.956 175.387 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 6' ' ' PHE . . . . . 0.411 ' CE1' HD21 ' B' ' 260' ' ' LEU . 97.6 m-85 -97.9 10.06 41.18 Favored 'General case' 0 N--CA 1.498 1.965 0 O-C-N 121.746 -0.596 . . . . 0.0 111.226 178.812 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -67.49 126.95 30.91 Favored 'General case' 0 N--CA 1.501 2.095 0 O-C-N 121.241 -0.912 . . . . 0.0 110.052 178.752 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 81.95 2.11 90.47 Favored Glycine 0 N--CA 1.497 2.716 0 N-CA-C 110.695 -0.962 . . . . 0.0 110.695 -176.938 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 59.6 p -77.86 142.66 38.37 Favored 'General case' 0 N--CA 1.497 1.924 0 O-C-N 121.061 -1.258 . . . . 0.0 110.065 175.31 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 10' ' ' ASN . . . . . 0.628 ' OD1' HG22 ' A' ' 24' ' ' VAL . 5.2 m-20 -85.27 117.53 24.26 Favored 'General case' 0 N--CA 1.5 2.028 0 N-CA-C 109.064 -0.717 . . . . 0.0 109.064 176.303 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 11' ' ' VAL . . . . . 0.443 HG12 ' HA ' ' A' ' 57' ' ' ILE . 29.8 m -142.21 158.88 20.08 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.89 0 C-N-CA 120.164 -0.614 . . . . 0.0 109.983 -179.152 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 12' ' ' GLU . . . . . 0.583 ' HB2' HD11 ' A' ' 58' ' ' LEU . 46.4 tt0 -109.4 129.53 55.54 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.619 -0.676 . . . . 0.0 110.107 178.772 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 13' ' ' VAL . . . . . 0.545 HG22 ' CD2' ' A' ' 55' ' ' LEU . 58.9 t -106.68 127.59 62.04 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.733 0 O-C-N 121.589 -0.695 . . . . 0.0 109.961 -178.917 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.506 HD13 ' HG2' ' A' ' 20' ' ' LYS . 28.3 tp -95.84 127.67 42.06 Favored 'General case' 0 N--CA 1.493 1.689 0 N-CA-C 109.096 -0.705 . . . . 0.0 109.096 173.947 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 87.9 mt -96.47 169.26 10.03 Favored 'General case' 0 N--CA 1.495 1.814 0 O-C-N 121.567 -0.708 . . . . 0.0 111.168 -172.793 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 24.2 p30 -57.59 -22.14 43.21 Favored 'General case' 0 N--CA 1.507 2.398 0 O-C-N 121.94 -0.475 . . . . 0.0 111.636 -177.123 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 44.6 p-10 -92.53 22.83 4.36 Favored 'General case' 0 N--CA 1.498 1.943 0 O-C-N 121.522 -0.736 . . . . 0.0 110.905 -176.995 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 74.5 m-20 58.56 27.5 15.77 Favored 'General case' 0 N--CA 1.505 2.312 0 O-C-N 121.465 -0.772 . . . . 0.0 110.637 176.078 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 48.0 m -106.29 143.6 34.18 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.519 -0.738 . . . . 0.0 109.597 172.859 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 20' ' ' LYS . . . . . 0.506 ' HG2' HD13 ' A' ' 14' ' ' LEU . 66.5 mttt -109.73 148.86 30.66 Favored 'General case' 0 N--CA 1.494 1.749 0 O-C-N 121.579 -0.701 . . . . 0.0 110.556 -176.229 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -153.07 154.21 34.41 Favored 'General case' 0 N--CA 1.496 1.834 0 O-C-N 121.729 -0.607 . . . . 0.0 110.105 176.066 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 22' ' ' ARG . . . . . 0.402 ' O ' HD22 ' A' ' 39' ' ' LEU . 30.8 ptt180 -138.69 151.17 46.94 Favored 'General case' 0 N--CA 1.497 1.913 0 O-C-N 121.597 -0.689 . . . . 0.0 110.466 179.341 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 23' ' ' GLY . . . . . 0.433 ' HA2' HD13 ' A' ' 39' ' ' LEU . . . -171.9 171.27 44.04 Favored Glycine 0 N--CA 1.492 2.394 0 N-CA-C 108.956 -1.658 . . . . 0.0 108.956 -178.71 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 24' ' ' VAL . . . . . 0.628 HG22 ' OD1' ' A' ' 10' ' ' ASN . 30.3 t -94.56 124.85 47.21 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.815 0 O-C-N 121.571 -0.958 . . . . 0.0 109.125 175.498 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 25' ' ' ILE . . . . . 0.492 ' HA ' HD23 ' A' ' 37' ' ' LEU . 51.0 mt -61.87 134.77 27.07 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.171 0 O-C-N 121.428 -0.795 . . . . 0.0 110.834 -171.839 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 26' ' ' THR . . . . . 0.737 HG21 ' HB2' ' A' ' 38' ' ' ARG . 11.0 p -121.21 -16.94 7.84 Favored 'General case' 0 N--CA 1.494 1.765 0 O-C-N 121.916 -0.49 . . . . 0.0 111.61 -177.844 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 27' ' ' ASN . . . . . 0.424 ' O ' HD12 ' A' ' 35' ' ' LEU . 4.8 t-20 -166.09 157.38 13.49 Favored 'General case' 0 N--CA 1.504 2.251 0 O-C-N 120.927 -1.108 . . . . 0.0 111.75 175.61 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 28' ' ' PHE . . . . . 0.416 ' CZ ' HG21 ' A' ' 3' ' ' VAL . 72.0 t80 -150.28 122.15 8.15 Favored 'General case' 0 N--CA 1.496 1.855 0 N-CA-C 109.225 -0.657 . . . . 0.0 109.225 173.459 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 26.6 t0 -99.12 130.45 45.44 Favored 'General case' 0 N--CA 1.491 1.614 0 N-CA-C 109.139 -0.689 . . . . 0.0 109.139 -178.022 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 19.3 m -70.55 -51.88 25.53 Favored 'General case' 0 N--CA 1.497 1.916 0 C-N-CA 120.0 -0.68 . . . . 0.0 110.54 -176.081 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 31.5 m -60.71 -40.79 93.6 Favored 'General case' 0 N--CA 1.501 2.116 0 O-C-N 121.617 -0.677 . . . . 0.0 110.847 -174.813 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 91.6 m-20 -103.85 -9.97 18.57 Favored 'General case' 0 N--CA 1.497 1.914 0 O-C-N 121.678 -0.639 . . . . 0.0 111.616 -177.579 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 15.0 m 49.83 67.26 0.93 Allowed 'General case' 0 N--CA 1.508 2.468 0 O-C-N 121.142 -0.974 . . . . 0.0 110.899 -174.665 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 34' ' ' ILE . . . . . 1.042 HD12 HG22 ' A' ' 48' ' ' VAL . 43.9 mm -120.8 125.93 74.64 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.997 0 O-C-N 121.623 -0.673 . . . . 0.0 109.26 -175.645 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.424 HD12 ' O ' ' A' ' 27' ' ' ASN . 14.8 tp -115.93 118.89 34.22 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.691 -0.63 . . . . 0.0 110.451 -170.659 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 78.4 mt-30 -90.96 132.75 35.77 Favored 'General case' 0 N--CA 1.489 1.517 0 N-CA-C 109.21 -0.663 . . . . 0.0 109.21 171.863 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 0.492 HD23 ' HA ' ' A' ' 25' ' ' ILE . 56.7 mt -117.77 123.57 46.32 Favored 'General case' 0 N--CA 1.493 1.693 0 C-N-CA 120.214 -0.594 . . . . 0.0 109.946 175.435 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 38' ' ' ARG . . . . . 0.737 ' HB2' HG21 ' A' ' 26' ' ' THR . 74.2 ttt-85 -104.27 104.87 14.84 Favored 'General case' 0 N--CA 1.496 1.835 0 O-C-N 121.716 -0.615 . . . . 0.0 109.97 173.643 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.433 HD13 ' HA2' ' A' ' 23' ' ' GLY . 63.7 tp -85.01 156.76 20.98 Favored 'General case' 0 N--CA 1.498 1.926 0 O-C-N 121.622 -0.674 . . . . 0.0 110.607 -176.339 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -66.82 -3.0 5.79 Favored 'General case' 0 N--CA 1.502 2.168 0 O-C-N 121.927 -0.483 . . . . 0.0 112.203 -170.954 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 91.6 m-20 -86.01 28.94 0.76 Allowed 'General case' 0 N--CA 1.498 1.946 0 O-C-N 120.97 -1.081 . . . . 0.0 110.765 172.364 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 10.2 m-20 59.34 31.4 21.1 Favored 'General case' 0 N--CA 1.504 2.243 0 O-C-N 121.244 -0.91 . . . . 0.0 110.419 174.372 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 66.2 m -124.64 137.83 54.35 Favored 'General case' 0 N--CA 1.496 1.865 0 O-C-N 121.486 -0.759 . . . . 0.0 110.439 178.877 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 8.5 t -103.93 151.13 23.53 Favored 'General case' 0 N--CA 1.498 1.933 0 O-C-N 121.816 -0.553 . . . . 0.0 110.262 176.32 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 39.0 ttmt -149.81 119.15 6.85 Favored 'General case' 0 N--CA 1.495 1.819 0 O-C-N 121.616 -0.677 . . . . 0.0 110.365 178.224 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 88.6 p -94.93 121.4 36.49 Favored 'General case' 0 N--CA 1.495 1.811 0 O-C-N 121.781 -0.575 . . . . 0.0 110.264 179.936 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 81.7 mt -129.28 135.14 62.5 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.853 0 O-C-N 121.686 -0.634 . . . . 0.0 109.342 179.572 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 48' ' ' VAL . . . . . 1.042 HG22 HD12 ' A' ' 34' ' ' ILE . 67.6 t -81.61 127.63 39.42 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.862 0 N-CA-C 109.069 -0.715 . . . . 0.0 109.069 177.35 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 49' ' ' THR . . . . . 0.6 ' HB ' HD22 ' B' ' 264' ' ' LEU . 59.6 p -58.28 -24.85 60.82 Favored 'General case' 0 N--CA 1.503 2.2 0 O-C-N 121.492 -0.755 . . . . 0.0 111.855 -168.337 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 19.0 tptm -56.89 -26.65 59.4 Favored 'General case' 0 N--CA 1.501 2.118 0 O-C-N 121.531 -0.731 . . . . 0.0 111.024 -177.12 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 4.9 p30 -85.1 6.85 23.81 Favored 'General case' 0 N--CA 1.498 1.958 0 C-N-CA 119.748 -0.781 . . . . 0.0 111.42 176.562 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 52' ' ' ILE . . . . . 0.406 HD12 HD13 ' B' ' 264' ' ' LEU . 98.4 mt -75.34 124.25 32.86 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.115 0 O-C-N 121.171 -0.956 . . . . 0.0 109.849 175.704 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 23.2 tptp -92.06 -29.11 16.74 Favored 'General case' 0 N--CA 1.494 1.774 0 O-C-N 121.801 -0.562 . . . . 0.0 109.879 171.081 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 5.2 m-20 -163.62 155.08 16.76 Favored 'General case' 0 N--CA 1.5 2.052 0 O-C-N 121.813 -0.554 . . . . 0.0 110.11 -178.145 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 55' ' ' LEU . . . . . 0.545 ' CD2' HG22 ' A' ' 13' ' ' VAL . 85.1 mt -132.99 149.65 52.22 Favored 'General case' 0 N--CA 1.497 1.903 0 O-C-N 121.736 -0.603 . . . . 0.0 110.432 -179.04 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 7.7 ptm180 -151.74 141.59 21.98 Favored 'General case' 0 N--CA 1.494 1.757 0 O-C-N 121.706 -0.621 . . . . 0.0 109.925 175.861 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 57' ' ' ILE . . . . . 0.443 ' HA ' HG12 ' A' ' 11' ' ' VAL . 69.5 mt -85.65 133.13 30.27 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.881 0 O-C-N 121.482 -0.762 . . . . 0.0 109.776 173.78 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 58' ' ' LEU . . . . . 0.583 HD11 ' HB2' ' A' ' 12' ' ' GLU . 79.2 mt -84.56 161.16 54.72 Favored Pre-proline 0 N--CA 1.496 1.869 0 O-C-N 121.616 -0.677 . . . . 0.0 110.07 178.611 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 24.9 Cg_endo -66.15 131.73 27.71 Favored 'Trans proline' 0 N--CA 1.488 1.165 0 O-C-N 123.628 1.331 . . . . 0.0 110.477 179.658 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 52.9 tttm -102.78 -53.93 2.75 Favored 'General case' 0 N--CA 1.495 1.797 0 O-C-N 121.698 -0.627 . . . . 0.0 110.302 -179.669 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 37.6 t30 -98.4 136.15 38.96 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.681 -0.637 . . . . 0.0 110.279 -178.764 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 74.8 mm-40 -101.48 162.96 12.52 Favored 'General case' 0 N--CA 1.495 1.812 0 O-C-N 121.626 -0.671 . . . . 0.0 110.233 179.683 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 18.2 tt -121.66 141.19 43.15 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.859 0 O-C-N 121.655 -0.653 . . . . 0.0 110.179 -179.455 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 64' ' ' MET . . . . . . . . . . . . . 23.8 ttm 52.16 67.49 3.98 Favored Pre-proline 0 N--CA 1.505 2.292 0 O-C-N 121.569 -0.707 . . . . 0.0 110.884 -179.32 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 25.7 Cg_endo -66.28 -35.09 33.35 Favored 'Trans proline' 0 N--CA 1.488 1.159 0 O-C-N 123.434 1.229 . . . . 0.0 110.503 -179.139 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 73.7 tttt -140.43 115.52 9.8 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.605 -0.684 . . . . 0.0 110.243 -179.986 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 15.4 t-20 -74.4 -37.25 63.44 Favored 'General case' 0 N--CA 1.498 1.943 0 O-C-N 121.741 -0.599 . . . . 0.0 110.178 178.36 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 173.94 -173.36 45.86 Favored Glycine 0 N--CA 1.494 2.518 0 N-CA-C 109.448 -1.461 . . . . 0.0 109.448 -179.581 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 23.0 m -97.54 113.38 25.07 Favored 'General case' 0 N--CA 1.494 1.749 0 O-C-N 121.632 -0.922 . . . . 0.0 110.175 179.745 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 47.8 mttp -144.88 164.35 31.34 Favored 'General case' 0 N--CA 1.495 1.814 0 O-C-N 121.723 -0.611 . . . . 0.0 110.211 179.598 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 2.3 t -120.34 78.66 27.37 Favored Pre-proline 0 N--CA 1.495 1.825 0 O-C-N 121.656 -0.653 . . . . 0.0 109.955 178.355 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 27.8 Cg_endo -67.03 -38.3 16.63 Favored 'Trans proline' 0 N--CA 1.489 1.261 0 O-C-N 123.546 1.287 . . . . 0.0 110.493 -178.323 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 88.4 p -147.08 156.85 43.35 Favored 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.707 -0.62 . . . . 0.0 110.348 -179.309 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 74' ' ' THR . . . . . 0.419 HG22 ' OG ' ' A' ' 76' ' ' SER . 24.3 m -68.04 -32.66 73.18 Favored 'General case' 0 N--CA 1.498 1.951 0 O-C-N 121.75 -0.594 . . . . 0.0 110.297 178.988 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 28.0 t30 55.97 40.15 30.45 Favored 'General case' 0 N--CA 1.505 2.314 0 O-C-N 121.508 -0.745 . . . . 0.0 110.748 -178.679 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 76' ' ' SER . . . . . 0.419 ' OG ' HG22 ' A' ' 74' ' ' THR . 49.9 m -123.34 152.28 41.64 Favored 'General case' 0 N--CA 1.495 1.806 0 O-C-N 121.644 -0.66 . . . . 0.0 110.097 178.995 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 23.9 m -79.0 131.19 36.21 Favored 'General case' 0 N--CA 1.497 1.889 0 O-C-N 121.648 -0.658 . . . . 0.0 110.183 -179.15 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 43.7 mmtt -130.51 143.63 50.88 Favored 'General case' 0 N--CA 1.496 1.826 0 O-C-N 121.621 -0.674 . . . . 0.0 110.164 179.454 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 83.0 mt -67.12 -34.73 78.24 Favored 'General case' 0 N--CA 1.5 2.044 0 O-C-N 121.686 -0.633 . . . . 0.0 110.14 179.064 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 90.2 mttt -102.11 168.9 9.08 Favored 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.741 -0.599 . . . . 0.0 110.147 179.322 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 50.2 m -108.68 149.16 29.35 Favored 'General case' 0 N--CA 1.495 1.82 0 O-C-N 121.675 -0.641 . . . . 0.0 110.174 -179.784 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -68.61 151.36 46.83 Favored 'General case' 0 N--CA 1.498 1.96 0 O-C-N 121.65 -0.656 . . . . 0.0 110.173 -179.479 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 41.1 tt0 -94.54 137.09 34.08 Favored 'General case' 0 N--CA 1.495 1.777 0 O-C-N 121.648 -0.658 . . . . 0.0 110.184 -179.658 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 10.1 t -134.32 156.71 47.98 Favored 'General case' 0 N--CA 1.497 1.897 0 O-C-N 121.782 -0.574 . . . . 0.0 110.236 179.532 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 97.5 m-85 -113.7 103.24 11.02 Favored 'General case' 0 N--CA 1.495 1.796 0 O-C-N 121.642 -0.662 . . . . 0.0 110.23 179.896 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 93.3 p -163.92 99.4 0.87 Allowed 'General case' 0 N--CA 1.496 1.829 0 O-C-N 121.635 -0.665 . . . . 0.0 110.11 179.231 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 78.6 p -66.96 -30.35 70.46 Favored 'General case' 0 N--CA 1.5 2.032 0 O-C-N 121.711 -0.618 . . . . 0.0 110.374 179.908 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 71.4 tttt 54.0 47.07 24.22 Favored 'General case' 0 N--CA 1.505 2.296 0 O-C-N 121.556 -0.715 . . . . 0.0 110.969 178.196 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 28.0 p-10 -162.68 -39.55 0.04 OUTLIER 'General case' 0 N--CA 1.498 1.949 0 O-C-N 121.545 -0.722 . . . . 0.0 110.664 178.172 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 36.2 ttmt -131.85 125.81 32.71 Favored 'General case' 0 N--CA 1.496 1.826 0 O-C-N 121.552 -0.718 . . . . 0.0 110.086 177.859 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 91' ' ' TRP . . . . . . . . . . . . . 45.9 p-90 -143.27 162.93 34.36 Favored 'General case' 0 N--CA 1.496 1.841 0 O-C-N 121.688 -0.632 . . . . 0.0 110.299 -179.923 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 48.4 m -120.66 147.15 45.64 Favored 'General case' 0 N--CA 1.496 1.852 0 O-C-N 121.733 -0.605 . . . . 0.0 110.198 -179.88 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 93' ' ' MET . . . . . . . . . . . . . 24.0 ttt -106.96 137.48 44.95 Favored 'General case' 0 N--CA 1.494 1.771 0 O-C-N 121.724 -0.61 . . . . 0.0 110.209 179.993 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 4.5 p-10 . . . . . 0 N--CA 1.498 1.942 0 CA-C-O 117.997 -1.001 . . . . 0.0 110.253 179.856 . . . . . . . . 0 0 . 1 . 011 nuclear build full ' B' B ' 240' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.334 0 N-CA-C 109.529 -1.428 . . . . 0.0 109.529 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' B' B ' 241' ' ' ALA . . . . . . . . . . . . . . . -100.33 134.75 42.81 Favored 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.679 -0.895 . . . . 0.0 110.231 -179.867 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 242' ' ' THR . . . . . . . . . . . . . 9.8 t -139.15 161.42 37.45 Favored 'General case' 0 N--CA 1.496 1.827 0 O-C-N 121.676 -0.64 . . . . 0.0 110.356 179.721 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 243' ' ' THR . . . . . . . . . . . . . 24.6 m -113.95 128.78 56.54 Favored 'General case' 0 N--CA 1.495 1.824 0 O-C-N 121.636 -0.665 . . . . 0.0 110.215 -179.872 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 244' ' ' LYS . . . . . . . . . . . . . 67.7 mttt -140.75 155.15 46.5 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.71 -0.619 . . . . 0.0 110.132 179.126 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 245' ' ' GLU . . . . . . . . . . . . . 54.1 mt-10 -66.09 -33.68 76.34 Favored 'General case' 0 N--CA 1.5 2.048 0 O-C-N 121.69 -0.631 . . . . 0.0 110.318 179.775 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 246' ' ' LYS . . . . . . . . . . . . . 34.7 tttp -98.62 135.45 40.12 Favored 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.561 -0.712 . . . . 0.0 110.172 179.108 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 247' ' ' ASN . . . . . . . . . . . . . 27.2 p30 -140.35 -177.45 5.03 Favored 'General case' 0 N--CA 1.497 1.913 0 O-C-N 121.67 -0.644 . . . . 0.0 110.393 -179.55 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 248' ' ' ILE . . . . . . . . . . . . . 50.7 mm 54.11 96.82 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.508 2.452 0 O-C-N 121.631 -0.668 . . . . 0.0 110.659 -179.787 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 249' ' ' SER . . . . . . . . . . . . . 33.9 t -89.16 161.82 16.26 Favored 'General case' 0 N--CA 1.495 1.823 0 O-C-N 121.704 -0.622 . . . . 0.0 110.172 179.596 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 250' ' ' VAL . . . . . 0.407 ' H ' HG22 ' B' ' 250' ' ' VAL . 35.1 m -90.21 14.45 1.33 Allowed 'Isoleucine or valine' 0 N--CA 1.503 2.181 0 O-C-N 121.698 -0.626 . . . . 0.0 111.435 -179.34 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 251' ' ' ASP . . . . . . . . . . . . . 74.3 m-20 -82.17 -3.22 54.5 Favored 'General case' 0 N--CA 1.499 1.995 0 O-C-N 121.266 -0.896 . . . . 0.0 111.37 179.407 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 252' ' ' VAL . . . . . 0.421 HG12 ' N ' ' B' ' 253' ' ' ASP . 39.9 t 58.37 164.33 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.51 2.54 0 O-C-N 121.363 -0.836 . . . . 0.0 110.595 -178.994 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 253' ' ' ASP . . . . . 0.421 ' N ' HG12 ' B' ' 252' ' ' VAL . 74.6 m-20 -81.42 117.82 22.18 Favored 'General case' 0 N--CA 1.497 1.913 0 O-C-N 121.417 -0.802 . . . . 0.0 110.294 -179.289 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 254' ' ' ALA . . . . . . . . . . . . . . . -67.42 -28.59 68.02 Favored 'General case' 0 N--CA 1.501 2.098 0 O-C-N 121.689 -0.632 . . . . 0.0 110.497 177.837 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 255' ' ' ASP . . . . . . . . . . . . . 74.5 m-20 -72.04 -25.97 62.01 Favored 'General case' 0 N--CA 1.499 2.019 0 O-C-N 121.62 -0.675 . . . . 0.0 110.751 -178.908 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 256' ' ' ALA . . . . . . . . . . . . . . . -61.67 -35.37 77.78 Favored 'General case' 0 N--CA 1.501 2.122 0 O-C-N 121.4 -0.813 . . . . 0.0 110.541 -178.056 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 257' ' ' SER . . . . . . . . . . . . . 32.2 t -55.14 -35.0 64.26 Favored 'General case' 0 N--CA 1.505 2.28 0 O-C-N 121.61 -0.681 . . . . 0.0 110.327 177.238 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 258' ' ' SER . . . . . . . . . . . . . 24.1 m -68.01 -31.39 71.05 Favored 'General case' 0 N--CA 1.497 1.919 0 C-N-CA 120.513 -0.475 . . . . 0.0 110.225 178.87 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 259' ' ' GLN . . . . . . . . . . . . . 48.7 tt0 -63.26 -37.12 86.01 Favored 'General case' 0 N--CA 1.5 2.027 0 O-C-N 121.647 -0.658 . . . . 0.0 110.37 178.714 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 260' ' ' LEU . . . . . 0.493 ' HA ' HD12 ' B' ' 263' ' ' LEU . 82.1 mt -64.18 -43.75 94.14 Favored 'General case' 0 N--CA 1.501 2.079 0 O-C-N 121.628 -0.67 . . . . 0.0 110.248 179.184 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 261' ' ' LEU . . . . . . . . . . . . . 17.5 tp -70.69 -38.36 73.68 Favored 'General case' 0 N--CA 1.497 1.915 0 O-C-N 121.662 -0.649 . . . . 0.0 109.733 175.919 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 262' ' ' SER . . . . . . . . . . . . . 23.1 t -62.38 -35.56 79.56 Favored 'General case' 0 N--CA 1.501 2.093 0 O-C-N 121.681 -0.637 . . . . 0.0 110.52 176.639 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 263' ' ' LEU . . . . . 0.493 HD12 ' HA ' ' B' ' 260' ' ' LEU . 18.3 mt -64.53 -42.0 96.01 Favored 'General case' 0 N--CA 1.501 2.101 0 O-C-N 121.689 -0.632 . . . . 0.0 110.254 179.679 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 264' ' ' LEU . . . . . 0.6 HD22 ' HB ' ' A' ' 49' ' ' THR . 87.6 mt -62.51 -38.62 90.64 Favored 'General case' 0 N--CA 1.502 2.146 0 O-C-N 121.691 -0.631 . . . . 0.0 110.509 178.715 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 265' ' ' LYS . . . . . . . . . . . . . 96.1 mttt -75.71 -32.84 60.24 Favored 'General case' 0 N--CA 1.498 1.949 0 O-C-N 121.743 -0.598 . . . . 0.0 110.272 -179.874 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 266' ' ' SER . . . . . . . . . . . . . 7.7 m -162.94 149.08 12.26 Favored 'General case' 0 N--CA 1.494 1.762 0 O-C-N 121.589 -0.694 . . . . 0.0 110.069 179.262 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 267' ' ' SER . . . . . . . . . . . . . 14.2 m -120.91 32.34 6.01 Favored 'General case' 0 N--CA 1.495 1.809 0 O-C-N 121.63 -0.669 . . . . 0.0 110.421 -179.36 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 268' ' ' THR . . . . . . . . . . . . . 43.1 p -69.73 -35.66 75.18 Favored 'General case' 0 N--CA 1.498 1.958 0 O-C-N 121.564 -0.71 . . . . 0.0 110.016 179.564 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 269' ' ' ALA . . . . . . . . . . . . . . . 47.92 85.32 0.18 Allowed Pre-proline 0 N--CA 1.506 2.329 0 O-C-N 121.77 -0.582 . . . . 0.0 111.323 -179.16 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 270' ' ' PRO . . . . . . . . . . . . . 18.9 Cg_exo -62.75 142.13 87.91 Favored 'Trans proline' 0 N--CA 1.49 1.29 0 O-C-N 123.513 1.27 . . . . 0.0 110.524 179.318 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 271' ' ' SER . . . . . . . . . . . . . 90.5 p -143.77 157.81 44.12 Favored 'General case' 0 N--CA 1.495 1.813 0 O-C-N 121.704 -0.622 . . . . 0.0 110.291 -179.944 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 272' ' ' ASP . . . . . . . . . . . . . 74.2 m-20 -102.11 145.51 29.25 Favored 'General case' 0 N--CA 1.495 1.81 0 O-C-N 121.666 -0.646 . . . . 0.0 110.268 179.634 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 273' ' ' LEU . . . . . . . . . . . . . 4.3 mm? 51.12 -171.84 0.03 OUTLIER 'General case' 0 N--CA 1.505 2.318 0 O-C-N 121.651 -0.656 . . . . 0.0 111.184 -179.932 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 274' ' ' ALA . . . . . . . . . . . . . . . 51.22 -174.8 0.02 OUTLIER 'General case' 0 N--CA 1.505 2.292 0 O-C-N 121.682 -0.636 . . . . 0.0 111.275 -179.383 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 275' ' ' THR . . . . . . . . . . . . . 22.8 p -150.44 164.62 19.83 Favored Pre-proline 0 N--CA 1.494 1.751 0 O-C-N 121.636 -0.665 . . . . 0.0 110.259 -179.839 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 276' ' ' PRO . . . . . . . . . . . . . 19.9 Cg_exo -62.32 152.9 73.88 Favored 'Trans proline' 0 N--CA 1.491 1.34 0 O-C-N 123.591 1.311 . . . . 0.0 110.615 179.144 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 277' ' ' GLN . . . . . . . . . . . . . 13.3 pt20 -114.1 161.84 26.08 Favored Pre-proline 0 N--CA 1.498 1.973 0 O-C-N 121.641 -0.662 . . . . 0.0 110.347 -179.876 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 278' ' ' PRO . . . . . . . . . . . . . 19.7 Cg_exo -62.19 138.83 74.61 Favored 'Trans proline' 0 N--CA 1.491 1.34 0 O-C-N 123.656 1.345 . . . . 0.0 110.703 -179.24 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 279' ' ' SER . . . . . . . . . . . . . 86.8 p -122.81 32.52 5.7 Favored 'General case' 0 N--CA 1.495 1.822 0 O-C-N 121.628 -0.67 . . . . 0.0 110.207 178.7 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 280' ' ' THR . . . . . . . . . . . . . 24.3 m -65.56 -36.97 85.35 Favored 'General case' 0 N--CA 1.501 2.084 0 O-C-N 121.626 -0.671 . . . . 0.0 110.447 -178.301 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 281' ' ' PHE . . . . . . . . . . . . . 89.0 m-85 -109.03 162.6 19.46 Favored Pre-proline 0 N--CA 1.495 1.796 0 O-C-N 121.701 -0.624 . . . . 0.0 110.298 -178.692 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 282' ' ' PRO . . . . . . . . . . . . . 19.4 Cg_exo -62.36 153.91 67.36 Favored 'Trans proline' 0 N--CA 1.49 1.275 0 O-C-N 123.587 1.309 . . . . 0.0 110.626 179.759 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 283' ' ' GLN . . . . . . . . . . . . . 58.0 mm-40 -88.35 156.21 51.2 Favored Pre-proline 0 N--CA 1.496 1.832 0 O-C-N 121.651 -0.655 . . . . 0.0 110.24 179.975 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 284' ' ' PRO . . . . . . . . . . . . . 29.9 Cg_endo -68.06 157.39 61.99 Favored 'Trans proline' 0 N--CA 1.487 1.132 0 O-C-N 123.667 1.351 . . . . 0.0 110.383 -179.537 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 285' ' ' PRO . . . . . . . . . . . . . 26.1 Cg_endo -66.45 152.79 80.1 Favored 'Trans proline' 0 N--CA 1.487 1.146 0 O-C-N 123.652 1.343 . . . . 0.0 110.45 179.746 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 286' ' ' VAL . . . . . . . . . . . . . 62.0 t -109.45 135.39 48.55 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.884 0 O-C-N 121.651 -0.656 . . . . 0.0 109.775 -179.584 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 287' ' ' GLU . . . . . . . . . . . . . 79.2 mt-10 -109.82 157.88 18.72 Favored 'General case' 0 N--CA 1.496 1.834 0 O-C-N 121.718 -0.614 . . . . 0.0 110.194 179.875 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 288' ' ' SER . . . . . . . . . . . . . 49.1 m -68.22 153.77 43.07 Favored 'General case' 0 N--CA 1.498 1.975 0 O-C-N 121.591 -0.693 . . . . 0.0 110.266 -179.815 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 289' ' ' HIS . . . . . . . . . . . . . 48.3 p-80 -128.86 33.29 4.64 Favored 'General case' 0 N--CA 1.497 1.895 0 O-C-N 121.713 -0.617 . . . . 0.0 110.377 -179.78 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 290' ' ' SER . . . . . . . . . . . . . 85.3 p -80.44 160.89 25.17 Favored 'General case' 0 N--CA 1.498 1.946 0 O-C-N 121.62 -0.675 . . . . 0.0 110.222 -179.7 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 291' ' ' SER . . . . . . . . . . . . . 23.0 t . . . . . 0 N--CA 1.494 1.763 0 CA-C-O 118.029 -0.986 . . . . 0.0 110.242 -179.91 . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' -1' ' ' MET . . . . . . . . . . . . . 85.3 mtp . . . . . 0 N--CA 1.494 1.736 0 CA-C-O 120.994 0.426 . . . . 0.0 110.13 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 0' ' ' GLY . . . . . . . . . . . . . . . 75.31 71.49 1.14 Allowed Glycine 0 N--CA 1.493 2.483 0 N-CA-C 109.598 -1.401 . . . . 0.0 109.598 179.708 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 89.4 mtp 52.66 95.19 0.02 OUTLIER 'General case' 0 N--CA 1.505 2.3 0 O-C-N 121.556 -0.967 . . . . 0.0 111.119 -179.97 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 69.7 m -99.58 168.76 9.75 Favored 'General case' 0 N--CA 1.494 1.725 0 O-C-N 121.668 -0.645 . . . . 0.0 110.146 -179.748 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 3' ' ' VAL . . . . . 0.428 HG12 ' CE1' ' A' ' 7' ' ' TYR . 61.3 t -65.92 -27.86 42.3 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.111 0 O-C-N 121.707 -0.621 . . . . 0.0 110.241 -178.798 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -55.19 -30.84 60.73 Favored 'General case' 0 N--CA 1.504 2.255 0 O-C-N 121.4 -0.813 . . . . 0.0 110.44 -178.64 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 74.4 m-20 -68.77 -30.98 69.69 Favored 'General case' 0 N--CA 1.5 2.032 0 C-N-CA 120.33 -0.548 . . . . 0.0 110.252 174.854 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 6' ' ' PHE . . . . . 0.404 ' CE1' HD21 ' B' ' 260' ' ' LEU . 96.7 m-85 -96.09 10.04 38.89 Favored 'General case' 0 N--CA 1.497 1.889 0 O-C-N 121.653 -0.655 . . . . 0.0 111.512 -178.168 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 7' ' ' TYR . . . . . 0.428 ' CE1' HG12 ' A' ' 3' ' ' VAL . 3.3 m-30 -67.24 137.53 56.23 Favored 'General case' 0 N--CA 1.501 2.105 0 O-C-N 121.093 -1.004 . . . . 0.0 110.014 174.189 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 8' ' ' GLY . . . . . 0.416 ' O ' HG13 ' A' ' 24' ' ' VAL . . . 82.72 -0.64 89.3 Favored Glycine 0 N--CA 1.498 2.796 0 N-CA-C 110.704 -0.959 . . . . 0.0 110.704 -176.294 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 31.8 t -77.02 133.96 38.96 Favored 'General case' 0 N--CA 1.498 1.937 0 O-C-N 121.113 -1.228 . . . . 0.0 110.488 178.928 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 13.6 t-20 -83.13 120.53 25.89 Favored 'General case' 0 N--CA 1.497 1.887 0 O-C-N 121.694 -0.628 . . . . 0.0 109.526 173.399 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 11' ' ' VAL . . . . . 0.538 HG12 ' HA ' ' A' ' 57' ' ' ILE . 35.2 m -143.15 165.42 15.45 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.734 0 N-CA-C 109.527 -0.546 . . . . 0.0 109.527 -178.329 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 12' ' ' GLU . . . . . 0.446 ' HB2' HD11 ' A' ' 58' ' ' LEU . 47.0 tt0 -109.35 126.38 53.34 Favored 'General case' 0 N--CA 1.494 1.729 0 C-N-CA 119.897 -0.721 . . . . 0.0 109.752 176.54 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 13' ' ' VAL . . . . . 0.608 HG22 ' CD2' ' A' ' 55' ' ' LEU . 54.1 t -106.79 125.1 62.77 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.745 0 O-C-N 121.614 -0.679 . . . . 0.0 109.891 -178.098 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 25.0 tp -95.94 128.59 42.97 Favored 'General case' 0 N--CA 1.494 1.734 0 N-CA-C 109.326 -0.62 . . . . 0.0 109.326 174.838 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 87.6 mt -96.68 169.5 9.83 Favored 'General case' 0 N--CA 1.496 1.837 0 O-C-N 121.677 -0.64 . . . . 0.0 111.004 -173.846 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 24.3 p30 -57.71 -22.2 44.94 Favored 'General case' 0 N--CA 1.505 2.307 0 O-C-N 121.701 -0.625 . . . . 0.0 111.615 -176.984 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 43.7 p-10 -93.05 23.16 4.44 Favored 'General case' 0 N--CA 1.497 1.902 0 O-C-N 121.523 -0.736 . . . . 0.0 110.867 -177.001 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 74.4 m-20 58.72 27.54 16.06 Favored 'General case' 0 N--CA 1.506 2.344 0 O-C-N 121.435 -0.79 . . . . 0.0 110.594 176.155 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 51.0 m -106.86 146.06 31.42 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.502 -0.749 . . . . 0.0 109.563 173.109 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 48.6 mttm -109.6 143.74 38.89 Favored 'General case' 0 N--CA 1.495 1.776 0 O-C-N 121.599 -0.688 . . . . 0.0 110.63 -176.599 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -153.07 123.64 7.23 Favored 'General case' 0 N--CA 1.497 1.876 0 O-C-N 121.778 -0.576 . . . . 0.0 110.048 176.575 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 22' ' ' ARG . . . . . 0.532 ' O ' HD13 ' A' ' 39' ' ' LEU . 8.9 ptp85 -118.32 147.61 43.31 Favored 'General case' 0 N--CA 1.498 1.96 0 O-C-N 121.615 -0.678 . . . . 0.0 110.375 -176.483 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -171.79 171.44 44.1 Favored Glycine 0 N--CA 1.495 2.63 0 N-CA-C 108.975 -1.65 . . . . 0.0 108.975 -176.148 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 24' ' ' VAL . . . . . 0.416 HG13 ' O ' ' A' ' 8' ' ' GLY . 47.2 t -94.58 119.41 42.53 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.925 0 O-C-N 121.433 -1.039 . . . . 0.0 109.355 -177.462 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 25' ' ' ILE . . . . . 0.413 ' HA ' HD23 ' A' ' 37' ' ' LEU . 74.9 mt -64.25 143.58 15.55 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.155 0 O-C-N 121.7 -0.625 . . . . 0.0 110.449 -171.975 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 26' ' ' THR . . . . . 0.794 HG21 ' HG3' ' A' ' 38' ' ' ARG . 20.7 p -121.3 -27.31 4.88 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.785 -0.572 . . . . 0.0 111.233 179.176 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 27' ' ' ASN . . . . . 0.538 ' O ' HD12 ' A' ' 35' ' ' LEU . 26.9 t30 -161.39 160.91 30.06 Favored 'General case' 0 N--CA 1.501 2.078 0 C-N-CA 118.95 -1.1 . . . . 0.0 111.814 -178.854 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 28' ' ' PHE . . . . . 0.444 ' CE1' HG21 ' A' ' 49' ' ' THR . 69.5 t80 -150.02 128.37 12.14 Favored 'General case' 0 N--CA 1.496 1.86 0 N-CA-C 109.301 -0.629 . . . . 0.0 109.301 169.107 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 17.9 t70 -100.2 130.56 46.34 Favored 'General case' 0 N--CA 1.492 1.659 0 N-CA-C 109.04 -0.726 . . . . 0.0 109.04 -178.351 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 87.1 p -68.87 -48.59 63.03 Favored 'General case' 0 N--CA 1.498 1.963 0 C-N-CA 120.016 -0.674 . . . . 0.0 110.649 -175.925 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 23.0 m -59.76 -43.77 94.15 Favored 'General case' 0 N--CA 1.502 2.16 0 O-C-N 121.636 -0.665 . . . . 0.0 110.907 -174.221 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 91.5 m-20 -104.24 -8.66 19.18 Favored 'General case' 0 N--CA 1.497 1.919 0 O-C-N 121.687 -0.633 . . . . 0.0 111.619 -178.252 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 24.8 m 49.71 67.22 0.93 Allowed 'General case' 0 N--CA 1.508 2.442 0 O-C-N 121.131 -0.98 . . . . 0.0 110.929 -174.403 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 34' ' ' ILE . . . . . 0.986 HD12 HG22 ' A' ' 48' ' ' VAL . 42.6 mm -122.52 126.1 73.6 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.028 0 O-C-N 121.635 -0.666 . . . . 0.0 109.356 -175.45 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.538 HD12 ' O ' ' A' ' 27' ' ' ASN . 12.3 tp -115.78 120.47 39.41 Favored 'General case' 0 N--CA 1.494 1.739 0 O-C-N 121.699 -0.626 . . . . 0.0 110.589 -169.464 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 99.0 mt-30 -91.08 132.96 35.71 Favored 'General case' 0 N--CA 1.49 1.538 0 N-CA-C 109.517 -0.549 . . . . 0.0 109.517 174.506 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 0.413 HD23 ' HA ' ' A' ' 25' ' ' ILE . 15.5 mt -117.95 123.84 46.76 Favored 'General case' 0 N--CA 1.495 1.811 0 O-C-N 121.902 -0.498 . . . . 0.0 109.964 176.034 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 38' ' ' ARG . . . . . 0.794 ' HG3' HG21 ' A' ' 26' ' ' THR . 11.6 mtt85 -96.83 106.91 19.31 Favored 'General case' 0 N--CA 1.498 1.934 0 O-C-N 121.646 -0.659 . . . . 0.0 109.924 175.792 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.532 HD13 ' O ' ' A' ' 22' ' ' ARG . 16.8 tp -84.67 152.48 23.75 Favored 'General case' 0 N--CA 1.495 1.777 0 C-N-CA 120.24 -0.584 . . . . 0.0 110.813 -174.807 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -66.8 -5.44 12.19 Favored 'General case' 0 N--CA 1.502 2.146 0 O-C-N 121.941 -0.474 . . . . 0.0 112.041 -171.658 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 91.6 m-20 -86.99 28.09 0.95 Allowed 'General case' 0 N--CA 1.499 2.001 0 O-C-N 121.115 -0.991 . . . . 0.0 110.879 174.547 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 8.5 t70 62.91 29.27 16.55 Favored 'General case' 0 N--CA 1.505 2.278 0 O-C-N 120.981 -1.074 . . . . 0.0 110.462 175.769 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 50.1 m -124.5 137.86 54.39 Favored 'General case' 0 N--CA 1.496 1.838 0 O-C-N 121.401 -0.812 . . . . 0.0 110.49 -179.438 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 9.8 t -97.7 150.99 20.59 Favored 'General case' 0 N--CA 1.497 1.911 0 O-C-N 121.818 -0.552 . . . . 0.0 110.194 175.47 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 41.3 tttp -149.3 119.13 7.07 Favored 'General case' 0 N--CA 1.495 1.786 0 O-C-N 121.546 -0.721 . . . . 0.0 110.313 178.679 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 90.2 p -95.61 122.27 38.18 Favored 'General case' 0 N--CA 1.494 1.769 0 O-C-N 121.701 -0.625 . . . . 0.0 110.194 179.005 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 82.3 mt -129.21 134.38 64.0 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.924 0 O-C-N 121.717 -0.614 . . . . 0.0 109.423 179.396 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 48' ' ' VAL . . . . . 0.986 HG22 HD12 ' A' ' 34' ' ' ILE . 49.1 t -82.62 127.88 39.24 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.941 0 O-C-N 121.66 -0.65 . . . . 0.0 109.321 179.14 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 49' ' ' THR . . . . . 0.444 HG21 ' CE1' ' A' ' 28' ' ' PHE . 33.9 p -58.53 -24.98 61.93 Favored 'General case' 0 N--CA 1.505 2.285 0 O-C-N 121.649 -0.657 . . . . 0.0 112.332 -166.013 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 24.6 pttm -56.34 -22.59 31.87 Favored 'General case' 0 N--CA 1.505 2.278 0 O-C-N 121.488 -0.757 . . . . 0.0 111.239 -175.779 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 9.9 p30 -82.51 -0.53 46.98 Favored 'General case' 0 N--CA 1.5 2.042 0 O-C-N 121.563 -0.711 . . . . 0.0 111.199 176.253 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 94.1 mt -77.0 126.96 38.06 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.069 0 O-C-N 121.176 -0.953 . . . . 0.0 110.012 177.585 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 41.1 tttp -92.02 -29.84 16.38 Favored 'General case' 0 N--CA 1.494 1.765 0 O-C-N 121.809 -0.557 . . . . 0.0 109.822 170.592 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 5.3 m-20 -164.24 156.97 17.31 Favored 'General case' 0 N--CA 1.5 2.026 0 O-C-N 121.717 -0.614 . . . . 0.0 110.058 -177.923 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 55' ' ' LEU . . . . . 0.608 ' CD2' HG22 ' A' ' 13' ' ' VAL . 74.4 mt -132.9 148.73 52.29 Favored 'General case' 0 N--CA 1.497 1.902 0 O-C-N 121.721 -0.612 . . . . 0.0 110.429 -179.287 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 7.0 ptm180 -151.06 141.53 22.5 Favored 'General case' 0 N--CA 1.496 1.863 0 O-C-N 121.694 -0.629 . . . . 0.0 109.868 175.634 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 57' ' ' ILE . . . . . 0.538 ' HA ' HG12 ' A' ' 11' ' ' VAL . 59.1 mt -85.74 133.36 29.74 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.888 0 O-C-N 121.47 -0.769 . . . . 0.0 110.012 176.205 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 58' ' ' LEU . . . . . 0.456 HD11 ' HB2' ' A' ' 22' ' ' ARG . 20.8 mt -83.6 116.95 67.16 Favored Pre-proline 0 N--CA 1.498 1.962 0 O-C-N 121.606 -0.684 . . . . 0.0 109.942 -179.202 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 26.7 Cg_endo -66.16 -30.46 46.51 Favored 'Trans proline' 0 N--CA 1.49 1.283 0 O-C-N 123.322 1.17 . . . . 0.0 110.763 -178.854 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 62.3 mttm -89.56 136.62 32.93 Favored 'General case' 0 N--CA 1.497 1.91 0 O-C-N 121.587 -0.696 . . . . 0.0 110.237 -178.956 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 91.7 m-20 -137.82 170.33 16.23 Favored 'General case' 0 N--CA 1.495 1.799 0 O-C-N 121.704 -0.622 . . . . 0.0 110.143 179.634 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 54.3 mt-10 -102.71 146.52 28.1 Favored 'General case' 0 N--CA 1.495 1.798 0 O-C-N 121.624 -0.672 . . . . 0.0 110.253 179.992 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 82.1 mt -116.96 135.84 56.03 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.922 0 O-C-N 121.608 -0.683 . . . . 0.0 109.613 179.945 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 64' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -79.15 -56.31 0.84 Allowed Pre-proline 0 N--CA 1.498 1.953 0 O-C-N 121.675 -0.641 . . . . 0.0 110.432 -179.965 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 39.1 Cg_endo -73.47 140.98 30.84 Favored 'Trans proline' 0 N--CA 1.487 1.097 0 O-C-N 123.303 1.16 . . . . 0.0 110.289 -177.837 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 76.4 mttt -93.19 -68.81 0.78 Allowed 'General case' 0 N--CA 1.495 1.806 0 O-C-N 121.704 -0.622 . . . . 0.0 110.22 179.941 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 15.4 t-20 -145.59 111.37 5.51 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.625 -0.672 . . . . 0.0 110.19 -179.849 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 160.84 -35.26 0.41 Allowed Glycine 0 N--CA 1.495 2.575 0 N-CA-C 109.642 -1.383 . . . . 0.0 109.642 179.817 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 23.8 m -95.78 136.22 36.48 Favored 'General case' 0 N--CA 1.496 1.837 0 O-C-N 121.761 -0.846 . . . . 0.0 110.146 -179.484 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 60.2 mttm -116.1 148.72 39.98 Favored 'General case' 0 N--CA 1.496 1.839 0 O-C-N 121.684 -0.635 . . . . 0.0 110.144 179.674 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 46.5 m -96.7 156.77 36.23 Favored Pre-proline 0 N--CA 1.494 1.739 0 O-C-N 121.666 -0.646 . . . . 0.0 110.226 -179.749 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 27.8 Cg_endo -66.87 152.95 79.49 Favored 'Trans proline' 0 N--CA 1.49 1.281 0 O-C-N 123.714 1.376 . . . . 0.0 110.402 179.922 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 30.4 t -108.61 141.5 40.45 Favored 'General case' 0 N--CA 1.495 1.806 0 O-C-N 121.675 -0.641 . . . . 0.0 110.196 179.902 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 74' ' ' THR . . . . . 0.605 HG21 HD11 ' B' ' 248' ' ' ILE . 24.2 m -66.38 -36.93 84.09 Favored 'General case' 0 N--CA 1.5 2.048 0 O-C-N 121.68 -0.638 . . . . 0.0 110.243 -179.494 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 2.6 m-20 -103.89 125.34 50.23 Favored 'General case' 0 N--CA 1.495 1.811 0 O-C-N 121.644 -0.66 . . . . 0.0 110.217 -179.357 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 29.3 t -143.27 146.79 33.91 Favored 'General case' 0 N--CA 1.495 1.819 0 O-C-N 121.725 -0.609 . . . . 0.0 110.156 179.722 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 38.1 p -106.49 30.05 6.35 Favored 'General case' 0 N--CA 1.495 1.822 0 O-C-N 121.646 -0.659 . . . . 0.0 110.487 179.295 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 38.5 tttp -98.38 145.35 26.8 Favored 'General case' 0 N--CA 1.496 1.825 0 O-C-N 121.618 -0.676 . . . . 0.0 110.178 -179.739 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 79' ' ' LEU . . . . . 0.564 ' N ' HD12 ' A' ' 79' ' ' LEU . 6.0 mp -89.5 136.37 33.07 Favored 'General case' 0 N--CA 1.496 1.866 0 O-C-N 121.702 -0.624 . . . . 0.0 110.176 -179.67 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 33.9 pttt -154.1 48.08 0.62 Allowed 'General case' 0 N--CA 1.495 1.82 0 O-C-N 121.707 -0.62 . . . . 0.0 110.283 -179.756 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 85.0 p -70.56 162.69 28.38 Favored 'General case' 0 N--CA 1.499 1.995 0 O-C-N 121.614 -0.679 . . . . 0.0 110.203 -179.261 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -159.03 -45.34 0.06 Allowed 'General case' 0 N--CA 1.495 1.802 0 O-C-N 121.713 -0.617 . . . . 0.0 110.234 -179.738 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 54.7 mt-10 -100.27 168.02 10.06 Favored 'General case' 0 N--CA 1.495 1.791 0 O-C-N 121.687 -0.633 . . . . 0.0 110.177 179.532 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 9.8 t -123.13 144.26 49.45 Favored 'General case' 0 N--CA 1.497 1.922 0 O-C-N 121.685 -0.634 . . . . 0.0 110.307 -179.543 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 97.8 m-85 -70.88 -35.85 72.52 Favored 'General case' 0 N--CA 1.498 1.956 0 O-C-N 121.743 -0.598 . . . . 0.0 110.375 -178.646 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 30.4 t -111.31 145.89 38.01 Favored 'General case' 0 N--CA 1.495 1.794 0 O-C-N 121.606 -0.684 . . . . 0.0 110.316 -179.18 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 88.4 p -113.69 158.55 20.75 Favored 'General case' 0 N--CA 1.496 1.867 0 O-C-N 121.692 -0.63 . . . . 0.0 110.073 179.492 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 69.5 tttt -63.08 -41.23 99.37 Favored 'General case' 0 N--CA 1.501 2.106 0 O-C-N 121.663 -0.648 . . . . 0.0 110.441 -179.27 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 91.8 m-20 -119.3 105.05 10.94 Favored 'General case' 0 N--CA 1.496 1.844 0 O-C-N 121.66 -0.65 . . . . 0.0 110.221 179.218 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 59.5 tttt -66.22 -38.62 88.37 Favored 'General case' 0 N--CA 1.5 2.054 0 O-C-N 121.742 -0.599 . . . . 0.0 110.283 179.83 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 91' ' ' TRP . . . . . . . . . . . . . 78.7 m95 -150.07 33.13 0.67 Allowed 'General case' 0 N--CA 1.495 1.787 0 O-C-N 121.657 -0.652 . . . . 0.0 110.297 179.186 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 46.7 m -120.11 144.98 47.33 Favored 'General case' 0 N--CA 1.495 1.811 0 O-C-N 121.59 -0.694 . . . . 0.0 110.237 -179.671 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 93' ' ' MET . . . . . . . . . . . . . 65.9 mtt -94.86 -63.85 1.13 Allowed 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.665 -0.647 . . . . 0.0 110.21 179.66 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 74.6 m-20 . . . . . 0 N--CA 1.506 2.36 0 CA-C-O 118.356 -0.83 . . . . 0.0 110.961 -179.917 . . . . . . . . 0 0 . 1 . 012 nuclear build full ' B' B ' 240' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.298 0 N-CA-C 109.582 -1.407 . . . . 0.0 109.582 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' B' B ' 241' ' ' ALA . . . . . . . . . . . . . . . -102.07 138.81 38.53 Favored 'General case' 0 N--CA 1.495 1.799 0 O-C-N 121.701 -0.882 . . . . 0.0 110.249 -179.914 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 242' ' ' THR . . . . . . . . . . . . . 24.7 m -126.81 143.45 51.25 Favored 'General case' 0 N--CA 1.495 1.818 0 O-C-N 121.685 -0.635 . . . . 0.0 110.135 179.911 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 243' ' ' THR . . . . . . . . . . . . . 39.9 p -117.76 151.12 37.94 Favored 'General case' 0 N--CA 1.496 1.871 0 O-C-N 121.667 -0.645 . . . . 0.0 110.104 179.621 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 244' ' ' LYS . . . . . . . . . . . . . 59.6 mttm -100.77 -34.54 9.79 Favored 'General case' 0 N--CA 1.494 1.767 0 O-C-N 121.614 -0.678 . . . . 0.0 110.251 -179.73 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 245' ' ' GLU . . . . . . . . . . . . . 42.2 tt0 -102.52 128.06 49.33 Favored 'General case' 0 N--CA 1.495 1.795 0 O-C-N 121.675 -0.64 . . . . 0.0 110.195 -178.897 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 246' ' ' LYS . . . . . . . . . . . . . 81.1 mttt -110.03 -47.33 3.34 Favored 'General case' 0 N--CA 1.495 1.808 0 O-C-N 121.666 -0.646 . . . . 0.0 110.244 179.174 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 247' ' ' ASN . . . . . . . . . . . . . 17.4 t-20 -131.94 33.38 3.95 Favored 'General case' 0 N--CA 1.494 1.774 0 O-C-N 121.692 -0.63 . . . . 0.0 110.224 -179.358 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 248' ' ' ILE . . . . . 0.605 HD11 HG21 ' A' ' 74' ' ' THR . 79.7 mt 52.75 93.23 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.507 2.393 0 O-C-N 121.581 -0.699 . . . . 0.0 110.556 -179.569 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 249' ' ' SER . . . . . . . . . . . . . 89.4 p -130.1 107.11 9.07 Favored 'General case' 0 N--CA 1.495 1.793 0 O-C-N 121.638 -0.663 . . . . 0.0 110.292 179.603 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 250' ' ' VAL . . . . . . . . . . . . . 12.3 p -154.07 139.51 10.86 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.807 0 O-C-N 121.776 -0.578 . . . . 0.0 109.982 178.8 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 251' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER 51.24 -167.26 0.04 OUTLIER 'General case' 0 N--CA 1.507 2.424 0 O-C-N 121.584 -0.698 . . . . 0.0 110.773 -178.793 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 252' ' ' VAL . . . . . 0.449 HG12 ' N ' ' B' ' 253' ' ' ASP . 24.1 t 58.56 168.6 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.509 2.503 0 O-C-N 121.614 -0.679 . . . . 0.0 110.404 179.14 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 253' ' ' ASP . . . . . 0.449 ' N ' HG12 ' B' ' 252' ' ' VAL . 4.3 m-20 54.73 57.77 5.42 Favored 'General case' 0 N--CA 1.507 2.384 0 O-C-N 121.333 -0.855 . . . . 0.0 110.779 179.249 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 254' ' ' ALA . . . . . . . . . . . . . . . -65.56 -18.47 65.35 Favored 'General case' 0 N--CA 1.501 2.09 0 O-C-N 121.49 -0.756 . . . . 0.0 110.885 178.467 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 255' ' ' ASP . . . . . . . . . . . . . 26.1 t0 -70.45 -26.0 63.45 Favored 'General case' 0 N--CA 1.499 1.989 0 O-C-N 121.41 -0.806 . . . . 0.0 110.463 179.335 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 256' ' ' ALA . . . . . . . . . . . . . . . -61.96 -30.5 70.96 Favored 'General case' 0 N--CA 1.502 2.14 0 O-C-N 121.413 -0.805 . . . . 0.0 110.432 178.951 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 257' ' ' SER . . . . . 0.463 ' HA ' HD12 ' B' ' 260' ' ' LEU . 58.4 m -54.75 -35.0 63.27 Favored 'General case' 0 N--CA 1.502 2.173 0 O-C-N 121.538 -0.726 . . . . 0.0 110.465 176.641 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 258' ' ' SER . . . . . . . . . . . . . 25.4 m -67.75 -33.19 74.36 Favored 'General case' 0 N--CA 1.498 1.936 0 O-C-N 121.827 -0.545 . . . . 0.0 110.204 -179.684 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 259' ' ' GLN . . . . . . . . . . . . . 98.4 mt-30 -64.76 -33.51 76.15 Favored 'General case' 0 N--CA 1.5 2.05 0 O-C-N 121.632 -0.668 . . . . 0.0 110.323 178.883 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 260' ' ' LEU . . . . . 0.51 ' HA ' HD12 ' B' ' 263' ' ' LEU . 82.2 mt -65.38 -40.05 93.01 Favored 'General case' 0 N--CA 1.5 2.071 0 O-C-N 121.636 -0.665 . . . . 0.0 110.181 178.808 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 261' ' ' LEU . . . . . . . . . . . . . 25.5 tp -69.15 -39.93 78.5 Favored 'General case' 0 N--CA 1.499 2.015 0 O-C-N 121.671 -0.643 . . . . 0.0 109.862 176.634 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 262' ' ' SER . . . . . . . . . . . . . 22.7 m -62.55 -37.14 84.98 Favored 'General case' 0 N--CA 1.502 2.136 0 O-C-N 121.74 -0.6 . . . . 0.0 110.493 177.853 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 263' ' ' LEU . . . . . 0.51 HD12 ' HA ' ' B' ' 260' ' ' LEU . 30.2 mt -64.4 -40.77 96.45 Favored 'General case' 0 N--CA 1.501 2.085 0 O-C-N 121.649 -0.657 . . . . 0.0 110.315 179.46 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 264' ' ' LEU . . . . . 0.4 ' CD1' HD11 ' A' ' 55' ' ' LEU . 84.6 mt -62.79 -39.01 92.94 Favored 'General case' 0 N--CA 1.5 2.063 0 O-C-N 121.627 -0.67 . . . . 0.0 110.466 178.874 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 265' ' ' LYS . . . . . . . . . . . . . 73.6 mttt -76.68 -38.86 53.72 Favored 'General case' 0 N--CA 1.498 1.942 0 O-C-N 121.746 -0.596 . . . . 0.0 110.163 -179.753 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 266' ' ' SER . . . . . . . . . . . . . 1.6 m 55.93 -81.78 0.01 OUTLIER 'General case' 0 N--CA 1.506 2.347 0 O-C-N 121.843 -0.536 . . . . 0.0 111.211 -177.151 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 267' ' ' SER . . . . . . . . . . . . . 49.6 m -113.7 157.79 21.74 Favored 'General case' 0 N--CA 1.494 1.774 0 O-C-N 121.237 -0.915 . . . . 0.0 110.167 -179.79 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 268' ' ' THR . . . . . 0.479 HG22 ' O ' ' B' ' 268' ' ' THR . 19.5 m -98.5 29.7 3.54 Favored 'General case' 0 N--CA 1.497 1.909 0 O-C-N 121.726 -0.609 . . . . 0.0 110.558 -179.455 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 269' ' ' ALA . . . . . . . . . . . . . . . 48.46 58.44 17.73 Favored Pre-proline 0 N--CA 1.505 2.319 0 O-C-N 121.593 -0.692 . . . . 0.0 111.364 -179.101 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 270' ' ' PRO . . . . . 0.475 ' O ' ' HB2' ' B' ' 274' ' ' ALA . 26.7 Cg_endo -66.72 -33.79 33.79 Favored 'Trans proline' 0 N--CA 1.488 1.204 0 O-C-N 123.402 1.211 . . . . 0.0 110.373 178.472 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 271' ' ' SER . . . . . . . . . . . . . 87.8 p -70.2 -29.14 65.92 Favored 'General case' 0 N--CA 1.498 1.97 0 O-C-N 121.691 -0.631 . . . . 0.0 110.547 178.803 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 272' ' ' ASP . . . . . . . . . . . . . 20.5 t70 -80.89 122.71 27.56 Favored 'General case' 0 N--CA 1.497 1.915 0 O-C-N 121.586 -0.696 . . . . 0.0 110.286 -178.633 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 273' ' ' LEU . . . . . . . . . . . . . 84.4 mt 56.69 -84.32 0.02 OUTLIER 'General case' 0 N--CA 1.505 2.304 0 O-C-N 121.955 -0.466 . . . . 0.0 111.269 179.774 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 274' ' ' ALA . . . . . 0.475 ' HB2' ' O ' ' B' ' 270' ' ' PRO . . . 49.89 93.77 0.01 OUTLIER 'General case' 0 N--CA 1.506 2.362 0 O-C-N 121.165 -0.959 . . . . 0.0 111.201 -177.006 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 275' ' ' THR . . . . . . . . . . . . . 7.6 t -112.54 154.33 44.67 Favored Pre-proline 0 N--CA 1.498 1.967 0 O-C-N 121.578 -0.701 . . . . 0.0 110.241 -179.572 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 276' ' ' PRO . . . . . . . . . . . . . 22.7 Cg_exo -61.1 138.17 76.33 Favored 'Trans proline' 0 N--CA 1.491 1.329 0 O-C-N 123.458 1.241 . . . . 0.0 110.703 179.736 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 277' ' ' GLN . . . . . . . . . . . . . 28.6 tt0 -133.19 89.64 32.63 Favored Pre-proline 0 N--CA 1.496 1.829 0 O-C-N 121.693 -0.629 . . . . 0.0 110.124 179.72 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 278' ' ' PRO . . . . . . . . . . . . . 22.7 Cg_endo -65.64 144.79 79.77 Favored 'Trans proline' 0 N--CA 1.489 1.235 0 O-C-N 123.56 1.295 . . . . 0.0 110.494 -179.933 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 279' ' ' SER . . . . . . . . . . . . . 95.7 p -132.95 160.61 36.59 Favored 'General case' 0 N--CA 1.495 1.791 0 O-C-N 121.737 -0.602 . . . . 0.0 110.235 -179.361 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 280' ' ' THR . . . . . . . . . . . . . 40.9 p -94.76 165.59 12.41 Favored 'General case' 0 N--CA 1.496 1.858 0 O-C-N 121.698 -0.626 . . . . 0.0 110.208 -179.936 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 281' ' ' PHE . . . . . . . . . . . . . 30.1 m-85 -119.09 89.75 39.98 Favored Pre-proline 0 N--CA 1.496 1.841 0 O-C-N 121.682 -0.636 . . . . 0.0 110.117 -179.681 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 282' ' ' PRO . . . . . . . . . . . . . 21.2 Cg_endo -65.3 -31.15 53.44 Favored 'Trans proline' 0 N--CA 1.49 1.318 0 O-C-N 123.525 1.276 . . . . 0.0 110.574 179.964 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 283' ' ' GLN . . . . . . . . . . . . . 37.3 mt-30 -95.24 156.46 37.72 Favored Pre-proline 0 N--CA 1.496 1.826 0 O-C-N 121.598 -0.689 . . . . 0.0 110.13 179.236 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 284' ' ' PRO . . . . . . . . . . . . . 30.1 Cg_endo -68.19 152.32 76.2 Favored 'Trans proline' 0 N--CA 1.487 1.099 0 O-C-N 123.555 1.292 . . . . 0.0 110.264 -179.868 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 285' ' ' PRO . . . . . . . . . . . . . 30.1 Cg_endo -68.06 132.55 26.5 Favored 'Trans proline' 0 N--CA 1.488 1.182 0 O-C-N 123.591 1.311 . . . . 0.0 110.28 -179.559 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 286' ' ' VAL . . . . . . . . . . . . . 26.9 m -134.35 149.12 29.74 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.032 0 O-C-N 121.639 -0.663 . . . . 0.0 110.208 179.321 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 287' ' ' GLU . . . . . . . . . . . . . 74.7 mm-40 -68.61 -34.99 76.71 Favored 'General case' 0 N--CA 1.499 2.019 0 O-C-N 121.706 -0.621 . . . . 0.0 110.179 179.408 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 288' ' ' SER . . . . . . . . . . . . . 10.4 m 52.91 -178.77 0.02 OUTLIER 'General case' 0 N--CA 1.506 2.357 0 O-C-N 121.671 -0.643 . . . . 0.0 111.158 -179.906 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 289' ' ' HIS . . . . . . . . . . . . . 57.0 t-80 -141.2 138.58 33.44 Favored 'General case' 0 N--CA 1.495 1.793 0 O-C-N 121.597 -0.689 . . . . 0.0 110.138 179.436 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 290' ' ' SER . . . . . . . . . . . . . 91.9 p -123.38 154.4 39.02 Favored 'General case' 0 N--CA 1.495 1.821 0 O-C-N 121.658 -0.651 . . . . 0.0 110.194 179.87 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 291' ' ' SER . . . . . . . . . . . . . 17.2 m . . . . . 0 N--CA 1.496 1.83 0 CA-C-O 117.941 -1.028 . . . . 0.0 110.206 179.827 . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' -1' ' ' MET . . . . . . . . . . . . . 61.4 mtt . . . . . 0 N--CA 1.493 1.704 0 CA-C-O 121.012 0.435 . . . . 0.0 110.148 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 0' ' ' GLY . . . . . . . . . . . . . . . -159.8 119.82 0.92 Allowed Glycine 0 N--CA 1.493 2.474 0 N-CA-C 109.542 -1.423 . . . . 0.0 109.542 179.699 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 6.3 mmm -128.93 163.08 26.07 Favored 'General case' 0 N--CA 1.495 1.818 0 O-C-N 121.64 -0.918 . . . . 0.0 110.166 -179.703 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 70.4 m -100.9 166.28 10.92 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.606 -0.684 . . . . 0.0 110.179 -179.828 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 3' ' ' VAL . . . . . 0.443 HG12 ' CE1' ' A' ' 7' ' ' TYR . 63.2 t -66.35 -27.85 41.75 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.093 0 O-C-N 121.644 -0.66 . . . . 0.0 110.188 -179.467 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -55.06 -30.98 60.75 Favored 'General case' 0 N--CA 1.505 2.275 0 O-C-N 121.394 -0.816 . . . . 0.0 110.439 -179.214 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 74.3 m-20 -68.57 -30.8 69.65 Favored 'General case' 0 N--CA 1.499 1.996 0 O-C-N 121.81 -0.556 . . . . 0.0 110.226 174.776 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 96.7 m-85 -95.8 10.15 38.06 Favored 'General case' 0 N--CA 1.496 1.859 0 O-C-N 121.574 -0.704 . . . . 0.0 111.524 -178.589 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 7' ' ' TYR . . . . . 0.443 ' CE1' HG12 ' A' ' 3' ' ' VAL . 4.0 m-30 -67.34 139.43 57.22 Favored 'General case' 0 N--CA 1.504 2.228 0 O-C-N 121.211 -0.931 . . . . 0.0 109.964 174.123 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 82.06 3.14 90.67 Favored Glycine 0 N--CA 1.497 2.727 0 N-CA-C 110.56 -1.016 . . . . 0.0 110.56 -176.595 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 73.9 m -78.12 135.74 37.74 Favored 'General case' 0 N--CA 1.498 1.929 0 O-C-N 121.114 -1.227 . . . . 0.0 110.524 175.943 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 14.0 t-20 -83.92 117.43 23.34 Favored 'General case' 0 N--CA 1.497 1.91 0 O-C-N 121.6 -0.687 . . . . 0.0 109.588 172.169 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 11' ' ' VAL . . . . . 0.546 HG12 ' HA ' ' A' ' 57' ' ' ILE . 35.4 m -142.29 164.39 17.9 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.691 0 N-CA-C 109.319 -0.622 . . . . 0.0 109.319 -179.275 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 12' ' ' GLU . . . . . 0.438 ' HB2' HD21 ' A' ' 58' ' ' LEU . 44.8 tt0 -109.36 129.04 55.54 Favored 'General case' 0 N--CA 1.492 1.666 0 C-N-CA 119.739 -0.785 . . . . 0.0 109.914 177.453 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 13' ' ' VAL . . . . . 0.551 HG22 ' CD2' ' A' ' 55' ' ' LEU . 58.3 t -106.74 125.14 62.69 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.697 0 O-C-N 121.575 -0.703 . . . . 0.0 109.873 -179.566 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 30.2 tp -95.85 128.43 42.72 Favored 'General case' 0 N--CA 1.494 1.728 0 N-CA-C 109.272 -0.64 . . . . 0.0 109.272 175.124 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 84.8 mt -98.28 166.31 11.45 Favored 'General case' 0 N--CA 1.496 1.846 0 O-C-N 121.683 -0.636 . . . . 0.0 111.047 -173.304 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 24.3 p30 -58.86 -21.66 57.55 Favored 'General case' 0 N--CA 1.504 2.271 0 O-C-N 121.769 -0.582 . . . . 0.0 111.64 -176.833 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 43.5 p-10 -92.64 23.4 4.09 Favored 'General case' 0 N--CA 1.498 1.953 0 O-C-N 121.547 -0.72 . . . . 0.0 110.905 -175.725 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 74.3 m-20 58.5 27.1 15.12 Favored 'General case' 0 N--CA 1.506 2.339 0 O-C-N 121.406 -0.809 . . . . 0.0 110.65 176.306 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 51.1 m -106.51 145.85 31.32 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.587 -0.696 . . . . 0.0 109.55 172.531 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 49.7 mttp -109.7 150.26 28.55 Favored 'General case' 0 N--CA 1.494 1.759 0 O-C-N 121.625 -0.672 . . . . 0.0 110.573 -175.531 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -152.97 150.37 29.16 Favored 'General case' 0 N--CA 1.496 1.861 0 O-C-N 121.682 -0.636 . . . . 0.0 110.111 176.05 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 22' ' ' ARG . . . . . 0.515 ' O ' HD13 ' A' ' 39' ' ' LEU . 5.8 ptm180 -144.06 140.26 29.4 Favored 'General case' 0 N--CA 1.498 1.934 0 O-C-N 121.614 -0.679 . . . . 0.0 110.509 179.407 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -171.8 171.4 44.09 Favored Glycine 0 N--CA 1.496 2.678 0 N-CA-C 109.085 -1.606 . . . . 0.0 109.085 -176.051 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 60.4 t -94.59 121.57 45.31 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.91 0 O-C-N 121.511 -0.993 . . . . 0.0 109.357 -177.338 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 25' ' ' ILE . . . . . 0.665 ' HA ' HD23 ' A' ' 37' ' ' LEU . 91.9 mt -65.09 144.04 15.19 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.066 0 O-C-N 121.636 -0.665 . . . . 0.0 110.65 -171.332 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 26' ' ' THR . . . . . 0.611 HG21 ' HB2' ' A' ' 38' ' ' ARG . 7.0 p -121.23 -27.56 4.86 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.78 -0.575 . . . . 0.0 111.133 178.807 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 27' ' ' ASN . . . . . 0.5 ' O ' HD12 ' A' ' 35' ' ' LEU . 8.0 t30 -161.56 160.94 29.59 Favored 'General case' 0 N--CA 1.5 2.044 0 C-N-CA 118.985 -1.086 . . . . 0.0 111.904 -178.547 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 28' ' ' PHE . . . . . 0.577 ' HE1' HG21 ' A' ' 49' ' ' THR . 84.5 t80 -150.15 125.09 9.9 Favored 'General case' 0 N--CA 1.498 1.934 0 N-CA-C 108.87 -0.789 . . . . 0.0 108.87 170.366 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 18.0 t70 -99.44 130.31 45.69 Favored 'General case' 0 N--CA 1.491 1.591 0 N-CA-C 108.986 -0.746 . . . . 0.0 108.986 -176.449 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 20.1 m -69.75 -50.88 39.11 Favored 'General case' 0 N--CA 1.498 1.935 0 C-N-CA 120.004 -0.678 . . . . 0.0 110.449 -177.142 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 23.2 m -59.88 -41.95 92.71 Favored 'General case' 0 N--CA 1.501 2.104 0 O-C-N 121.597 -0.689 . . . . 0.0 110.781 -174.771 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 29.7 m120 -103.93 -10.13 18.38 Favored 'General case' 0 N--CA 1.497 1.915 0 O-C-N 121.676 -0.64 . . . . 0.0 111.644 -177.766 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 1.8 m 49.94 67.31 0.93 Allowed 'General case' 0 N--CA 1.508 2.442 0 O-C-N 121.046 -1.034 . . . . 0.0 111.037 -175.003 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 34' ' ' ILE . . . . . 1.107 HD12 HG22 ' A' ' 48' ' ' VAL . 47.7 mm -126.26 127.39 70.66 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.089 0 O-C-N 121.51 -0.744 . . . . 0.0 109.46 -175.864 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.5 HD12 ' O ' ' A' ' 27' ' ' ASN . 11.2 tp -115.89 120.59 39.7 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.742 -0.599 . . . . 0.0 110.511 -170.832 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 58.6 mt-30 -91.55 134.59 34.53 Favored 'General case' 0 N--CA 1.492 1.65 0 N-CA-C 109.481 -0.563 . . . . 0.0 109.481 174.639 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 0.665 HD23 ' HA ' ' A' ' 25' ' ' ILE . 89.4 mt -117.87 123.94 47.11 Favored 'General case' 0 N--CA 1.497 1.895 0 C-N-CA 120.406 -0.518 . . . . 0.0 109.929 174.641 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 38' ' ' ARG . . . . . 0.611 ' HB2' HG21 ' A' ' 26' ' ' THR . 57.7 ttt85 -96.34 107.21 19.54 Favored 'General case' 0 N--CA 1.497 1.914 0 O-C-N 121.596 -0.69 . . . . 0.0 109.736 175.79 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.515 HD13 ' O ' ' A' ' 22' ' ' ARG . 18.4 tp -85.36 153.58 22.44 Favored 'General case' 0 N--CA 1.495 1.811 0 O-C-N 121.693 -0.629 . . . . 0.0 111.085 -173.65 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -62.99 -9.76 11.24 Favored 'General case' 0 N--CA 1.503 2.186 0 O-C-N 122.031 -0.418 . . . . 0.0 112.045 -170.475 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 53.6 p-10 -85.12 28.94 0.68 Allowed 'General case' 0 N--CA 1.499 2.011 0 O-C-N 121.024 -1.048 . . . . 0.0 111.049 175.064 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 74.4 m-20 57.95 29.59 17.88 Favored 'General case' 0 N--CA 1.504 2.252 0 O-C-N 121.112 -0.992 . . . . 0.0 110.404 176.619 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 28.2 m -119.71 137.9 53.63 Favored 'General case' 0 N--CA 1.496 1.852 0 O-C-N 121.518 -0.739 . . . . 0.0 110.306 178.604 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 9.8 t -97.86 150.07 21.69 Favored 'General case' 0 N--CA 1.495 1.79 0 O-C-N 121.728 -0.608 . . . . 0.0 110.327 176.608 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 19.9 mtpp -148.93 122.25 9.01 Favored 'General case' 0 N--CA 1.495 1.815 0 O-C-N 121.714 -0.616 . . . . 0.0 110.423 178.207 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 90.6 p -96.37 123.79 40.14 Favored 'General case' 0 N--CA 1.496 1.85 0 O-C-N 121.815 -0.553 . . . . 0.0 110.202 179.802 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 82.0 mt -129.28 134.23 64.18 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.858 0 O-C-N 121.673 -0.642 . . . . 0.0 109.269 179.111 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 48' ' ' VAL . . . . . 1.107 HG22 HD12 ' A' ' 34' ' ' ILE . 57.8 t -81.93 127.61 39.46 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.9 0 C-N-CA 120.036 -0.666 . . . . 0.0 109.306 179.989 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 49' ' ' THR . . . . . 0.577 HG21 ' HE1' ' A' ' 28' ' ' PHE . 39.3 p -59.91 -24.79 64.6 Favored 'General case' 0 N--CA 1.504 2.241 0 O-C-N 121.582 -0.698 . . . . 0.0 112.054 -170.415 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 32.3 ttpt -56.25 -23.29 35.12 Favored 'General case' 0 N--CA 1.503 2.214 0 O-C-N 121.43 -0.794 . . . . 0.0 111.138 -177.037 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 48.5 p30 -84.16 1.95 41.94 Favored 'General case' 0 N--CA 1.498 1.933 0 O-C-N 121.463 -0.773 . . . . 0.0 111.342 176.61 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 97.4 mt -75.55 127.84 37.09 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.145 0 O-C-N 121.154 -0.966 . . . . 0.0 110.084 178.66 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 52.3 tttm -92.6 -30.4 15.64 Favored 'General case' 0 N--CA 1.494 1.77 0 O-C-N 121.843 -0.536 . . . . 0.0 109.687 169.379 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 5.1 m-20 -163.9 158.04 19.39 Favored 'General case' 0 N--CA 1.5 2.038 0 O-C-N 121.785 -0.572 . . . . 0.0 109.994 -178.304 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 55' ' ' LEU . . . . . 0.551 ' CD2' HG22 ' A' ' 13' ' ' VAL . 83.4 mt -132.94 149.59 52.23 Favored 'General case' 0 N--CA 1.496 1.863 0 O-C-N 121.656 -0.653 . . . . 0.0 110.38 -179.201 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 20.1 ptp180 -151.51 144.84 24.76 Favored 'General case' 0 N--CA 1.497 1.895 0 O-C-N 121.705 -0.622 . . . . 0.0 110.16 175.813 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 57' ' ' ILE . . . . . 0.546 ' HA ' HG12 ' A' ' 11' ' ' VAL . 66.4 mt -86.59 133.41 29.91 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.88 0 O-C-N 121.661 -0.649 . . . . 0.0 110.042 174.221 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 58' ' ' LEU . . . . . 0.448 HD11 ' HB2' ' A' ' 22' ' ' ARG . 16.6 mt -83.45 116.97 67.19 Favored Pre-proline 0 N--CA 1.498 1.935 0 O-C-N 121.64 -0.662 . . . . 0.0 109.894 -179.092 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 26.2 Cg_endo -66.55 141.97 62.98 Favored 'Trans proline' 0 N--CA 1.488 1.186 0 O-C-N 123.286 1.15 . . . . 0.0 110.413 179.648 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 99.2 mttt -97.46 149.51 22.08 Favored 'General case' 0 N--CA 1.495 1.786 0 O-C-N 121.668 -0.645 . . . . 0.0 110.188 179.949 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 25.2 p30 -115.49 154.16 29.81 Favored 'General case' 0 N--CA 1.498 1.926 0 O-C-N 121.657 -0.652 . . . . 0.0 110.373 -179.869 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 12.5 pt-20 -161.86 40.05 0.13 Allowed 'General case' 0 N--CA 1.497 1.905 0 O-C-N 121.718 -0.614 . . . . 0.0 110.319 179.697 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 81.9 mt -111.68 136.83 46.58 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.882 0 O-C-N 121.587 -0.696 . . . . 0.0 109.705 -179.101 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 64' ' ' MET . . . . . . . . . . . . . 51.1 mtm 52.12 85.03 0.2 Allowed Pre-proline 0 N--CA 1.505 2.316 0 O-C-N 121.661 -0.65 . . . . 0.0 111.123 -179.871 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 28.4 Cg_endo -67.35 150.17 80.98 Favored 'Trans proline' 0 N--CA 1.488 1.202 0 O-C-N 123.626 1.329 . . . . 0.0 110.365 179.519 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 51.5 tttm -63.73 -35.17 79.69 Favored 'General case' 0 N--CA 1.501 2.094 0 O-C-N 121.664 -0.648 . . . . 0.0 110.4 179.941 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 23.7 p30 -79.0 173.0 13.02 Favored 'General case' 0 N--CA 1.499 1.993 0 O-C-N 121.66 -0.65 . . . . 0.0 110.315 179.97 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 123.23 -41.9 1.7 Allowed Glycine 0 N--CA 1.494 2.548 0 N-CA-C 109.544 -1.422 . . . . 0.0 109.544 -179.81 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 24.2 m -66.51 -37.25 84.65 Favored 'General case' 0 N--CA 1.5 2.063 0 O-C-N 121.703 -0.88 . . . . 0.0 110.13 179.193 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 62.4 mttm 53.4 42.61 32.0 Favored 'General case' 0 N--CA 1.506 2.336 0 O-C-N 121.607 -0.683 . . . . 0.0 110.914 179.144 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 1.8 t -77.93 158.86 77.19 Favored Pre-proline 0 N--CA 1.497 1.916 0 O-C-N 121.601 -0.687 . . . . 0.0 110.151 179.708 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 22.3 Cg_exo -61.19 139.07 81.67 Favored 'Trans proline' 0 N--CA 1.491 1.368 0 O-C-N 123.612 1.322 . . . . 0.0 110.751 -179.904 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 25.9 t -144.79 149.25 35.15 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.677 -0.64 . . . . 0.0 110.202 179.844 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 9.7 t -132.6 154.22 50.27 Favored 'General case' 0 N--CA 1.497 1.876 0 O-C-N 121.627 -0.671 . . . . 0.0 110.337 179.662 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 38.7 p-10 -126.82 31.47 5.3 Favored 'General case' 0 N--CA 1.496 1.861 0 O-C-N 121.647 -0.658 . . . . 0.0 110.565 -179.81 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 50.9 m -120.54 144.66 47.94 Favored 'General case' 0 N--CA 1.495 1.796 0 O-C-N 121.602 -0.686 . . . . 0.0 110.23 179.836 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 22.4 m -88.88 -60.9 1.83 Allowed 'General case' 0 N--CA 1.497 1.907 0 O-C-N 121.81 -0.556 . . . . 0.0 110.201 179.973 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 55.9 mttm -103.13 146.05 28.98 Favored 'General case' 0 N--CA 1.495 1.82 0 O-C-N 121.777 -0.577 . . . . 0.0 110.19 -179.644 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -100.31 -172.37 2.2 Favored 'General case' 0 N--CA 1.496 1.837 0 O-C-N 121.66 -0.65 . . . . 0.0 109.816 179.586 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 23.6 ttpp -63.05 -35.95 81.95 Favored 'General case' 0 N--CA 1.501 2.125 0 O-C-N 121.583 -0.698 . . . . 0.0 110.31 179.985 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 29.2 t -117.09 145.18 43.93 Favored 'General case' 0 N--CA 1.495 1.783 0 O-C-N 121.724 -0.61 . . . . 0.0 110.271 179.858 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -136.34 154.85 50.73 Favored 'General case' 0 N--CA 1.496 1.858 0 O-C-N 121.709 -0.619 . . . . 0.0 110.102 179.882 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 74.8 mm-40 -98.54 133.15 43.31 Favored 'General case' 0 N--CA 1.495 1.799 0 O-C-N 121.68 -0.638 . . . . 0.0 110.286 -179.303 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 23.4 m -68.89 -34.41 75.38 Favored 'General case' 0 N--CA 1.499 1.988 0 O-C-N 121.695 -0.628 . . . . 0.0 110.188 179.401 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 97.2 m-85 -66.62 158.54 29.66 Favored 'General case' 0 N--CA 1.5 2.05 0 O-C-N 121.7 -0.625 . . . . 0.0 110.326 -178.694 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 25.8 t -114.7 153.35 30.41 Favored 'General case' 0 N--CA 1.495 1.798 0 O-C-N 121.742 -0.599 . . . . 0.0 110.142 179.931 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 50.7 m -65.7 146.5 54.72 Favored 'General case' 0 N--CA 1.5 2.07 0 O-C-N 121.625 -0.672 . . . . 0.0 110.375 -179.007 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 97.5 mttt -66.58 -33.91 76.71 Favored 'General case' 0 N--CA 1.499 2.023 0 O-C-N 121.669 -0.644 . . . . 0.0 110.408 -179.343 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 35.9 t30 -98.11 107.14 19.54 Favored 'General case' 0 N--CA 1.495 1.79 0 O-C-N 121.684 -0.635 . . . . 0.0 110.306 -179.057 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 53.4 pttt -133.17 -39.31 0.94 Allowed 'General case' 0 N--CA 1.498 1.96 0 O-C-N 121.714 -0.617 . . . . 0.0 110.689 179.297 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 91' ' ' TRP . . . . . . . . . . . . . 10.8 m0 -95.06 145.94 24.62 Favored 'General case' 0 N--CA 1.495 1.776 0 O-C-N 121.466 -0.771 . . . . 0.0 110.262 178.753 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 95.9 p -138.21 160.65 38.87 Favored 'General case' 0 N--CA 1.496 1.828 0 O-C-N 121.718 -0.614 . . . . 0.0 110.145 179.476 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 93' ' ' MET . . . . . . . . . . . . . 74.5 mtm -116.41 155.27 28.82 Favored 'General case' 0 N--CA 1.496 1.848 0 O-C-N 121.657 -0.652 . . . . 0.0 110.242 -179.631 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 10.2 p-10 . . . . . 0 N--CA 1.498 1.946 0 CA-C-O 118.044 -0.979 . . . . 0.0 110.291 179.867 . . . . . . . . 0 0 . 1 . 013 nuclear build full ' B' B ' 240' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.286 0 N-CA-C 109.596 -1.402 . . . . 0.0 109.596 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' B' B ' 241' ' ' ALA . . . . . . . . . . . . . . . -143.0 153.31 42.86 Favored 'General case' 0 N--CA 1.494 1.766 0 O-C-N 121.708 -0.877 . . . . 0.0 110.269 179.959 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 242' ' ' THR . . . . . . . . . . . . . 36.8 p -110.77 31.79 5.73 Favored 'General case' 0 N--CA 1.496 1.861 0 O-C-N 121.674 -0.641 . . . . 0.0 110.344 -179.76 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 243' ' ' THR . . . . . . . . . . . . . 24.0 m -105.5 139.19 40.49 Favored 'General case' 0 N--CA 1.495 1.813 0 O-C-N 121.566 -0.709 . . . . 0.0 110.218 -179.456 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 244' ' ' LYS . . . . . . . . . . . . . 5.2 ttpm? -114.87 137.52 51.87 Favored 'General case' 0 N--CA 1.496 1.831 0 O-C-N 121.709 -0.619 . . . . 0.0 110.127 -179.893 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 245' ' ' GLU . . . . . . . . . . . . . 46.4 tt0 -130.97 70.48 1.46 Allowed 'General case' 0 N--CA 1.495 1.794 0 O-C-N 121.65 -0.656 . . . . 0.0 110.195 -179.767 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 246' ' ' LYS . . . . . . . . . . . . . 52.3 mttp 53.5 45.51 28.08 Favored 'General case' 0 N--CA 1.505 2.317 0 O-C-N 121.407 -0.808 . . . . 0.0 111.009 178.343 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 247' ' ' ASN . . . . . . . . . . . . . 36.0 t30 -62.83 -38.68 91.72 Favored 'General case' 0 N--CA 1.501 2.12 0 O-C-N 121.549 -0.719 . . . . 0.0 110.506 179.98 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 248' ' ' ILE . . . . . . . . . . . . . 82.0 mt 52.78 78.88 0.07 OUTLIER 'Isoleucine or valine' 0 N--CA 1.507 2.4 0 O-C-N 121.578 -0.701 . . . . 0.0 110.503 179.816 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 249' ' ' SER . . . . . . . . . . . . . 23.1 t -66.07 -36.19 82.54 Favored 'General case' 0 N--CA 1.5 2.046 0 O-C-N 121.536 -0.727 . . . . 0.0 110.332 179.69 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 250' ' ' VAL . . . . . . . . . . . . . 12.4 p -89.89 144.89 8.17 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.914 0 O-C-N 121.759 -0.588 . . . . 0.0 110.289 -179.903 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 251' ' ' ASP . . . . . . . . . . . . . 74.6 m-20 51.79 -174.39 0.02 OUTLIER 'General case' 0 N--CA 1.507 2.389 0 O-C-N 121.707 -0.621 . . . . 0.0 111.176 179.571 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 252' ' ' VAL . . . . . . . . . . . . . 61.5 t 52.0 84.51 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.507 2.412 0 O-C-N 121.633 -0.667 . . . . 0.0 110.603 179.975 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 253' ' ' ASP . . . . . . . . . . . . . 74.7 m-20 -81.77 111.05 17.65 Favored 'General case' 0 N--CA 1.498 1.936 0 O-C-N 121.659 -0.651 . . . . 0.0 110.191 179.659 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 254' ' ' ALA . . . . . . . . . . . . . . . -67.52 -34.03 76.29 Favored 'General case' 0 N--CA 1.498 1.971 0 O-C-N 121.643 -0.661 . . . . 0.0 110.28 179.308 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 255' ' ' ASP . . . . . . . . . . . . . 11.7 p-10 -72.64 -27.28 62.04 Favored 'General case' 0 N--CA 1.5 2.029 0 O-C-N 121.746 -0.597 . . . . 0.0 110.693 -179.887 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 256' ' ' ALA . . . . . . . . . . . . . . . -63.37 -33.9 76.55 Favored 'General case' 0 N--CA 1.501 2.111 0 O-C-N 121.437 -0.789 . . . . 0.0 110.347 179.024 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 257' ' ' SER . . . . . . . . . . . . . 59.2 m -56.62 -39.8 74.25 Favored 'General case' 0 N--CA 1.502 2.157 0 O-C-N 121.667 -0.646 . . . . 0.0 110.594 179.365 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 258' ' ' SER . . . . . . . . . . . . . 68.9 p -69.93 -31.86 69.83 Favored 'General case' 0 N--CA 1.498 1.96 0 C-N-CA 120.248 -0.581 . . . . 0.0 110.302 -178.983 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 259' ' ' GLN . . . . . . . . . . . . . 98.8 mt-30 -64.61 -37.02 86.13 Favored 'General case' 0 N--CA 1.501 2.081 0 O-C-N 121.54 -0.725 . . . . 0.0 110.39 -179.888 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 260' ' ' LEU . . . . . 0.491 ' HA ' HD12 ' B' ' 263' ' ' LEU . 47.1 mt -66.24 -42.22 88.92 Favored 'General case' 0 N--CA 1.501 2.075 0 O-C-N 121.699 -0.625 . . . . 0.0 110.199 179.637 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 261' ' ' LEU . . . . . . . . . . . . . 21.5 tp -70.57 -38.05 74.05 Favored 'General case' 0 N--CA 1.497 1.887 0 O-C-N 121.704 -0.623 . . . . 0.0 109.762 176.561 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 262' ' ' SER . . . . . . . . . . . . . 66.6 m -62.51 -36.04 81.3 Favored 'General case' 0 N--CA 1.501 2.124 0 O-C-N 121.733 -0.604 . . . . 0.0 110.444 176.724 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 263' ' ' LEU . . . . . 0.491 HD12 ' HA ' ' B' ' 260' ' ' LEU . 22.5 mt -64.59 -41.17 96.42 Favored 'General case' 0 N--CA 1.501 2.098 0 O-C-N 121.669 -0.644 . . . . 0.0 110.241 179.803 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 264' ' ' LEU . . . . . 0.418 ' CD1' HD11 ' A' ' 55' ' ' LEU . 85.3 mt -62.28 -37.73 86.62 Favored 'General case' 0 N--CA 1.503 2.182 0 O-C-N 121.667 -0.646 . . . . 0.0 110.353 177.317 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 265' ' ' LYS . . . . . . . . . . . . . 49.0 tttm -76.42 -35.81 58.34 Favored 'General case' 0 N--CA 1.497 1.912 0 O-C-N 121.769 -0.582 . . . . 0.0 110.098 178.903 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 266' ' ' SER . . . . . . . . . . . . . 3.5 m -163.31 113.28 1.34 Allowed 'General case' 0 N--CA 1.495 1.797 0 O-C-N 121.628 -0.67 . . . . 0.0 110.167 -179.757 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 267' ' ' SER . . . . . . . . . . . . . 34.2 m -79.53 -32.62 42.27 Favored 'General case' 0 N--CA 1.498 1.943 0 O-C-N 121.671 -0.643 . . . . 0.0 110.498 -178.965 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 268' ' ' THR . . . . . . . . . . . . . 39.7 p -108.72 167.63 9.93 Favored 'General case' 0 N--CA 1.495 1.815 0 O-C-N 121.574 -0.704 . . . . 0.0 110.41 -177.436 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 269' ' ' ALA . . . . . 0.435 ' HB1' ' HD2' ' B' ' 270' ' ' PRO . . . 54.93 172.86 0.04 OUTLIER Pre-proline 0 N--CA 1.507 2.405 0 O-C-N 121.707 -0.621 . . . . 0.0 111.312 -178.67 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 270' ' ' PRO . . . . . 0.435 ' HD2' ' HB1' ' B' ' 269' ' ' ALA . 16.2 Cg_exo -64.83 179.59 1.32 Allowed 'Trans proline' 0 N--CA 1.489 1.246 0 O-C-N 123.505 1.266 . . . . 0.0 110.451 179.5 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 271' ' ' SER . . . . . . . . . . . . . 50.2 m -109.83 149.2 30.19 Favored 'General case' 0 N--CA 1.496 1.826 0 O-C-N 121.758 -0.589 . . . . 0.0 110.204 179.914 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 272' ' ' ASP . . . . . . . . . . . . . 74.6 m-20 -90.38 172.26 8.87 Favored 'General case' 0 N--CA 1.496 1.862 0 O-C-N 121.69 -0.632 . . . . 0.0 110.241 -179.249 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 273' ' ' LEU . . . . . 0.428 HD13 ' HA ' ' B' ' 273' ' ' LEU . 4.6 mm? 52.33 91.06 0.02 OUTLIER 'General case' 0 N--CA 1.507 2.378 0 O-C-N 121.638 -0.664 . . . . 0.0 110.887 -179.505 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 274' ' ' ALA . . . . . . . . . . . . . . . -166.26 155.62 11.53 Favored 'General case' 0 N--CA 1.498 1.937 0 O-C-N 121.751 -0.593 . . . . 0.0 109.957 179.77 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 275' ' ' THR . . . . . . . . . . . . . 26.5 p -89.48 153.11 48.1 Favored Pre-proline 0 N--CA 1.495 1.823 0 O-C-N 121.65 -0.656 . . . . 0.0 110.131 179.806 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 276' ' ' PRO . . . . . . . . . . . . . 31.5 Cg_endo -68.8 129.54 18.84 Favored 'Trans proline' 0 N--CA 1.487 1.143 0 O-C-N 123.608 1.32 . . . . 0.0 110.348 -179.572 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 277' ' ' GLN . . . . . . . . . . . . . 7.1 tt0 -160.71 150.58 14.45 Favored Pre-proline 0 N--CA 1.494 1.745 0 O-C-N 121.746 -0.596 . . . . 0.0 110.117 178.757 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 278' ' ' PRO . . . . . . . . . . . . . 17.4 Cg_exo -62.89 133.16 40.25 Favored 'Trans proline' 0 N--CA 1.491 1.331 0 O-C-N 123.452 1.238 . . . . 0.0 110.506 178.632 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 279' ' ' SER . . . . . . . . . . . . . 66.9 p -99.36 -62.58 1.22 Allowed 'General case' 0 N--CA 1.495 1.818 0 O-C-N 121.67 -0.644 . . . . 0.0 110.217 179.655 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 280' ' ' THR . . . . . . . . . . . . . 25.6 m -129.46 138.91 51.68 Favored 'General case' 0 N--CA 1.494 1.77 0 O-C-N 121.654 -0.654 . . . . 0.0 110.134 179.249 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 281' ' ' PHE . . . . . . . . . . . . . 29.9 m-85 51.94 91.44 0.07 OUTLIER Pre-proline 0 N--CA 1.506 2.35 0 O-C-N 121.65 -0.656 . . . . 0.0 111.001 179.966 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 282' ' ' PRO . . . . . . . . . . . . . 19.6 Cg_endo -64.71 -32.06 57.7 Favored 'Trans proline' 0 N--CA 1.49 1.27 0 O-C-N 123.443 1.233 . . . . 0.0 110.506 179.961 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 283' ' ' GLN . . . . . . . . . . . . . 24.2 mt-30 -139.38 154.51 71.84 Favored Pre-proline 0 N--CA 1.495 1.78 0 O-C-N 121.565 -0.709 . . . . 0.0 110.126 178.531 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 284' ' ' PRO . . . . . . . . . . . . . 30.4 Cg_endo -68.49 112.81 2.94 Favored 'Trans proline' 0 N--CA 1.489 1.24 0 O-C-N 123.651 1.342 . . . . 0.0 110.297 -179.619 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 285' ' ' PRO . . . . . . . . . . . . . 33.1 Cg_endo -68.79 -33.82 19.87 Favored 'Trans proline' 0 N--CA 1.489 1.257 0 O-C-N 123.389 1.205 . . . . 0.0 110.363 179.234 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 286' ' ' VAL . . . . . . . . . . . . . 57.5 t -69.93 -37.36 72.62 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.046 0 O-C-N 121.664 -0.647 . . . . 0.0 109.78 -179.002 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 287' ' ' GLU . . . . . . . . . . . . . 46.3 tt0 -65.97 -38.54 88.84 Favored 'General case' 0 N--CA 1.501 2.108 0 O-C-N 121.689 -0.632 . . . . 0.0 110.43 -178.283 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 288' ' ' SER . . . . . . . . . . . . . 29.6 t -132.27 136.03 46.66 Favored 'General case' 0 N--CA 1.496 1.828 0 O-C-N 121.606 -0.684 . . . . 0.0 110.299 -179.623 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 289' ' ' HIS . . . . . . . . . . . . . 48.9 p-80 -128.53 150.24 50.26 Favored 'General case' 0 N--CA 1.496 1.835 0 O-C-N 121.711 -0.618 . . . . 0.0 110.244 179.856 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 290' ' ' SER . . . . . . . . . . . . . 47.5 m -119.57 147.43 44.49 Favored 'General case' 0 N--CA 1.495 1.817 0 O-C-N 121.687 -0.633 . . . . 0.0 110.172 -179.953 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 291' ' ' SER . . . . . . . . . . . . . 2.7 t . . . . . 0 N--CA 1.494 1.764 0 CA-C-O 118.051 -0.976 . . . . 0.0 110.237 -179.955 . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' -1' ' ' MET . . . . . . . . . . . . . 69.8 mmm . . . . . 0 N--CA 1.492 1.666 0 CA-C-O 120.993 0.425 . . . . 0.0 110.135 . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 0' ' ' GLY . . . . . . . . . . . . . . . 76.65 38.08 33.12 Favored Glycine 0 N--CA 1.495 2.58 0 N-CA-C 109.516 -1.434 . . . . 0.0 109.516 -179.821 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 65.1 mtt 52.2 84.55 0.05 OUTLIER 'General case' 0 N--CA 1.505 2.287 0 O-C-N 121.568 -0.96 . . . . 0.0 110.963 -179.319 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 75.5 m -100.99 -179.1 3.95 Favored 'General case' 0 N--CA 1.494 1.758 0 O-C-N 121.704 -0.622 . . . . 0.0 110.222 -179.681 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 58.1 t -65.78 -27.98 42.79 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.176 0 O-C-N 121.721 -0.612 . . . . 0.0 110.326 -179.146 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -55.63 -32.45 63.17 Favored 'General case' 0 N--CA 1.504 2.24 0 O-C-N 121.427 -0.796 . . . . 0.0 110.424 -178.319 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -68.7 -34.4 75.58 Favored 'General case' 0 N--CA 1.498 1.937 0 C-N-CA 120.389 -0.524 . . . . 0.0 109.971 174.79 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 6' ' ' PHE . . . . . 0.447 ' CE2' HD11 ' B' ' 260' ' ' LEU . 96.2 m-85 -97.37 10.21 40.25 Favored 'General case' 0 N--CA 1.498 1.958 0 O-C-N 121.767 -0.583 . . . . 0.0 111.166 178.798 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -67.43 128.88 38.06 Favored 'General case' 0 N--CA 1.5 2.071 0 O-C-N 121.247 -0.908 . . . . 0.0 110.006 -179.832 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 8' ' ' GLY . . . . . 0.466 ' O ' HG13 ' A' ' 24' ' ' VAL . . . 82.77 -0.82 89.23 Favored Glycine 0 N--CA 1.497 2.723 0 N-CA-C 110.839 -0.904 . . . . 0.0 110.839 -176.463 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 57.7 p -76.37 138.7 40.59 Favored 'General case' 0 N--CA 1.497 1.918 0 O-C-N 121.07 -1.253 . . . . 0.0 110.335 177.171 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 11.3 t-20 -84.55 119.17 24.87 Favored 'General case' 0 N--CA 1.496 1.844 0 O-C-N 121.666 -0.646 . . . . 0.0 109.784 174.154 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 11' ' ' VAL . . . . . 0.529 HG12 ' HA ' ' A' ' 57' ' ' ILE . 35.1 m -141.75 163.99 19.38 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.717 0 O-C-N 121.737 -0.602 . . . . 0.0 109.427 -179.41 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 37.7 tt0 -109.37 130.15 55.51 Favored 'General case' 0 N--CA 1.492 1.649 0 C-N-CA 119.855 -0.738 . . . . 0.0 109.996 177.574 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 13' ' ' VAL . . . . . 0.534 HG22 ' CD2' ' A' ' 55' ' ' LEU . 58.4 t -106.78 127.35 62.39 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.692 0 O-C-N 121.551 -0.718 . . . . 0.0 109.827 -179.799 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 29.4 tp -95.81 125.85 40.66 Favored 'General case' 0 N--CA 1.494 1.769 0 N-CA-C 109.102 -0.703 . . . . 0.0 109.102 174.344 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 85.0 mt -97.07 166.79 11.42 Favored 'General case' 0 N--CA 1.495 1.792 0 O-C-N 121.624 -0.672 . . . . 0.0 111.293 -171.968 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 24.4 p30 -58.0 -21.49 45.08 Favored 'General case' 0 N--CA 1.507 2.382 0 O-C-N 121.83 -0.544 . . . . 0.0 111.569 -177.296 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 43.5 p-10 -93.54 27.1 2.74 Favored 'General case' 0 N--CA 1.497 1.887 0 O-C-N 121.537 -0.727 . . . . 0.0 110.539 -178.135 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 1.1 p30 53.08 27.28 5.6 Favored 'General case' 0 N--CA 1.506 2.345 0 CA-C-O 121.173 0.511 . . . . 0.0 111.042 172.249 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 51.1 m -107.62 147.33 30.79 Favored 'General case' 0 N--CA 1.491 1.585 0 N-CA-C 109.149 -0.685 . . . . 0.0 109.149 171.026 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 49.6 mttp -109.62 147.81 32.4 Favored 'General case' 0 N--CA 1.495 1.784 0 O-C-N 121.595 -0.691 . . . . 0.0 110.62 -174.744 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -153.02 156.61 39.13 Favored 'General case' 0 N--CA 1.496 1.826 0 O-C-N 121.742 -0.599 . . . . 0.0 110.129 176.18 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 22' ' ' ARG . . . . . 0.406 ' O ' HD22 ' A' ' 39' ' ' LEU . 30.8 ptt180 -144.07 152.84 41.52 Favored 'General case' 0 N--CA 1.496 1.838 0 O-C-N 121.679 -0.638 . . . . 0.0 110.416 178.464 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 23' ' ' GLY . . . . . 0.451 ' HA2' HD13 ' A' ' 39' ' ' LEU . . . -171.9 171.07 43.93 Favored Glycine 0 N--CA 1.493 2.453 0 N-CA-C 109.184 -1.566 . . . . 0.0 109.184 179.597 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 24' ' ' VAL . . . . . 0.466 HG13 ' O ' ' A' ' 8' ' ' GLY . 45.4 t -94.57 126.31 47.02 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.925 0 O-C-N 121.643 -0.916 . . . . 0.0 109.178 175.498 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 25' ' ' ILE . . . . . 0.475 ' HA ' HD23 ' A' ' 37' ' ' LEU . 52.7 mt -62.86 138.36 22.97 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.147 0 O-C-N 121.589 -0.694 . . . . 0.0 111.012 -170.806 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 26' ' ' THR . . . . . 0.622 HG21 ' HG3' ' A' ' 38' ' ' ARG . 18.1 p -121.25 -19.09 7.19 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.861 -0.524 . . . . 0.0 111.563 179.501 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 27' ' ' ASN . . . . . 0.445 ' O ' HD12 ' A' ' 35' ' ' LEU . 2.2 t-20 -165.26 157.94 15.87 Favored 'General case' 0 N--CA 1.504 2.263 0 O-C-N 120.949 -1.095 . . . . 0.0 111.732 175.329 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 28' ' ' PHE . . . . . 0.435 ' HE1' HG21 ' A' ' 49' ' ' THR . 64.3 t80 -150.29 121.11 7.58 Favored 'General case' 0 N--CA 1.495 1.79 0 N-CA-C 109.246 -0.65 . . . . 0.0 109.246 173.683 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 17.8 t70 -98.28 130.42 44.98 Favored 'General case' 0 N--CA 1.492 1.645 0 N-CA-C 109.114 -0.699 . . . . 0.0 109.114 -176.708 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 23.2 t -70.22 -52.32 24.07 Favored 'General case' 0 N--CA 1.497 1.91 0 C-N-CA 119.977 -0.689 . . . . 0.0 110.618 -176.653 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 22.5 m -60.42 -40.69 91.91 Favored 'General case' 0 N--CA 1.502 2.171 0 O-C-N 121.654 -0.654 . . . . 0.0 110.798 -174.993 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 29.8 m120 -104.0 -10.09 18.35 Favored 'General case' 0 N--CA 1.497 1.914 0 O-C-N 121.578 -0.701 . . . . 0.0 111.601 -177.266 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 7.7 m 49.54 67.22 0.93 Allowed 'General case' 0 N--CA 1.508 2.441 0 O-C-N 121.114 -0.991 . . . . 0.0 110.886 -174.606 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 34' ' ' ILE . . . . . 1.028 HD12 HG22 ' A' ' 48' ' ' VAL . 44.7 mm -121.41 125.9 74.23 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.001 0 O-C-N 121.603 -0.686 . . . . 0.0 109.329 -175.886 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.445 HD12 ' O ' ' A' ' 27' ' ' ASN . 15.8 tp -116.19 118.91 34.12 Favored 'General case' 0 N--CA 1.494 1.743 0 O-C-N 121.617 -0.677 . . . . 0.0 110.537 -171.088 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 92.1 mt-30 -91.35 131.24 36.97 Favored 'General case' 0 N--CA 1.491 1.624 0 N-CA-C 109.391 -0.596 . . . . 0.0 109.391 171.299 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 0.475 HD23 ' HA ' ' A' ' 25' ' ' ILE . 44.6 mt -117.81 123.54 46.2 Favored 'General case' 0 N--CA 1.494 1.764 0 O-C-N 121.752 -0.592 . . . . 0.0 110.15 176.41 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 38' ' ' ARG . . . . . 0.622 ' HG3' HG21 ' A' ' 26' ' ' THR . 66.0 mtt-85 -103.18 106.59 17.14 Favored 'General case' 0 N--CA 1.498 1.942 0 O-C-N 121.688 -0.632 . . . . 0.0 110.246 171.583 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.451 HD13 ' HA2' ' A' ' 23' ' ' GLY . 56.9 tp -83.53 151.76 25.24 Favored 'General case' 0 N--CA 1.497 1.925 0 O-C-N 121.527 -0.733 . . . . 0.0 110.488 -178.256 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -68.69 -2.95 10.37 Favored 'General case' 0 N--CA 1.503 2.202 0 O-C-N 121.722 -0.611 . . . . 0.0 112.172 -170.641 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 91.4 m-20 -87.89 28.83 0.98 Allowed 'General case' 0 N--CA 1.498 1.938 0 O-C-N 121.033 -1.042 . . . . 0.0 110.74 174.769 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 6.3 t70 64.99 28.8 12.46 Favored 'General case' 0 N--CA 1.506 2.326 0 O-C-N 121.205 -0.934 . . . . 0.0 110.397 175.771 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 67.2 m -123.97 139.72 53.67 Favored 'General case' 0 N--CA 1.495 1.777 0 O-C-N 121.449 -0.782 . . . . 0.0 110.035 177.869 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 7.6 t -128.16 147.1 50.54 Favored 'General case' 0 N--CA 1.496 1.861 0 O-C-N 121.736 -0.603 . . . . 0.0 109.939 179.486 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 45' ' ' LYS . . . . . 0.544 ' HE3' HD11 ' A' ' 47' ' ' ILE . 21.8 ttpt -152.25 132.4 13.54 Favored 'General case' 0 N--CA 1.496 1.869 0 C-N-CA 120.1 -0.64 . . . . 0.0 110.686 -177.526 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 86.9 p -95.27 124.33 39.25 Favored 'General case' 0 N--CA 1.495 1.779 0 O-C-N 121.75 -0.594 . . . . 0.0 110.108 177.574 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 47' ' ' ILE . . . . . 0.544 HD11 ' HE3' ' A' ' 45' ' ' LYS . 77.8 mt -129.25 134.94 62.97 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.855 0 O-C-N 121.651 -0.655 . . . . 0.0 109.333 179.724 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 48' ' ' VAL . . . . . 1.028 HG22 HD12 ' A' ' 34' ' ' ILE . 64.2 t -81.78 127.67 39.39 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.916 0 N-CA-C 109.074 -0.713 . . . . 0.0 109.074 177.646 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 49' ' ' THR . . . . . 0.543 ' HB ' HD22 ' B' ' 264' ' ' LEU . 61.0 p -58.03 -24.96 60.41 Favored 'General case' 0 N--CA 1.506 2.365 0 O-C-N 121.49 -0.756 . . . . 0.0 111.872 -167.763 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 33.5 tttp -56.65 -24.8 50.95 Favored 'General case' 0 N--CA 1.503 2.196 0 O-C-N 121.444 -0.785 . . . . 0.0 111.014 -177.228 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 46.3 p30 -84.06 3.28 35.31 Favored 'General case' 0 N--CA 1.499 1.992 0 C-N-CA 119.725 -0.79 . . . . 0.0 111.363 176.691 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 52' ' ' ILE . . . . . 0.427 HG21 HD11 ' A' ' 55' ' ' LEU . 98.9 mt -75.2 124.38 32.94 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.104 0 O-C-N 121.185 -0.947 . . . . 0.0 109.926 177.976 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 74.7 tttt -93.26 -28.59 16.15 Favored 'General case' 0 N--CA 1.495 1.786 0 O-C-N 121.81 -0.556 . . . . 0.0 109.959 171.227 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 5.0 m-20 -163.3 153.58 15.89 Favored 'General case' 0 N--CA 1.499 2.02 0 O-C-N 121.707 -0.62 . . . . 0.0 110.068 -178.094 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 55' ' ' LEU . . . . . 0.534 ' CD2' HG22 ' A' ' 13' ' ' VAL . 83.8 mt -132.96 148.8 52.27 Favored 'General case' 0 N--CA 1.497 1.902 0 O-C-N 121.681 -0.637 . . . . 0.0 110.512 -178.535 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 20.2 ptp180 -151.97 145.19 24.66 Favored 'General case' 0 N--CA 1.495 1.799 0 O-C-N 121.7 -0.625 . . . . 0.0 110.123 175.152 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 57' ' ' ILE . . . . . 0.529 ' HA ' HG12 ' A' ' 11' ' ' VAL . 67.1 mt -85.84 133.48 29.5 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.822 0 O-C-N 121.539 -0.726 . . . . 0.0 109.765 172.405 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 58' ' ' LEU . . . . . 0.402 HD11 ' HB2' ' A' ' 22' ' ' ARG . 30.5 mt -79.34 123.92 84.36 Favored Pre-proline 0 N--CA 1.497 1.898 0 O-C-N 121.446 -0.784 . . . . 0.0 109.802 -177.215 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 31.7 Cg_endo -68.05 142.72 57.31 Favored 'Trans proline' 0 N--CA 1.489 1.231 0 O-C-N 123.359 1.189 . . . . 0.0 110.676 -174.872 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 89.4 mttt -135.52 114.84 12.46 Favored 'General case' 0 N--CA 1.495 1.775 0 O-C-N 121.754 -0.591 . . . . 0.0 109.927 176.31 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 29.9 m120 -140.05 174.54 10.41 Favored 'General case' 0 N--CA 1.496 1.828 0 O-C-N 121.603 -0.686 . . . . 0.0 110.353 -178.064 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 75.0 mm-40 -104.42 175.8 5.37 Favored 'General case' 0 N--CA 1.495 1.811 0 O-C-N 121.688 -0.632 . . . . 0.0 110.087 179.348 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 7.0 tp -119.35 142.72 33.31 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.944 0 O-C-N 121.74 -0.6 . . . . 0.0 110.171 -179.297 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 64' ' ' MET . . . . . . . . . . . . . 4.8 ttt 52.37 86.93 0.15 Allowed Pre-proline 0 N--CA 1.505 2.29 0 O-C-N 121.637 -0.665 . . . . 0.0 111.041 -179.683 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 27.7 Cg_endo -66.88 141.93 60.73 Favored 'Trans proline' 0 N--CA 1.488 1.172 0 O-C-N 123.533 1.281 . . . . 0.0 110.368 179.444 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 77.8 mttt -65.5 -36.58 84.27 Favored 'General case' 0 N--CA 1.501 2.11 0 O-C-N 121.719 -0.613 . . . . 0.0 110.391 -179.59 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 1.3 p-10 -128.93 30.41 5.07 Favored 'General case' 0 N--CA 1.498 1.934 0 O-C-N 121.64 -0.663 . . . . 0.0 110.601 -179.513 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 80.0 -178.83 53.63 Favored Glycine 0 N--CA 1.494 2.543 0 N-CA-C 109.523 -1.431 . . . . 0.0 109.523 179.797 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 24.7 m -68.06 -40.55 82.73 Favored 'General case' 0 N--CA 1.498 1.973 0 O-C-N 121.748 -0.854 . . . . 0.0 110.225 179.422 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 39.9 tttp 62.23 -70.97 0.05 OUTLIER 'General case' 0 N--CA 1.507 2.398 0 O-C-N 122.01 -0.431 . . . . 0.0 111.092 -177.377 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 19.5 p -118.25 91.14 39.93 Favored Pre-proline 0 N--CA 1.495 1.816 0 O-C-N 121.308 -0.87 . . . . 0.0 110.232 -178.089 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 23.7 Cg_exo -60.53 -28.79 87.29 Favored 'Trans proline' 0 N--CA 1.491 1.374 0 O-C-N 123.547 1.288 . . . . 0.0 110.944 179.976 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 29.9 t -104.02 137.37 42.08 Favored 'General case' 0 N--CA 1.495 1.787 0 O-C-N 121.607 -0.683 . . . . 0.0 110.174 179.721 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 42.8 p -77.2 -31.39 55.29 Favored 'General case' 0 N--CA 1.499 2.013 0 O-C-N 121.691 -0.631 . . . . 0.0 110.395 -179.588 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 91.7 m-20 -99.18 120.72 39.98 Favored 'General case' 0 N--CA 1.496 1.841 0 O-C-N 121.593 -0.692 . . . . 0.0 110.276 -179.133 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 87.6 p -151.59 164.42 36.91 Favored 'General case' 0 N--CA 1.495 1.784 0 O-C-N 121.694 -0.629 . . . . 0.0 110.089 179.228 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 39.8 p -96.47 11.32 35.4 Favored 'General case' 0 N--CA 1.495 1.806 0 O-C-N 121.586 -0.696 . . . . 0.0 111.255 179.562 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 52.2 mtmt -67.83 -33.79 75.48 Favored 'General case' 0 N--CA 1.5 2.045 0 O-C-N 121.265 -0.897 . . . . 0.0 110.274 179.276 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 79' ' ' LEU . . . . . 0.557 ' N ' HD12 ' A' ' 79' ' ' LEU . 6.3 mp -92.2 148.04 22.46 Favored 'General case' 0 N--CA 1.496 1.862 0 O-C-N 121.643 -0.661 . . . . 0.0 110.245 -179.836 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 40.5 pttt -133.09 170.66 15.08 Favored 'General case' 0 N--CA 1.496 1.869 0 O-C-N 121.639 -0.663 . . . . 0.0 110.337 179.976 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 31.3 t -102.23 142.91 32.71 Favored 'General case' 0 N--CA 1.495 1.791 0 O-C-N 121.712 -0.617 . . . . 0.0 110.153 -179.715 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -72.76 139.44 47.11 Favored 'General case' 0 N--CA 1.498 1.957 0 O-C-N 121.716 -0.615 . . . . 0.0 110.164 -179.332 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 54.7 mt-10 -118.87 153.94 33.73 Favored 'General case' 0 N--CA 1.496 1.848 0 O-C-N 121.758 -0.589 . . . . 0.0 110.078 179.506 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 46.3 p -126.13 24.62 6.87 Favored 'General case' 0 N--CA 1.498 1.926 0 O-C-N 121.609 -0.682 . . . . 0.0 110.815 -179.864 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 85.8 m-85 -77.25 -34.12 55.86 Favored 'General case' 0 N--CA 1.499 2.009 0 O-C-N 121.461 -0.774 . . . . 0.0 110.158 178.644 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 87.4 p -148.28 169.53 19.91 Favored 'General case' 0 N--CA 1.494 1.775 0 O-C-N 121.718 -0.614 . . . . 0.0 110.238 179.905 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 49.3 m -114.2 148.15 37.78 Favored 'General case' 0 N--CA 1.494 1.76 0 O-C-N 121.715 -0.615 . . . . 0.0 110.173 -179.996 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 86.0 mttt -66.98 -39.54 87.21 Favored 'General case' 0 N--CA 1.5 2.036 0 O-C-N 121.598 -0.689 . . . . 0.0 110.369 179.974 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 30.0 m120 -76.54 -39.1 53.85 Favored 'General case' 0 N--CA 1.499 1.999 0 O-C-N 121.683 -0.636 . . . . 0.0 110.482 -178.016 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 94.3 mttt -107.4 136.52 47.06 Favored 'General case' 0 N--CA 1.496 1.861 0 O-C-N 121.729 -0.607 . . . . 0.0 110.427 -177.633 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 91' ' ' TRP . . . . . . . . . . . . . 98.7 m95 -105.01 145.4 30.49 Favored 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.65 -0.656 . . . . 0.0 110.266 179.557 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 23.6 m -64.29 -35.17 79.98 Favored 'General case' 0 N--CA 1.502 2.146 0 O-C-N 121.701 -0.624 . . . . 0.0 110.318 -179.604 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 93' ' ' MET . . . . . . . . . . . . . 49.4 ttm -120.3 141.38 50.07 Favored 'General case' 0 N--CA 1.494 1.732 0 O-C-N 121.706 -0.621 . . . . 0.0 110.182 179.74 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 20.0 t0 . . . . . 0 N--CA 1.494 1.767 0 CA-C-O 118.008 -0.996 . . . . 0.0 110.22 -179.934 . . . . . . . . 0 0 . 1 . 014 nuclear build full ' B' B ' 240' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.315 0 N-CA-C 109.536 -1.426 . . . . 0.0 109.536 . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' B' B ' 241' ' ' ALA . . . . . . . . . . . . . . . -143.37 154.65 43.94 Favored 'General case' 0 N--CA 1.494 1.753 0 O-C-N 121.658 -0.907 . . . . 0.0 110.268 179.895 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 242' ' ' THR . . . . . . . . . . . . . 42.6 p -69.23 -34.1 74.31 Favored 'General case' 0 N--CA 1.498 1.971 0 O-C-N 121.649 -0.657 . . . . 0.0 110.161 -179.758 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 243' ' ' THR . . . . . . . . . . . . . 39.3 p -126.52 154.49 43.73 Favored 'General case' 0 N--CA 1.495 1.798 0 O-C-N 121.587 -0.696 . . . . 0.0 110.168 179.706 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 244' ' ' LYS . . . . . . . . . . . . . 40.6 tttp -66.31 -34.96 79.17 Favored 'General case' 0 N--CA 1.5 2.046 0 O-C-N 121.671 -0.643 . . . . 0.0 110.352 179.5 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 245' ' ' GLU . . . . . . . . . . . . . 55.0 mt-10 -95.25 148.06 22.81 Favored 'General case' 0 N--CA 1.494 1.768 0 O-C-N 121.67 -0.644 . . . . 0.0 110.304 -179.097 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 246' ' ' LYS . . . . . . . . . . . . . 17.2 tptm -157.02 34.06 0.29 Allowed 'General case' 0 N--CA 1.495 1.807 0 O-C-N 121.734 -0.604 . . . . 0.0 110.133 179.986 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 247' ' ' ASN . . . . . . . . . . . . . 90.9 m-20 -109.14 123.22 48.86 Favored 'General case' 0 N--CA 1.495 1.787 0 O-C-N 121.528 -0.733 . . . . 0.0 110.311 -179.289 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 248' ' ' ILE . . . . . . . . . . . . . 81.0 mt 52.68 94.2 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.508 2.427 0 O-C-N 121.649 -0.657 . . . . 0.0 110.692 179.526 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 249' ' ' SER . . . . . 0.41 ' C ' HG23 ' B' ' 250' ' ' VAL . 95.8 p -112.01 146.67 37.48 Favored 'General case' 0 N--CA 1.494 1.774 0 O-C-N 121.652 -0.655 . . . . 0.0 110.218 179.496 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 250' ' ' VAL . . . . . 0.41 HG23 ' C ' ' B' ' 249' ' ' SER . 82.3 t -148.88 140.07 17.24 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.975 0 O-C-N 121.66 -0.65 . . . . 0.0 109.395 -179.769 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 251' ' ' ASP . . . . . . . . . . . . . 5.8 p-10 -161.65 88.07 0.7 Allowed 'General case' 0 N--CA 1.497 1.907 0 O-C-N 121.714 -0.616 . . . . 0.0 110.414 -179.962 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 252' ' ' VAL . . . . . . . . . . . . . 58.8 t 52.61 81.8 0.05 OUTLIER 'Isoleucine or valine' 0 N--CA 1.506 2.342 0 O-C-N 121.432 -0.793 . . . . 0.0 110.668 179.431 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 253' ' ' ASP . . . . . . . . . . . . . 74.6 m-20 51.66 90.42 0.02 OUTLIER 'General case' 0 N--CA 1.506 2.346 0 O-C-N 121.597 -0.689 . . . . 0.0 111.226 178.994 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 254' ' ' ALA . . . . . . . . . . . . . . . -66.99 -31.7 72.44 Favored 'General case' 0 N--CA 1.5 2.045 0 O-C-N 121.632 -0.667 . . . . 0.0 110.32 178.2 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 255' ' ' ASP . . . . . . . . . . . . . 17.5 t0 -72.81 -26.25 61.44 Favored 'General case' 0 N--CA 1.499 1.984 0 O-C-N 121.676 -0.64 . . . . 0.0 110.662 179.89 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 256' ' ' ALA . . . . . . . . . . . . . . . -62.21 -31.72 72.29 Favored 'General case' 0 N--CA 1.501 2.122 0 O-C-N 121.445 -0.785 . . . . 0.0 110.421 -179.694 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 257' ' ' SER . . . . . . . . . . . . . 50.0 m -55.26 -34.91 64.44 Favored 'General case' 0 N--CA 1.503 2.224 0 O-C-N 121.595 -0.69 . . . . 0.0 110.518 176.808 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 258' ' ' SER . . . . . . . . . . . . . 23.4 t -68.23 -33.04 73.66 Favored 'General case' 0 N--CA 1.499 2.0 0 C-N-CA 120.463 -0.495 . . . . 0.0 110.242 -179.814 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 259' ' ' GLN . . . . . . . . . . . . . 28.7 mt-30 -64.65 -34.91 79.4 Favored 'General case' 0 N--CA 1.5 2.031 0 O-C-N 121.665 -0.647 . . . . 0.0 110.37 179.717 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 260' ' ' LEU . . . . . 0.525 ' HA ' HD12 ' B' ' 263' ' ' LEU . 85.7 mt -65.66 -42.6 91.17 Favored 'General case' 0 N--CA 1.501 2.082 0 O-C-N 121.728 -0.608 . . . . 0.0 110.259 179.288 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 261' ' ' LEU . . . . . . . . . . . . . 22.5 tp -69.79 -36.91 76.1 Favored 'General case' 0 N--CA 1.498 1.943 0 C-N-CA 120.175 -0.61 . . . . 0.0 109.73 176.391 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 262' ' ' SER . . . . . . . . . . . . . 22.8 t -62.33 -36.4 82.08 Favored 'General case' 0 N--CA 1.5 2.07 0 O-C-N 121.756 -0.59 . . . . 0.0 110.516 177.198 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 263' ' ' LEU . . . . . 0.525 HD12 ' HA ' ' B' ' 260' ' ' LEU . 18.2 mt -64.79 -44.48 89.83 Favored 'General case' 0 N--CA 1.501 2.076 0 O-C-N 121.654 -0.654 . . . . 0.0 110.154 179.764 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 264' ' ' LEU . . . . . 0.543 HD22 ' HB ' ' A' ' 49' ' ' THR . 84.9 mt -62.92 -35.25 79.46 Favored 'General case' 0 N--CA 1.502 2.13 0 O-C-N 121.734 -0.604 . . . . 0.0 110.678 178.918 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 265' ' ' LYS . . . . . . . . . . . . . 30.1 ttpt -76.04 -44.99 36.62 Favored 'General case' 0 N--CA 1.497 1.911 0 O-C-N 121.697 -0.627 . . . . 0.0 110.265 -177.344 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 266' ' ' SER . . . . . . . . . . . . . 39.2 t 50.58 -170.87 0.02 OUTLIER 'General case' 0 N--CA 1.506 2.367 0 O-C-N 121.635 -0.665 . . . . 0.0 111.111 -178.254 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 267' ' ' SER . . . . . . . . . . . . . 97.1 p -108.66 133.37 52.85 Favored 'General case' 0 N--CA 1.496 1.84 0 O-C-N 121.686 -0.634 . . . . 0.0 110.157 179.21 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 268' ' ' THR . . . . . . . . . . . . . 39.5 p -135.72 161.38 35.71 Favored 'General case' 0 N--CA 1.495 1.82 0 O-C-N 121.726 -0.609 . . . . 0.0 110.262 -179.917 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 269' ' ' ALA . . . . . . . . . . . . . . . 48.2 88.71 0.1 Allowed Pre-proline 0 N--CA 1.506 2.352 0 O-C-N 121.759 -0.588 . . . . 0.0 111.382 -179.873 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 270' ' ' PRO . . . . . . . . . . . . . 27.1 Cg_endo -66.92 145.18 73.37 Favored 'Trans proline' 0 N--CA 1.488 1.183 0 O-C-N 123.519 1.273 . . . . 0.0 110.323 178.748 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 271' ' ' SER . . . . . . . . . . . . . 48.8 m -118.88 145.85 45.38 Favored 'General case' 0 N--CA 1.495 1.81 0 O-C-N 121.682 -0.636 . . . . 0.0 110.208 -179.749 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 272' ' ' ASP . . . . . . . . . . . . . 74.6 m-20 -127.97 -44.88 1.44 Allowed 'General case' 0 N--CA 1.497 1.914 0 O-C-N 121.703 -0.623 . . . . 0.0 110.219 179.762 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 273' ' ' LEU . . . . . . . . . . . . . 21.0 tp -161.77 145.06 12.22 Favored 'General case' 0 N--CA 1.495 1.783 0 O-C-N 121.604 -0.685 . . . . 0.0 110.169 -179.801 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 274' ' ' ALA . . . . . . . . . . . . . . . 50.45 -169.06 0.03 OUTLIER 'General case' 0 N--CA 1.506 2.359 0 O-C-N 121.647 -0.658 . . . . 0.0 111.174 -179.145 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 275' ' ' THR . . . . . . . . . . . . . 22.7 p -96.86 163.2 20.68 Favored Pre-proline 0 N--CA 1.495 1.784 0 O-C-N 121.73 -0.606 . . . . 0.0 110.258 -179.362 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 276' ' ' PRO . . . . . . . . . . . . . 21.9 Cg_exo -61.56 -31.0 86.98 Favored 'Trans proline' 0 N--CA 1.491 1.354 0 O-C-N 123.68 1.358 . . . . 0.0 110.803 -179.566 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 277' ' ' GLN . . . . . . . . . . . . . 35.5 mt-30 -109.75 157.24 38.14 Favored Pre-proline 0 N--CA 1.495 1.806 0 O-C-N 121.596 -0.69 . . . . 0.0 110.258 -179.749 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 278' ' ' PRO . . . . . . . . . . . . . 17.1 Cg_exo -63.05 141.91 85.42 Favored 'Trans proline' 0 N--CA 1.491 1.349 0 O-C-N 123.643 1.338 . . . . 0.0 110.618 179.327 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 279' ' ' SER . . . . . . . . . . . . . 26.7 t -160.64 -67.68 0.07 Allowed 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.644 -0.66 . . . . 0.0 110.171 178.332 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 280' ' ' THR . . . . . . . . . . . . . 24.7 m -70.4 -35.27 73.36 Favored 'General case' 0 N--CA 1.498 1.949 0 O-C-N 121.615 -0.678 . . . . 0.0 110.167 179.069 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 281' ' ' PHE . . . . . . . . . . . . . 42.7 m-85 -112.37 167.71 8.75 Favored Pre-proline 0 N--CA 1.495 1.782 0 O-C-N 121.76 -0.587 . . . . 0.0 110.334 -178.581 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 282' ' ' PRO . . . . . . . . . . . . . 17.3 Cg_exo -63.26 -177.48 0.37 Allowed 'Trans proline' 0 N--CA 1.489 1.25 0 O-C-N 123.683 1.36 . . . . 0.0 110.631 179.895 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 283' ' ' GLN . . . . . . . . . . . . . 39.1 mt-30 -81.94 166.08 39.44 Favored Pre-proline 0 N--CA 1.497 1.914 0 O-C-N 121.756 -0.59 . . . . 0.0 110.095 -179.666 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 284' ' ' PRO . . . . . 0.409 ' N ' ' HD2' ' B' ' 285' ' ' PRO . 24.7 Cg_exo -56.71 -51.81 8.26 Favored 'Trans proline' 0 N--CA 1.492 1.384 0 O-C-N 123.57 1.3 . . . . 0.0 111.905 -177.59 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 285' ' ' PRO . . . . . 0.409 ' HD2' ' N ' ' B' ' 284' ' ' PRO . 36.3 Cg_endo -72.17 159.25 50.28 Favored 'Trans proline' 0 N--CA 1.486 1.053 0 O-C-N 123.226 1.119 . . . . 0.0 110.275 -175.59 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 286' ' ' VAL . . . . . . . . . . . . . 54.6 t -99.63 133.48 42.31 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.823 0 O-C-N 121.629 -0.67 . . . . 0.0 109.704 -178.869 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 287' ' ' GLU . . . . . . . . . . . . . 74.3 mm-40 -66.91 -36.39 82.17 Favored 'General case' 0 N--CA 1.499 2.006 0 O-C-N 121.697 -0.627 . . . . 0.0 110.52 -177.627 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 288' ' ' SER . . . . . . . . . . . . . 50.3 m -112.08 146.36 38.11 Favored 'General case' 0 N--CA 1.496 1.872 0 O-C-N 121.687 -0.633 . . . . 0.0 110.314 -179.811 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 289' ' ' HIS . . . . . . . . . . . . . 83.2 t60 -66.72 -38.79 87.4 Favored 'General case' 0 N--CA 1.5 2.036 0 O-C-N 121.674 -0.641 . . . . 0.0 110.332 179.559 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 290' ' ' SER . . . . . . . . . . . . . 92.1 p -116.12 153.83 31.06 Favored 'General case' 0 N--CA 1.496 1.831 0 O-C-N 121.718 -0.614 . . . . 0.0 110.269 -179.26 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 291' ' ' SER . . . . . . . . . . . . . 89.0 p . . . . . 0 N--CA 1.496 1.844 0 CA-C-O 118.064 -0.969 . . . . 0.0 110.195 -179.603 . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' -1' ' ' MET . . . . . . . . . . . . . 85.1 mtp . . . . . 0 N--CA 1.493 1.709 0 CA-C-O 121.0 0.428 . . . . 0.0 110.221 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 0' ' ' GLY . . . . . . . . . . . . . . . -84.03 -174.66 50.49 Favored Glycine 0 N--CA 1.494 2.528 0 N-CA-C 109.481 -1.448 . . . . 0.0 109.481 179.757 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 65.6 mtt -94.49 129.53 41.23 Favored 'General case' 0 N--CA 1.496 1.833 0 O-C-N 121.631 -0.923 . . . . 0.0 110.156 -179.973 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 70.3 m -101.17 167.83 9.96 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.682 -0.636 . . . . 0.0 110.124 -179.898 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 3' ' ' VAL . . . . . 0.453 HG12 ' CE1' ' A' ' 7' ' ' TYR . 65.7 t -66.33 -27.81 41.64 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.131 0 O-C-N 121.792 -0.568 . . . . 0.0 110.249 -179.771 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -55.14 -30.94 60.85 Favored 'General case' 0 N--CA 1.505 2.292 0 O-C-N 121.462 -0.774 . . . . 0.0 110.449 -178.671 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 9.7 m-20 -68.66 -30.87 69.66 Favored 'General case' 0 N--CA 1.499 2.024 0 O-C-N 121.88 -0.513 . . . . 0.0 110.24 174.789 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 96.5 m-85 -95.84 10.1 38.28 Favored 'General case' 0 N--CA 1.497 1.921 0 O-C-N 121.679 -0.638 . . . . 0.0 111.449 -178.398 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 7' ' ' TYR . . . . . 0.453 ' CE1' HG12 ' A' ' 3' ' ' VAL . 3.7 m-30 -67.16 141.81 57.24 Favored 'General case' 0 N--CA 1.501 2.105 0 O-C-N 121.147 -0.971 . . . . 0.0 110.112 174.966 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 8' ' ' GLY . . . . . 0.431 ' O ' HG13 ' A' ' 24' ' ' VAL . . . 82.95 -1.39 88.66 Favored Glycine 0 N--CA 1.498 2.776 0 N-CA-C 110.745 -0.942 . . . . 0.0 110.745 -177.056 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 9' ' ' SER . . . . . 0.521 ' OG ' HD12 ' A' ' 25' ' ' ILE . 88.5 p -77.34 141.01 40.09 Favored 'General case' 0 N--CA 1.498 1.972 0 O-C-N 121.125 -1.221 . . . . 0.0 110.509 -179.454 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 10' ' ' ASN . . . . . 0.679 ' CG ' HG22 ' A' ' 24' ' ' VAL . 2.5 m120 -85.16 118.53 24.78 Favored 'General case' 0 N--CA 1.498 1.943 0 O-C-N 121.669 -0.644 . . . . 0.0 109.646 174.323 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 11' ' ' VAL . . . . . 0.668 HG21 HD11 ' A' ' 25' ' ' ILE . 35.8 m -143.12 160.94 17.6 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.796 0 O-C-N 121.732 -0.605 . . . . 0.0 109.76 -178.746 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 12' ' ' GLU . . . . . 0.588 ' HB2' HD11 ' A' ' 58' ' ' LEU . 44.6 tt0 -109.43 125.36 52.34 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.575 -0.703 . . . . 0.0 110.16 178.142 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 13' ' ' VAL . . . . . 0.591 HG22 ' CD2' ' A' ' 55' ' ' LEU . 59.6 t -106.87 123.17 61.74 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.839 0 O-C-N 121.565 -0.709 . . . . 0.0 109.946 -177.629 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.438 HD13 ' HD3' ' A' ' 20' ' ' LYS . 27.6 tp -96.2 128.95 43.58 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.726 -0.609 . . . . 0.0 109.636 175.222 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 82.8 mt -99.04 167.16 10.9 Favored 'General case' 0 N--CA 1.497 1.922 0 O-C-N 121.609 -0.682 . . . . 0.0 110.97 -171.799 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 9.5 p30 -57.77 -22.11 45.23 Favored 'General case' 0 N--CA 1.505 2.294 0 O-C-N 121.76 -0.587 . . . . 0.0 111.39 -179.961 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 24.6 p30 -90.03 21.3 3.75 Favored 'General case' 0 N--CA 1.5 2.063 0 O-C-N 121.59 -0.694 . . . . 0.0 111.163 -177.721 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 74.4 m-20 59.87 28.8 18.35 Favored 'General case' 0 N--CA 1.506 2.36 0 O-C-N 121.339 -0.851 . . . . 0.0 110.813 172.675 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 18.0 m -111.66 133.94 53.57 Favored 'General case' 0 N--CA 1.494 1.769 0 O-C-N 121.494 -0.754 . . . . 0.0 109.573 170.617 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 20' ' ' LYS . . . . . 0.438 ' HD3' HD13 ' A' ' 14' ' ' LEU . 5.3 ttpm? -109.84 142.15 41.52 Favored 'General case' 0 N--CA 1.494 1.731 0 O-C-N 121.647 -0.658 . . . . 0.0 110.523 -177.114 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -152.99 160.27 43.0 Favored 'General case' 0 N--CA 1.496 1.828 0 O-C-N 121.773 -0.579 . . . . 0.0 110.09 179.562 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 22' ' ' ARG . . . . . 0.496 ' O ' HD13 ' A' ' 39' ' ' LEU . 30.9 ptt180 -140.28 148.57 41.63 Favored 'General case' 0 N--CA 1.497 1.916 0 O-C-N 121.622 -0.674 . . . . 0.0 110.8 -178.844 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -171.71 171.44 44.08 Favored Glycine 0 N--CA 1.495 2.617 0 N-CA-C 108.701 -1.759 . . . . 0.0 108.701 -176.332 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 24' ' ' VAL . . . . . 0.679 HG22 ' CG ' ' A' ' 10' ' ' ASN . 39.0 t -94.6 118.84 41.6 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.925 0 O-C-N 121.462 -1.022 . . . . 0.0 109.314 -175.913 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 25' ' ' ILE . . . . . 0.668 HD11 HG21 ' A' ' 11' ' ' VAL . 95.3 mt -63.95 143.41 15.7 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.142 0 O-C-N 121.665 -0.647 . . . . 0.0 110.333 -172.073 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 26' ' ' THR . . . . . 0.623 HG21 ' HB2' ' A' ' 38' ' ' ARG . 7.5 p -121.25 -27.01 4.95 Favored 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.721 -0.612 . . . . 0.0 111.336 -179.887 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 27' ' ' ASN . . . . . 0.528 ' O ' HD12 ' A' ' 35' ' ' LEU . 27.2 t30 -162.03 160.67 27.84 Favored 'General case' 0 N--CA 1.499 1.991 0 C-N-CA 119.002 -1.079 . . . . 0.0 111.814 -179.109 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 28' ' ' PHE . . . . . 0.553 ' HE1' HG21 ' A' ' 49' ' ' THR . 83.3 t80 -150.19 126.73 10.86 Favored 'General case' 0 N--CA 1.497 1.901 0 N-CA-C 108.964 -0.754 . . . . 0.0 108.964 170.599 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 21.3 t70 -99.73 130.51 45.95 Favored 'General case' 0 N--CA 1.491 1.597 0 N-CA-C 108.955 -0.757 . . . . 0.0 108.955 -177.431 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 20.1 m -70.31 -51.68 28.4 Favored 'General case' 0 N--CA 1.498 1.946 0 C-N-CA 119.999 -0.681 . . . . 0.0 110.394 -176.9 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 23.1 m -60.07 -41.25 92.02 Favored 'General case' 0 N--CA 1.502 2.17 0 O-C-N 121.619 -0.676 . . . . 0.0 110.829 -174.967 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 29.8 m120 -103.91 -10.14 18.4 Favored 'General case' 0 N--CA 1.496 1.87 0 O-C-N 121.624 -0.673 . . . . 0.0 111.613 -177.662 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 1.8 m 49.91 67.34 0.92 Allowed 'General case' 0 N--CA 1.509 2.51 0 O-C-N 121.098 -1.001 . . . . 0.0 111.07 -175.776 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 34' ' ' ILE . . . . . 1.128 HD12 HG22 ' A' ' 48' ' ' VAL . 47.4 mm -126.69 127.03 69.76 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.167 0 O-C-N 121.597 -0.689 . . . . 0.0 109.479 -176.066 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.528 HD12 ' O ' ' A' ' 27' ' ' ASN . 11.7 tp -115.88 121.61 42.87 Favored 'General case' 0 N--CA 1.494 1.765 0 O-C-N 121.708 -0.62 . . . . 0.0 110.521 -170.432 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 79.5 mt-30 -91.61 134.19 34.9 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.829 -0.544 . . . . 0.0 109.539 173.83 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 0.409 HD23 ' HA ' ' A' ' 25' ' ' ILE . 13.9 mt -117.82 123.81 46.83 Favored 'General case' 0 N--CA 1.493 1.725 0 O-C-N 121.798 -0.564 . . . . 0.0 109.989 174.52 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 38' ' ' ARG . . . . . 0.623 ' HB2' HG21 ' A' ' 26' ' ' THR . 56.6 ttt85 -98.42 107.69 20.2 Favored 'General case' 0 N--CA 1.497 1.878 0 O-C-N 121.63 -0.669 . . . . 0.0 109.756 175.986 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.496 HD13 ' O ' ' A' ' 22' ' ' ARG . 18.9 tp -85.1 150.75 24.63 Favored 'General case' 0 N--CA 1.495 1.797 0 O-C-N 121.697 -0.627 . . . . 0.0 110.993 -173.933 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -63.15 -9.17 9.83 Favored 'General case' 0 N--CA 1.503 2.184 0 O-C-N 121.922 -0.486 . . . . 0.0 111.962 -173.223 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 37.7 t30 -85.01 29.08 0.66 Allowed 'General case' 0 N--CA 1.499 2.018 0 O-C-N 121.146 -0.971 . . . . 0.0 110.952 174.202 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 74.4 m-20 59.67 31.81 21.1 Favored 'General case' 0 N--CA 1.504 2.27 0 O-C-N 121.257 -0.902 . . . . 0.0 110.428 174.176 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 48.9 m -123.92 137.78 54.58 Favored 'General case' 0 N--CA 1.496 1.859 0 O-C-N 121.394 -0.816 . . . . 0.0 110.374 178.836 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 9.0 t -97.55 150.21 21.35 Favored 'General case' 0 N--CA 1.497 1.906 0 O-C-N 121.735 -0.603 . . . . 0.0 110.212 176.244 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 42.1 tttp -149.81 119.16 6.85 Favored 'General case' 0 N--CA 1.496 1.861 0 O-C-N 121.662 -0.649 . . . . 0.0 110.255 178.466 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 90.3 p -96.07 122.63 39.12 Favored 'General case' 0 N--CA 1.495 1.807 0 O-C-N 121.676 -0.64 . . . . 0.0 110.21 178.431 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 82.5 mt -129.27 135.68 61.24 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.845 0 O-C-N 121.565 -0.709 . . . . 0.0 109.328 179.835 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 48' ' ' VAL . . . . . 1.128 HG22 HD12 ' A' ' 34' ' ' ILE . 58.7 t -81.95 127.57 39.5 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.902 0 O-C-N 121.531 -0.731 . . . . 0.0 109.232 179.56 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 49' ' ' THR . . . . . 0.553 HG21 ' HE1' ' A' ' 28' ' ' PHE . 37.4 p -59.41 -24.81 63.78 Favored 'General case' 0 N--CA 1.504 2.273 0 O-C-N 121.659 -0.651 . . . . 0.0 112.055 -170.101 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 73.5 tttt -56.23 -22.78 31.62 Favored 'General case' 0 N--CA 1.503 2.183 0 O-C-N 121.401 -0.812 . . . . 0.0 111.1 -177.161 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 51.4 p30 -83.8 0.92 45.42 Favored 'General case' 0 N--CA 1.499 1.985 0 O-C-N 121.443 -0.786 . . . . 0.0 111.358 176.369 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 96.3 mt -75.99 127.76 37.36 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.089 0 O-C-N 121.162 -0.961 . . . . 0.0 110.084 178.72 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 75.0 tttt -91.76 -32.39 15.41 Favored 'General case' 0 N--CA 1.493 1.711 0 N-CA-C 109.443 -0.577 . . . . 0.0 109.443 169.901 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -161.47 157.29 24.79 Favored 'General case' 0 N--CA 1.497 1.898 0 O-C-N 121.723 -0.611 . . . . 0.0 109.815 -177.037 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 55' ' ' LEU . . . . . 0.591 ' CD2' HG22 ' A' ' 13' ' ' VAL . 85.2 mt -132.92 148.55 52.28 Favored 'General case' 0 N--CA 1.497 1.904 0 O-C-N 121.65 -0.656 . . . . 0.0 110.462 -179.851 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 6.5 ptm180 -150.76 139.6 20.85 Favored 'General case' 0 N--CA 1.495 1.782 0 O-C-N 121.765 -0.584 . . . . 0.0 109.94 176.335 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 57' ' ' ILE . . . . . 0.471 ' HA ' HG12 ' A' ' 11' ' ' VAL . 67.7 mt -84.98 133.26 29.73 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.872 0 O-C-N 121.522 -0.736 . . . . 0.0 109.671 174.079 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 58' ' ' LEU . . . . . 0.588 HD11 ' HB2' ' A' ' 12' ' ' GLU . 45.1 mt -83.69 155.61 65.22 Favored Pre-proline 0 N--CA 1.498 1.952 0 O-C-N 121.566 -0.709 . . . . 0.0 110.255 -178.462 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 17.9 Cg_exo -62.56 157.94 44.01 Favored 'Trans proline' 0 N--CA 1.49 1.295 0 O-C-N 123.573 1.301 . . . . 0.0 110.627 178.618 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 65.6 tttt -79.83 139.03 37.34 Favored 'General case' 0 N--CA 1.497 1.917 0 O-C-N 121.758 -0.589 . . . . 0.0 110.036 179.483 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 24.2 p30 -129.08 172.8 11.04 Favored 'General case' 0 N--CA 1.497 1.912 0 O-C-N 121.714 -0.616 . . . . 0.0 110.283 179.977 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 46.7 mt-10 -120.7 99.4 6.51 Favored 'General case' 0 N--CA 1.496 1.871 0 O-C-N 121.707 -0.621 . . . . 0.0 110.27 -179.432 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 63' ' ' ILE . . . . . 0.438 HG22 ' N ' ' A' ' 64' ' ' MET . 46.9 mm 58.14 164.98 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.509 2.495 0 CA-C-O 121.404 0.621 . . . . 0.0 110.783 179.272 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 64' ' ' MET . . . . . 0.438 ' N ' HG22 ' A' ' 63' ' ' ILE . 45.7 mtm 52.19 60.4 13.43 Favored Pre-proline 0 N--CA 1.505 2.287 0 O-C-N 121.403 -0.811 . . . . 0.0 111.093 178.781 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 28.7 Cg_endo -67.6 -38.93 13.08 Favored 'Trans proline' 0 N--CA 1.488 1.167 0 O-C-N 123.502 1.264 . . . . 0.0 110.351 178.727 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 24.9 pttm -139.6 164.95 28.54 Favored 'General case' 0 N--CA 1.496 1.828 0 O-C-N 121.674 -0.641 . . . . 0.0 110.365 179.583 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 43.2 t-20 -64.17 -38.48 91.23 Favored 'General case' 0 N--CA 1.501 2.094 0 O-C-N 121.645 -0.66 . . . . 0.0 110.41 179.586 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 71.93 -75.63 0.74 Allowed Glycine 0 N--CA 1.493 2.477 0 N-CA-C 109.708 -1.357 . . . . 0.0 109.708 179.21 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 24.0 m -65.35 -35.47 81.08 Favored 'General case' 0 N--CA 1.5 2.042 0 O-C-N 121.697 -0.884 . . . . 0.0 110.458 -178.918 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 50.5 tttm 53.49 91.78 0.02 OUTLIER 'General case' 0 N--CA 1.505 2.315 0 O-C-N 121.632 -0.667 . . . . 0.0 110.847 -178.982 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 91.6 p -100.65 169.74 7.5 Favored Pre-proline 0 N--CA 1.495 1.782 0 O-C-N 121.655 -0.653 . . . . 0.0 110.288 -179.084 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 22.2 Cg_exo -61.27 153.59 64.25 Favored 'Trans proline' 0 N--CA 1.49 1.296 0 O-C-N 123.634 1.333 . . . . 0.0 110.743 -179.81 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 8.4 t 57.02 170.34 0.04 OUTLIER 'General case' 0 N--CA 1.506 2.328 0 O-C-N 121.658 -0.651 . . . . 0.0 111.056 -178.79 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 38.1 p -97.37 -30.81 12.72 Favored 'General case' 0 N--CA 1.495 1.796 0 O-C-N 121.614 -0.679 . . . . 0.0 110.531 -179.411 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 91.5 m-20 -101.17 123.13 44.83 Favored 'General case' 0 N--CA 1.495 1.801 0 O-C-N 121.598 -0.689 . . . . 0.0 110.357 -178.665 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 76' ' ' SER . . . . . 0.49 ' HB2' HD11 ' A' ' 79' ' ' LEU . 49.5 m -129.11 149.03 51.09 Favored 'General case' 0 N--CA 1.495 1.786 0 O-C-N 121.722 -0.611 . . . . 0.0 110.13 178.875 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 9.9 t -138.02 156.91 47.33 Favored 'General case' 0 N--CA 1.497 1.875 0 O-C-N 121.7 -0.625 . . . . 0.0 110.514 -179.767 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 56.3 mttm 53.44 37.03 24.65 Favored 'General case' 0 N--CA 1.505 2.304 0 O-C-N 121.562 -0.711 . . . . 0.0 110.997 178.406 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 79' ' ' LEU . . . . . 0.49 HD11 ' HB2' ' A' ' 76' ' ' SER . 83.9 mt -68.57 -43.55 76.33 Favored 'General case' 0 N--CA 1.499 1.995 0 O-C-N 121.54 -0.725 . . . . 0.0 110.238 179.145 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 75.0 mttt 52.31 32.29 10.73 Favored 'General case' 0 N--CA 1.506 2.354 0 O-C-N 121.62 -0.675 . . . . 0.0 111.0 179.712 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 90.2 p -68.17 -33.14 73.9 Favored 'General case' 0 N--CA 1.498 1.941 0 O-C-N 121.691 -0.63 . . . . 0.0 110.324 -179.226 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -112.28 146.4 38.27 Favored 'General case' 0 N--CA 1.494 1.749 0 O-C-N 121.619 -0.675 . . . . 0.0 110.271 -179.832 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 78.7 mt-10 -112.82 99.05 7.6 Favored 'General case' 0 N--CA 1.496 1.836 0 O-C-N 121.69 -0.631 . . . . 0.0 110.144 179.306 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 10.2 t -141.65 155.4 45.7 Favored 'General case' 0 N--CA 1.496 1.85 0 O-C-N 121.654 -0.654 . . . . 0.0 110.341 179.703 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 49.2 p90 -147.3 161.51 40.83 Favored 'General case' 0 N--CA 1.494 1.748 0 O-C-N 121.69 -0.631 . . . . 0.0 110.321 179.34 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 32.7 t -142.47 135.96 28.95 Favored 'General case' 0 N--CA 1.495 1.777 0 O-C-N 121.741 -0.6 . . . . 0.0 110.138 179.286 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 86.3 p -118.8 27.94 8.59 Favored 'General case' 0 N--CA 1.497 1.887 0 O-C-N 121.624 -0.673 . . . . 0.0 110.614 179.505 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 98.3 mttt -95.25 -68.89 0.78 Allowed 'General case' 0 N--CA 1.496 1.848 0 O-C-N 121.541 -0.724 . . . . 0.0 110.197 -179.727 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 91.6 m-20 -124.95 115.69 20.99 Favored 'General case' 0 N--CA 1.495 1.809 0 O-C-N 121.604 -0.685 . . . . 0.0 110.185 179.525 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 51.4 tttm -66.12 -41.64 90.25 Favored 'General case' 0 N--CA 1.5 2.032 0 O-C-N 121.62 -0.675 . . . . 0.0 110.285 179.615 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 91' ' ' TRP . . . . . . . . . . . . . 64.9 p-90 -145.16 158.73 43.74 Favored 'General case' 0 N--CA 1.497 1.88 0 O-C-N 121.689 -0.632 . . . . 0.0 110.301 -179.929 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 26.2 t -147.98 147.74 29.97 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.596 -0.69 . . . . 0.0 110.228 179.807 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 93' ' ' MET . . . . . . . . . . . . . 22.8 ptm -152.02 33.61 0.53 Allowed 'General case' 0 N--CA 1.496 1.828 0 O-C-N 121.657 -0.652 . . . . 0.0 110.357 179.559 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 . . . . . 0 N--CA 1.494 1.762 0 CA-C-O 117.988 -1.006 . . . . 0.0 110.202 179.979 . . . . . . . . 0 0 . 1 . 015 nuclear build full ' B' B ' 240' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.313 0 N-CA-C 109.531 -1.427 . . . . 0.0 109.531 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' B' B ' 241' ' ' ALA . . . . . . . . . . . . . . . -67.14 -33.19 74.9 Favored 'General case' 0 N--CA 1.499 2.015 0 O-C-N 121.607 -0.937 . . . . 0.0 110.35 179.969 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 242' ' ' THR . . . . . . . . . . . . . 9.7 t -133.08 161.3 34.76 Favored 'General case' 0 N--CA 1.497 1.884 0 O-C-N 121.673 -0.642 . . . . 0.0 110.349 -179.932 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 243' ' ' THR . . . . . . . . . . . . . 21.7 m -93.29 135.38 34.56 Favored 'General case' 0 N--CA 1.495 1.779 0 O-C-N 121.626 -0.671 . . . . 0.0 110.18 -179.832 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 244' ' ' LYS . . . . . . . . . . . . . 35.8 tttp -101.26 33.14 2.99 Favored 'General case' 0 N--CA 1.494 1.763 0 O-C-N 121.66 -0.65 . . . . 0.0 110.26 -179.043 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 245' ' ' GLU . . . . . . . . . . . . . 78.4 mt-10 53.37 100.01 0.01 OUTLIER 'General case' 0 N--CA 1.507 2.393 0 O-C-N 121.688 -0.632 . . . . 0.0 111.16 -179.224 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 246' ' ' LYS . . . . . . . . . . . . . 40.6 tttp -60.19 -32.86 71.48 Favored 'General case' 0 N--CA 1.502 2.157 0 O-C-N 121.56 -0.713 . . . . 0.0 110.496 -179.171 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 247' ' ' ASN . . . . . . . . . . . . . 91.1 m-20 -96.33 137.01 36.03 Favored 'General case' 0 N--CA 1.495 1.81 0 O-C-N 121.708 -0.62 . . . . 0.0 110.06 178.659 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 248' ' ' ILE . . . . . 0.431 HG22 ' N ' ' B' ' 249' ' ' SER . 74.2 mt 57.84 164.09 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.509 2.505 0 O-C-N 121.715 -0.616 . . . . 0.0 110.617 -178.349 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 249' ' ' SER . . . . . 0.431 ' N ' HG22 ' B' ' 248' ' ' ILE . 87.9 p -116.01 157.02 25.28 Favored 'General case' 0 N--CA 1.495 1.819 0 O-C-N 121.426 -0.796 . . . . 0.0 110.335 -179.793 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 250' ' ' VAL . . . . . . . . . . . . . 59.2 t -89.26 137.94 20.26 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.948 0 O-C-N 121.728 -0.607 . . . . 0.0 109.647 179.857 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 251' ' ' ASP . . . . . . . . . . . . . 16.6 t70 -161.81 166.76 25.96 Favored 'General case' 0 N--CA 1.495 1.793 0 O-C-N 121.746 -0.597 . . . . 0.0 110.216 -179.393 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 252' ' ' VAL . . . . . 0.418 HG13 ' N ' ' B' ' 253' ' ' ASP . 11.9 p -162.1 -40.35 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.498 1.964 0 O-C-N 121.769 -0.582 . . . . 0.0 110.426 -179.897 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 253' ' ' ASP . . . . . 0.418 ' N ' HG13 ' B' ' 252' ' ' VAL . 1.2 m-20 52.5 95.78 0.02 OUTLIER 'General case' 0 N--CA 1.505 2.324 0 O-C-N 121.507 -0.745 . . . . 0.0 111.194 179.304 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 254' ' ' ALA . . . . . . . . . . . . . . . -65.95 -31.05 71.74 Favored 'General case' 0 N--CA 1.5 2.07 0 O-C-N 121.686 -0.634 . . . . 0.0 110.403 179.469 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 255' ' ' ASP . . . . . . . . . . . . . 74.4 m-20 -72.55 -29.74 63.83 Favored 'General case' 0 N--CA 1.499 1.989 0 O-C-N 121.653 -0.654 . . . . 0.0 110.254 178.453 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 256' ' ' ALA . . . . . . . . . . . . . . . -63.13 -31.02 72.06 Favored 'General case' 0 N--CA 1.5 2.049 0 O-C-N 121.462 -0.774 . . . . 0.0 110.333 177.935 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 257' ' ' SER . . . . . . . . . . . . . 6.6 t -54.91 -34.93 63.61 Favored 'General case' 0 N--CA 1.503 2.198 0 O-C-N 121.558 -0.714 . . . . 0.0 110.421 176.884 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 258' ' ' SER . . . . . . . . . . . . . 24.8 m -68.09 -32.53 72.91 Favored 'General case' 0 N--CA 1.497 1.908 0 O-C-N 121.864 -0.522 . . . . 0.0 110.239 179.983 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 259' ' ' GLN . . . . . . . . . . . . . 78.1 mt-30 -64.64 -35.03 79.71 Favored 'General case' 0 N--CA 1.5 2.028 0 O-C-N 121.593 -0.692 . . . . 0.0 110.367 179.782 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 260' ' ' LEU . . . . . 0.544 ' HA ' HD12 ' B' ' 263' ' ' LEU . 51.4 mt -65.52 -43.4 90.17 Favored 'General case' 0 N--CA 1.501 2.082 0 O-C-N 121.67 -0.644 . . . . 0.0 110.281 179.045 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 261' ' ' LEU . . . . . . . . . . . . . 21.5 tp -71.05 -36.94 72.5 Favored 'General case' 0 N--CA 1.498 1.932 0 C-N-CA 120.088 -0.645 . . . . 0.0 109.586 174.97 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 262' ' ' SER . . . . . . . . . . . . . 22.6 t -62.25 -35.69 79.73 Favored 'General case' 0 N--CA 1.501 2.09 0 O-C-N 121.714 -0.616 . . . . 0.0 110.438 175.893 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 263' ' ' LEU . . . . . 0.544 HD12 ' HA ' ' B' ' 260' ' ' LEU . 16.2 mt -64.43 -41.46 96.58 Favored 'General case' 0 N--CA 1.5 2.068 0 O-C-N 121.683 -0.635 . . . . 0.0 110.242 179.433 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 264' ' ' LEU . . . . . 0.44 ' CD1' HD11 ' A' ' 55' ' ' LEU . 87.9 mt -62.14 -35.63 79.35 Favored 'General case' 0 N--CA 1.502 2.171 0 O-C-N 121.695 -0.628 . . . . 0.0 110.291 176.563 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 265' ' ' LYS . . . . . . . . . . . . . 57.4 tttm -75.21 -32.23 61.12 Favored 'General case' 0 N--CA 1.498 1.967 0 O-C-N 121.818 -0.551 . . . . 0.0 110.085 178.009 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 266' ' ' SER . . . . . . . . . . . . . 29.1 t -162.62 118.56 1.89 Allowed 'General case' 0 N--CA 1.496 1.843 0 O-C-N 121.679 -0.638 . . . . 0.0 109.956 178.993 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 267' ' ' SER . . . . . . . . . . . . . 24.2 m -67.07 -33.9 76.5 Favored 'General case' 0 N--CA 1.5 2.03 0 O-C-N 121.719 -0.613 . . . . 0.0 110.514 -178.286 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 268' ' ' THR . . . . . . . . . . . . . 21.8 m -65.18 -51.59 60.12 Favored 'General case' 0 N--CA 1.5 2.069 0 O-C-N 121.636 -0.665 . . . . 0.0 110.464 -177.231 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 269' ' ' ALA . . . . . . . . . . . . . . . 46.32 55.75 15.88 Favored Pre-proline 0 N--CA 1.506 2.339 0 O-C-N 121.749 -0.594 . . . . 0.0 111.325 -178.072 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 270' ' ' PRO . . . . . . . . . . . . . 28.0 Cg_endo -67.12 -45.21 4.12 Favored 'Trans proline' 0 N--CA 1.489 1.207 0 O-C-N 123.479 1.252 . . . . 0.0 110.533 -177.758 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 271' ' ' SER . . . . . . . . . . . . . 87.4 p -154.77 174.57 14.86 Favored 'General case' 0 N--CA 1.494 1.772 0 O-C-N 121.687 -0.633 . . . . 0.0 110.325 -178.975 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 272' ' ' ASP . . . . . . . . . . . . . 20.6 t70 -78.05 129.24 35.0 Favored 'General case' 0 N--CA 1.498 1.949 0 O-C-N 121.738 -0.601 . . . . 0.0 109.962 179.678 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 273' ' ' LEU . . . . . 0.426 ' HA ' HD22 ' B' ' 273' ' ' LEU . 0.2 OUTLIER 52.63 80.64 0.09 Allowed 'General case' 0 N--CA 1.506 2.369 0 O-C-N 121.631 -0.668 . . . . 0.0 110.865 -178.654 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' B' B ' 274' ' ' ALA . . . . . . . . . . . . . . . -166.4 154.0 9.9 Favored 'General case' 0 N--CA 1.497 1.909 0 O-C-N 121.528 -0.733 . . . . 0.0 110.011 179.76 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 275' ' ' THR . . . . . . . . . . . . . 7.7 t -68.29 149.12 98.19 Favored Pre-proline 0 N--CA 1.5 2.067 0 C-N-CA 120.251 -0.58 . . . . 0.0 110.232 -179.863 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 276' ' ' PRO . . . . . . . . . . . . . 29.3 Cg_endo -67.51 145.15 69.7 Favored 'Trans proline' 0 N--CA 1.489 1.243 0 O-C-N 123.495 1.26 . . . . 0.0 110.358 179.239 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 277' ' ' GLN . . . . . . . . . . . . . 39.9 mt-30 -127.55 66.1 68.71 Favored Pre-proline 0 N--CA 1.495 1.791 0 O-C-N 121.646 -0.659 . . . . 0.0 110.177 -179.848 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 278' ' ' PRO . . . . . . . . . . . . . 29.9 Cg_endo -67.77 -31.08 32.95 Favored 'Trans proline' 0 N--CA 1.489 1.208 0 O-C-N 123.414 1.218 . . . . 0.0 110.611 179.211 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 279' ' ' SER . . . . . . . . . . . . . 22.8 t -63.56 -35.02 79.1 Favored 'General case' 0 N--CA 1.502 2.135 0 O-C-N 121.598 -0.689 . . . . 0.0 110.631 -178.431 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 280' ' ' THR . . . . . . . . . . . . . 37.8 p -105.17 29.07 6.69 Favored 'General case' 0 N--CA 1.497 1.886 0 O-C-N 121.685 -0.634 . . . . 0.0 110.608 -179.623 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 281' ' ' PHE . . . . . . . . . . . . . 85.1 t80 -131.96 73.11 78.78 Favored Pre-proline 0 N--CA 1.494 1.74 0 O-C-N 121.511 -0.743 . . . . 0.0 110.113 179.485 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 282' ' ' PRO . . . . . . . . . . . . . 29.6 Cg_endo -67.8 124.26 11.68 Favored 'Trans proline' 0 N--CA 1.488 1.168 0 O-C-N 123.49 1.258 . . . . 0.0 110.354 -179.819 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 283' ' ' GLN . . . . . . . . . . . . . 7.9 mt-30 -76.42 -56.27 1.53 Allowed Pre-proline 0 N--CA 1.498 1.927 0 O-C-N 121.661 -0.65 . . . . 0.0 110.634 179.532 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 284' ' ' PRO . . . . . . . . . . . . . 41.4 Cg_endo -73.2 154.8 51.96 Favored 'Trans proline' 0 N--CA 1.487 1.115 0 O-C-N 123.338 1.178 . . . . 0.0 110.401 -178.541 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 285' ' ' PRO . . . . . . . . . . . . . 29.7 Cg_endo -67.97 154.33 73.03 Favored 'Trans proline' 0 N--CA 1.488 1.183 0 O-C-N 123.7 1.368 . . . . 0.0 110.356 179.314 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 286' ' ' VAL . . . . . . . . . . . . . 26.8 m -126.64 157.14 37.7 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.981 0 O-C-N 121.648 -0.658 . . . . 0.0 110.212 179.657 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 287' ' ' GLU . . . . . . . . . . . . . 46.0 tt0 -99.95 137.45 38.39 Favored 'General case' 0 N--CA 1.495 1.808 0 O-C-N 121.68 -0.637 . . . . 0.0 110.171 -179.438 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 288' ' ' SER . . . . . . . . . . . . . 28.6 t -127.33 144.71 51.0 Favored 'General case' 0 N--CA 1.495 1.81 0 O-C-N 121.672 -0.643 . . . . 0.0 110.166 179.701 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 289' ' ' HIS . . . . . . . . . . . . . 83.7 t60 -117.2 129.15 55.75 Favored 'General case' 0 N--CA 1.496 1.845 0 O-C-N 121.637 -0.664 . . . . 0.0 110.153 -179.99 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 290' ' ' SER . . . . . . . . . . . . . 29.8 t -122.6 143.25 49.87 Favored 'General case' 0 N--CA 1.495 1.793 0 O-C-N 121.617 -0.677 . . . . 0.0 110.213 -179.93 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 291' ' ' SER . . . . . . . . . . . . . 10.3 t . . . . . 0 N--CA 1.494 1.767 0 CA-C-O 117.995 -1.002 . . . . 0.0 110.223 179.977 . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' -1' ' ' MET . . . . . . . . . . . . . 23.1 ptt? . . . . . 0 N--CA 1.496 1.84 0 CA-C-O 121.029 0.442 . . . . 0.0 110.232 . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 0' ' ' GLY . . . . . . . . . . . . . . . 170.15 -175.46 44.14 Favored Glycine 0 N--CA 1.494 2.538 0 N-CA-C 109.472 -1.451 . . . . 0.0 109.472 179.955 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 74.9 mtm -124.66 156.61 37.25 Favored 'General case' 0 N--CA 1.495 1.788 0 O-C-N 121.701 -0.882 . . . . 0.0 110.227 179.708 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 66.2 m -100.99 172.33 7.09 Favored 'General case' 0 N--CA 1.495 1.786 0 O-C-N 121.771 -0.581 . . . . 0.0 110.181 -179.812 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 3' ' ' VAL . . . . . 0.472 HG12 ' CE1' ' A' ' 7' ' ' TYR . 69.5 t -66.46 -27.82 41.51 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.048 0 O-C-N 121.652 -0.655 . . . . 0.0 110.254 -179.265 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -55.17 -31.27 61.23 Favored 'General case' 0 N--CA 1.504 2.273 0 O-C-N 121.499 -0.751 . . . . 0.0 110.42 -178.891 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 74.5 m-20 -68.63 -31.33 70.4 Favored 'General case' 0 N--CA 1.499 1.99 0 O-C-N 121.883 -0.511 . . . . 0.0 110.131 174.714 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 87.4 m-85 -95.59 10.05 38.07 Favored 'General case' 0 N--CA 1.497 1.887 0 O-C-N 121.641 -0.662 . . . . 0.0 111.398 -179.573 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 7' ' ' TYR . . . . . 0.472 ' CE1' HG12 ' A' ' 3' ' ' VAL . 3.1 m-30 -67.24 144.05 56.16 Favored 'General case' 0 N--CA 1.502 2.128 0 O-C-N 121.154 -0.966 . . . . 0.0 110.042 175.52 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 8' ' ' GLY . . . . . 0.429 ' O ' HG13 ' A' ' 24' ' ' VAL . . . 82.06 0.71 89.88 Favored Glycine 0 N--CA 1.497 2.717 0 N-CA-C 110.483 -1.047 . . . . 0.0 110.483 -175.766 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 9' ' ' SER . . . . . 0.478 ' OG ' HD12 ' A' ' 25' ' ' ILE . 89.2 p -77.75 141.04 39.52 Favored 'General case' 0 N--CA 1.497 1.889 0 O-C-N 121.079 -1.248 . . . . 0.0 110.514 -178.851 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 10' ' ' ASN . . . . . 0.699 ' CG ' HG22 ' A' ' 24' ' ' VAL . 2.6 m120 -85.08 120.2 26.32 Favored 'General case' 0 N--CA 1.497 1.92 0 O-C-N 121.665 -0.647 . . . . 0.0 109.495 173.532 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 11' ' ' VAL . . . . . 0.71 HG21 HD11 ' A' ' 25' ' ' ILE . 35.5 m -143.5 162.93 16.21 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.78 0 O-C-N 121.715 -0.616 . . . . 0.0 109.566 -178.838 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 12' ' ' GLU . . . . . 0.463 ' HB2' HD11 ' A' ' 58' ' ' LEU . 33.3 tt0 -109.4 127.87 54.7 Favored 'General case' 0 N--CA 1.494 1.729 0 C-N-CA 119.896 -0.722 . . . . 0.0 109.952 177.539 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 13' ' ' VAL . . . . . 0.592 HG22 ' CD2' ' A' ' 55' ' ' LEU . 60.5 t -106.92 124.1 62.4 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.863 0 O-C-N 121.673 -0.642 . . . . 0.0 109.808 -179.67 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 15.4 tp -96.03 125.96 40.94 Favored 'General case' 0 N--CA 1.494 1.749 0 O-C-N 121.761 -0.587 . . . . 0.0 109.47 175.144 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 83.1 mt -97.44 163.17 12.99 Favored 'General case' 0 N--CA 1.498 1.937 0 O-C-N 121.553 -0.717 . . . . 0.0 111.054 -172.594 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 24.9 p30 -59.21 -21.64 59.81 Favored 'General case' 0 N--CA 1.505 2.294 0 O-C-N 121.722 -0.611 . . . . 0.0 111.489 -177.961 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 25.5 p30 -92.19 23.52 3.79 Favored 'General case' 0 N--CA 1.498 1.959 0 O-C-N 121.532 -0.73 . . . . 0.0 110.977 -176.571 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 74.4 m-20 60.18 28.63 18.22 Favored 'General case' 0 N--CA 1.504 2.265 0 O-C-N 121.414 -0.804 . . . . 0.0 110.836 173.07 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 43.2 m -107.99 134.94 50.18 Favored 'General case' 0 N--CA 1.495 1.793 0 O-C-N 121.491 -0.755 . . . . 0.0 109.567 170.395 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 37.4 ttmt -109.64 137.73 47.04 Favored 'General case' 0 N--CA 1.494 1.761 0 O-C-N 121.756 -0.59 . . . . 0.0 110.345 -176.137 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -153.05 158.86 42.58 Favored 'General case' 0 N--CA 1.496 1.836 0 O-C-N 121.686 -0.634 . . . . 0.0 110.498 -179.782 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 22' ' ' ARG . . . . . 0.49 ' O ' HD13 ' A' ' 39' ' ' LEU . 42.9 ptt85 -144.02 150.88 38.92 Favored 'General case' 0 N--CA 1.496 1.836 0 O-C-N 121.683 -0.635 . . . . 0.0 110.5 178.838 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -171.64 171.42 44.06 Favored Glycine 0 N--CA 1.494 2.535 0 N-CA-C 108.872 -1.691 . . . . 0.0 108.872 -174.493 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 24' ' ' VAL . . . . . 0.699 HG22 ' CG ' ' A' ' 10' ' ' ASN . 38.5 t -94.49 117.17 37.58 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.933 0 O-C-N 121.522 -0.987 . . . . 0.0 109.402 -176.519 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 25' ' ' ILE . . . . . 0.71 HD11 HG21 ' A' ' 11' ' ' VAL . 92.0 mt -63.93 143.16 15.94 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.154 0 O-C-N 121.642 -0.661 . . . . 0.0 110.397 -172.157 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 26' ' ' THR . . . . . 0.607 HG21 ' HB2' ' A' ' 38' ' ' ARG . 7.8 p -121.21 -26.76 5.01 Favored 'General case' 0 N--CA 1.495 1.785 0 O-C-N 121.685 -0.634 . . . . 0.0 111.245 -179.669 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 7.6 t30 -161.94 156.9 23.01 Favored 'General case' 0 N--CA 1.5 2.051 0 C-N-CA 118.88 -1.128 . . . . 0.0 111.726 -178.17 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 28' ' ' PHE . . . . . 0.528 ' CE1' HG21 ' A' ' 49' ' ' THR . 62.8 t80 -150.07 123.56 9.07 Favored 'General case' 0 N--CA 1.498 1.949 0 N-CA-C 109.373 -0.602 . . . . 0.0 109.373 170.433 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 17.8 t70 -99.3 127.06 45.26 Favored 'General case' 0 N--CA 1.492 1.638 0 N-CA-C 109.162 -0.681 . . . . 0.0 109.162 -178.541 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 22.6 t -64.68 -43.53 93.23 Favored 'General case' 0 N--CA 1.5 2.044 0 O-C-N 121.72 -0.612 . . . . 0.0 110.907 -174.709 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 21.1 m -59.7 -48.09 83.06 Favored 'General case' 0 N--CA 1.502 2.166 0 O-C-N 121.539 -0.726 . . . . 0.0 110.984 -173.444 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 91.5 m-20 -106.99 -0.31 23.15 Favored 'General case' 0 N--CA 1.498 1.966 0 O-C-N 121.613 -0.679 . . . . 0.0 111.675 -179.364 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 45.2 p 45.26 67.02 0.78 Allowed 'General case' 0 N--CA 1.507 2.391 0 O-C-N 121.494 -0.754 . . . . 0.0 111.212 -174.986 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 34' ' ' ILE . . . . . 0.976 HD12 HG22 ' A' ' 48' ' ' VAL . 41.3 mm -114.48 125.86 71.88 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.963 0 O-C-N 121.629 -0.669 . . . . 0.0 109.213 -176.047 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 10.2 tp -115.75 118.84 34.16 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.604 -0.685 . . . . 0.0 110.416 -169.554 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 99.3 mt-30 -91.38 133.13 35.72 Favored 'General case' 0 N--CA 1.49 1.528 0 N-CA-C 109.381 -0.6 . . . . 0.0 109.381 173.731 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 14.6 mt -117.88 123.8 46.76 Favored 'General case' 0 N--CA 1.494 1.753 0 O-C-N 121.837 -0.539 . . . . 0.0 109.945 175.107 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 38' ' ' ARG . . . . . 0.607 ' HB2' HG21 ' A' ' 26' ' ' THR . 72.5 ttt180 -97.36 105.01 17.08 Favored 'General case' 0 N--CA 1.495 1.813 0 O-C-N 121.672 -0.643 . . . . 0.0 109.783 176.001 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.49 HD13 ' O ' ' A' ' 22' ' ' ARG . 22.0 tp -85.16 154.3 22.1 Favored 'General case' 0 N--CA 1.494 1.765 0 O-C-N 121.716 -0.615 . . . . 0.0 111.075 -173.624 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -65.54 -6.48 10.94 Favored 'General case' 0 N--CA 1.503 2.179 0 O-C-N 121.955 -0.466 . . . . 0.0 112.149 -169.961 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 49.4 p-10 -86.17 29.15 0.76 Allowed 'General case' 0 N--CA 1.5 2.064 0 O-C-N 121.12 -0.987 . . . . 0.0 110.873 174.199 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 74.3 m-20 57.65 29.68 17.66 Favored 'General case' 0 N--CA 1.504 2.24 0 O-C-N 121.252 -0.905 . . . . 0.0 110.36 177.126 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 37.8 m -120.62 137.87 54.2 Favored 'General case' 0 N--CA 1.496 1.852 0 O-C-N 121.458 -0.776 . . . . 0.0 110.397 178.996 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 9.7 t -97.47 150.99 20.45 Favored 'General case' 0 N--CA 1.497 1.878 0 O-C-N 121.76 -0.588 . . . . 0.0 110.222 176.46 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 40.9 tttp -148.61 119.14 7.42 Favored 'General case' 0 N--CA 1.497 1.886 0 O-C-N 121.591 -0.693 . . . . 0.0 110.269 178.05 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 91.0 p -96.59 122.12 39.16 Favored 'General case' 0 N--CA 1.494 1.736 0 O-C-N 121.635 -0.666 . . . . 0.0 110.284 179.027 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 82.8 mt -129.32 133.94 64.65 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.909 0 O-C-N 121.628 -0.67 . . . . 0.0 109.422 178.974 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 48' ' ' VAL . . . . . 0.976 HG22 HD12 ' A' ' 34' ' ' ILE . 60.3 t -82.0 127.9 39.2 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.959 0 C-N-CA 120.103 -0.639 . . . . 0.0 109.404 179.41 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 49' ' ' THR . . . . . 0.528 HG21 ' CE1' ' A' ' 28' ' ' PHE . 37.5 p -57.86 -24.83 59.35 Favored 'General case' 0 N--CA 1.505 2.3 0 O-C-N 121.734 -0.604 . . . . 0.0 112.281 -165.869 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 16.6 pttp -56.14 -22.47 28.74 Favored 'General case' 0 N--CA 1.506 2.337 0 O-C-N 121.515 -0.741 . . . . 0.0 111.238 -176.016 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 10.3 p30 -82.01 -1.06 47.0 Favored 'General case' 0 N--CA 1.5 2.046 0 C-N-CA 119.889 -0.724 . . . . 0.0 111.194 176.398 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 89.6 mt -77.37 130.24 36.48 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.082 0 O-C-N 121.223 -0.923 . . . . 0.0 110.129 177.812 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 40.4 tttp -91.53 -31.73 15.83 Favored 'General case' 0 N--CA 1.494 1.766 0 O-C-N 121.772 -0.58 . . . . 0.0 109.496 168.778 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 5.3 m-20 -164.27 159.64 20.19 Favored 'General case' 0 N--CA 1.5 2.052 0 O-C-N 121.832 -0.542 . . . . 0.0 110.063 -177.869 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 55' ' ' LEU . . . . . 0.592 ' CD2' HG22 ' A' ' 13' ' ' VAL . 83.1 mt -132.99 150.21 52.18 Favored 'General case' 0 N--CA 1.495 1.802 0 O-C-N 121.752 -0.592 . . . . 0.0 110.395 -179.44 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 19.9 ptp180 -150.39 141.39 22.96 Favored 'General case' 0 N--CA 1.495 1.803 0 O-C-N 121.7 -0.625 . . . . 0.0 109.998 175.336 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 57' ' ' ILE . . . . . 0.507 ' HA ' HG12 ' A' ' 11' ' ' VAL . 67.0 mt -85.15 133.21 29.89 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.822 0 O-C-N 121.541 -0.724 . . . . 0.0 109.884 173.702 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 58' ' ' LEU . . . . . 0.463 HD11 ' HB2' ' A' ' 12' ' ' GLU . 25.2 mt -82.11 159.44 65.27 Favored Pre-proline 0 N--CA 1.497 1.901 0 O-C-N 121.652 -0.655 . . . . 0.0 110.095 -179.337 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 22.1 Cg_endo -65.33 149.33 88.44 Favored 'Trans proline' 0 N--CA 1.49 1.286 0 O-C-N 123.736 1.387 . . . . 0.0 110.583 -177.685 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 39.1 tttp -126.4 138.46 53.55 Favored 'General case' 0 N--CA 1.496 1.853 0 O-C-N 121.729 -0.607 . . . . 0.0 110.089 179.724 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 30.4 m120 53.38 -179.22 0.02 OUTLIER 'General case' 0 N--CA 1.506 2.326 0 O-C-N 121.607 -0.683 . . . . 0.0 111.099 -179.85 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 27.8 tp10 -126.78 142.44 51.54 Favored 'General case' 0 N--CA 1.495 1.797 0 O-C-N 121.607 -0.683 . . . . 0.0 110.22 -179.748 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 50.8 mm -68.89 -38.71 79.0 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.055 0 O-C-N 121.626 -0.671 . . . . 0.0 109.816 -179.569 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 64' ' ' MET . . . . . . . . . . . . . 41.3 mtm 55.52 173.01 0.04 OUTLIER Pre-proline 0 N--CA 1.507 2.422 0 O-C-N 121.704 -0.623 . . . . 0.0 111.203 -179.67 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 17.5 Cg_exo -63.72 156.37 57.95 Favored 'Trans proline' 0 N--CA 1.491 1.339 0 O-C-N 123.474 1.249 . . . . 0.0 110.485 179.234 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 74.4 mttt -88.53 134.03 33.98 Favored 'General case' 0 N--CA 1.497 1.918 0 O-C-N 121.721 -0.612 . . . . 0.0 110.08 -179.904 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 91.7 m-20 -132.95 161.19 34.95 Favored 'General case' 0 N--CA 1.496 1.831 0 O-C-N 121.713 -0.617 . . . . 0.0 110.184 -179.742 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . -96.05 53.11 1.63 Allowed Glycine 0 N--CA 1.495 2.598 0 N-CA-C 109.493 -1.443 . . . . 0.0 109.493 179.588 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 69' ' ' THR . . . . . 0.538 ' O ' HG23 ' A' ' 69' ' ' THR . 5.3 t -115.06 84.66 2.12 Favored 'General case' 0 N--CA 1.499 2.024 0 O-C-N 121.684 -0.892 . . . . 0.0 110.345 -179.364 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 55.0 mttm -93.53 154.57 17.81 Favored 'General case' 0 N--CA 1.496 1.86 0 O-C-N 121.63 -0.669 . . . . 0.0 110.17 -179.983 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 4.1 m -68.81 166.49 26.8 Favored Pre-proline 0 N--CA 1.498 1.958 0 O-C-N 121.665 -0.647 . . . . 0.0 110.23 -179.851 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 23.4 Cg_exo -60.63 -31.37 92.09 Favored 'Trans proline' 0 N--CA 1.491 1.364 0 O-C-N 123.662 1.348 . . . . 0.0 110.729 -179.386 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 29.8 t -123.42 134.15 53.99 Favored 'General case' 0 N--CA 1.494 1.74 0 O-C-N 121.64 -0.663 . . . . 0.0 110.204 179.133 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 40.0 p -129.75 162.73 27.75 Favored 'General case' 0 N--CA 1.495 1.8 0 O-C-N 121.693 -0.63 . . . . 0.0 110.179 179.941 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 15.9 t-20 -64.55 -35.54 81.31 Favored 'General case' 0 N--CA 1.5 2.03 0 O-C-N 121.66 -0.65 . . . . 0.0 110.316 179.303 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 30.4 t -118.69 143.57 46.77 Favored 'General case' 0 N--CA 1.494 1.768 0 O-C-N 121.723 -0.611 . . . . 0.0 110.195 179.753 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 40.2 p -121.58 165.35 15.82 Favored 'General case' 0 N--CA 1.496 1.845 0 O-C-N 121.625 -0.672 . . . . 0.0 110.152 -179.915 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 51.2 mttp -63.47 -37.82 88.75 Favored 'General case' 0 N--CA 1.501 2.081 0 O-C-N 121.575 -0.703 . . . . 0.0 110.406 -179.757 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 79' ' ' LEU . . . . . 0.46 ' C ' HD23 ' A' ' 79' ' ' LEU . 7.8 tt -110.22 124.48 51.67 Favored 'General case' 0 N--CA 1.494 1.77 0 O-C-N 121.716 -0.615 . . . . 0.0 110.092 178.901 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 56.2 tttm -137.96 133.73 34.07 Favored 'General case' 0 N--CA 1.495 1.783 0 O-C-N 121.652 -0.655 . . . . 0.0 110.179 -179.778 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 98.5 p -121.56 151.47 40.3 Favored 'General case' 0 N--CA 1.496 1.829 0 O-C-N 121.72 -0.612 . . . . 0.0 110.204 179.229 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -151.04 155.78 39.73 Favored 'General case' 0 N--CA 1.494 1.769 0 O-C-N 121.68 -0.637 . . . . 0.0 110.286 -179.823 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 42.8 tt0 -103.63 145.06 30.6 Favored 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.763 -0.586 . . . . 0.0 110.057 179.561 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 23.7 m -107.15 141.79 37.87 Favored 'General case' 0 N--CA 1.495 1.803 0 O-C-N 121.665 -0.647 . . . . 0.0 110.295 -178.807 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 96.9 m-85 -117.14 154.73 30.55 Favored 'General case' 0 N--CA 1.496 1.85 0 O-C-N 121.677 -0.639 . . . . 0.0 110.128 179.876 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 49.6 m -112.19 143.02 43.94 Favored 'General case' 0 N--CA 1.495 1.799 0 O-C-N 121.693 -0.629 . . . . 0.0 110.081 179.469 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 81.6 p -103.89 -56.49 2.19 Favored 'General case' 0 N--CA 1.495 1.775 0 O-C-N 121.678 -0.639 . . . . 0.0 110.425 -178.761 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 73.1 mttt -114.67 135.39 54.2 Favored 'General case' 0 N--CA 1.496 1.838 0 O-C-N 121.642 -0.661 . . . . 0.0 110.331 -178.631 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 91.8 m-20 -135.44 31.06 3.17 Favored 'General case' 0 N--CA 1.496 1.866 0 O-C-N 121.667 -0.646 . . . . 0.0 110.327 178.595 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -110.24 32.38 5.19 Favored 'General case' 0 N--CA 1.495 1.821 0 O-C-N 121.613 -0.679 . . . . 0.0 110.286 -178.975 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 91' ' ' TRP . . . . . . . . . . . . . 97.1 m95 -87.98 -54.07 4.42 Favored 'General case' 0 N--CA 1.498 1.953 0 O-C-N 121.61 -0.681 . . . . 0.0 110.178 -179.701 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 28.7 t -135.42 142.11 45.57 Favored 'General case' 0 N--CA 1.495 1.789 0 O-C-N 121.611 -0.68 . . . . 0.0 110.246 -179.965 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 93' ' ' MET . . . . . . . . . . . . . 65.5 mtt -65.95 -34.86 79.07 Favored 'General case' 0 N--CA 1.5 2.057 0 O-C-N 121.628 -0.67 . . . . 0.0 110.289 179.558 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 17.2 t70 . . . . . 0 N--CA 1.495 1.782 0 CA-C-O 118.021 -0.99 . . . . 0.0 110.138 -179.976 . . . . . . . . 0 0 . 1 . 016 nuclear build full ' B' B ' 240' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.217 0 N-CA-C 109.585 -1.406 . . . . 0.0 109.585 . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' B' B ' 241' ' ' ALA . . . . . . . . . . . . . . . -67.49 -34.06 76.38 Favored 'General case' 0 N--CA 1.499 1.975 0 O-C-N 121.687 -0.89 . . . . 0.0 110.222 -179.874 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 242' ' ' THR . . . . . . . . . . . . . 24.5 m -66.6 -39.19 88.28 Favored 'General case' 0 N--CA 1.499 2.022 0 O-C-N 121.627 -0.671 . . . . 0.0 110.211 179.941 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 243' ' ' THR . . . . . . . . . . . . . 15.6 m 51.9 83.61 0.05 Allowed 'General case' 0 N--CA 1.506 2.326 0 O-C-N 121.63 -0.669 . . . . 0.0 111.027 -179.513 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 244' ' ' LYS . . . . . . . . . . . . . 67.9 tttt -66.31 -44.25 83.97 Favored 'General case' 0 N--CA 1.501 2.079 0 O-C-N 121.611 -0.681 . . . . 0.0 110.306 -179.976 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 245' ' ' GLU . . . . . . . . . . . . . 46.3 mt-10 -136.4 143.32 43.92 Favored 'General case' 0 N--CA 1.494 1.762 0 O-C-N 121.65 -0.656 . . . . 0.0 110.197 179.646 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 246' ' ' LYS . . . . . . . . . . . . . 33.6 tttp -107.67 30.14 6.57 Favored 'General case' 0 N--CA 1.497 1.884 0 O-C-N 121.744 -0.598 . . . . 0.0 110.322 179.203 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 247' ' ' ASN . . . . . . . . . . . . . 41.9 t-20 -131.83 126.62 34.76 Favored 'General case' 0 N--CA 1.495 1.822 0 O-C-N 121.635 -0.665 . . . . 0.0 110.161 -179.676 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 248' ' ' ILE . . . . . . . . . . . . . 10.4 tt -162.75 49.15 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.497 1.894 0 O-C-N 121.648 -0.658 . . . . 0.0 110.041 179.908 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 249' ' ' SER . . . . . . . . . . . . . 60.0 p -153.17 -61.02 0.14 Allowed 'General case' 0 N--CA 1.495 1.8 0 O-C-N 121.594 -0.691 . . . . 0.0 110.278 179.833 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 250' ' ' VAL . . . . . 0.479 ' CG1' HG22 ' B' ' 252' ' ' VAL . 61.9 t -90.17 133.67 31.4 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.946 0 O-C-N 121.595 -0.69 . . . . 0.0 109.824 -179.471 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 251' ' ' ASP . . . . . . . . . . . . . 74.4 m-20 -79.99 -32.23 39.78 Favored 'General case' 0 N--CA 1.499 2.024 0 O-C-N 121.716 -0.615 . . . . 0.0 110.305 179.467 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 252' ' ' VAL . . . . . 0.479 HG22 ' CG1' ' B' ' 250' ' ' VAL . 35.3 m -78.86 -165.88 0.07 OUTLIER 'Isoleucine or valine' 0 N--CA 1.501 2.107 0 O-C-N 121.67 -0.644 . . . . 0.0 110.091 179.948 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 253' ' ' ASP . . . . . . . . . . . . . 9.8 p-10 -160.54 75.14 0.55 Allowed 'General case' 0 N--CA 1.496 1.848 0 O-C-N 121.561 -0.712 . . . . 0.0 110.275 -179.704 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 254' ' ' ALA . . . . . . . . . . . . . . . -66.89 -24.61 66.13 Favored 'General case' 0 N--CA 1.501 2.118 0 O-C-N 121.626 -0.672 . . . . 0.0 110.774 179.465 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 255' ' ' ASP . . . . . . . . . . . . . 74.4 m-20 -70.94 -32.45 69.35 Favored 'General case' 0 N--CA 1.499 2.003 0 O-C-N 121.468 -0.77 . . . . 0.0 110.147 -177.975 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 256' ' ' ALA . . . . . . . . . . . . . . . -65.27 -49.96 67.57 Favored 'General case' 0 N--CA 1.501 2.089 0 O-C-N 121.649 -0.657 . . . . 0.0 110.173 177.58 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 257' ' ' SER . . . . . . . . . . . . . 44.9 t -57.18 -40.62 77.69 Favored 'General case' 0 N--CA 1.502 2.16 0 O-C-N 121.636 -0.665 . . . . 0.0 110.563 178.702 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 258' ' ' SER . . . . . . . . . . . . . 83.9 p -69.54 -30.76 68.66 Favored 'General case' 0 N--CA 1.498 1.945 0 C-N-CA 120.359 -0.536 . . . . 0.0 110.295 -178.724 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 259' ' ' GLN . . . . . . . . . . . . . 46.4 tt0 -63.25 -37.81 88.7 Favored 'General case' 0 N--CA 1.501 2.091 0 O-C-N 121.614 -0.679 . . . . 0.0 110.378 179.373 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 260' ' ' LEU . . . . . 0.504 ' HA ' HD12 ' B' ' 263' ' ' LEU . 83.3 mt -66.09 -42.45 89.28 Favored 'General case' 0 N--CA 1.5 2.041 0 O-C-N 121.67 -0.644 . . . . 0.0 110.249 179.627 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 261' ' ' LEU . . . . . 0.436 HD12 HD12 ' A' ' 55' ' ' LEU . 22.5 tp -70.32 -38.14 74.84 Favored 'General case' 0 N--CA 1.497 1.921 0 O-C-N 121.679 -0.638 . . . . 0.0 109.772 176.292 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 262' ' ' SER . . . . . . . . . . . . . 69.7 m -62.51 -35.87 80.75 Favored 'General case' 0 N--CA 1.501 2.097 0 O-C-N 121.767 -0.583 . . . . 0.0 110.533 176.916 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 263' ' ' LEU . . . . . 0.504 HD12 ' HA ' ' B' ' 260' ' ' LEU . 21.4 mt -64.59 -42.77 95.36 Favored 'General case' 0 N--CA 1.501 2.116 0 O-C-N 121.602 -0.686 . . . . 0.0 110.235 -179.822 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 264' ' ' LEU . . . . . . . . . . . . . 86.5 mt -62.48 -36.34 82.18 Favored 'General case' 0 N--CA 1.502 2.129 0 O-C-N 121.702 -0.623 . . . . 0.0 110.435 177.938 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 265' ' ' LYS . . . . . . . . . . . . . 28.1 mtpt -76.51 -26.68 55.52 Favored 'General case' 0 N--CA 1.498 1.937 0 O-C-N 121.799 -0.563 . . . . 0.0 110.539 179.068 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 266' ' ' SER . . . . . . . . . . . . . 32.6 m 52.32 32.46 11.05 Favored 'General case' 0 N--CA 1.506 2.333 0 O-C-N 121.485 -0.759 . . . . 0.0 110.986 -179.367 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 267' ' ' SER . . . . . . . . . . . . . 92.1 p -128.22 159.6 34.71 Favored 'General case' 0 N--CA 1.495 1.796 0 O-C-N 121.676 -0.64 . . . . 0.0 110.066 178.882 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 268' ' ' THR . . . . . 0.433 HG22 ' H ' ' B' ' 269' ' ' ALA . 3.1 m 56.96 172.7 0.04 OUTLIER 'General case' 0 N--CA 1.508 2.464 0 O-C-N 121.557 -0.714 . . . . 0.0 110.645 -179.0 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 269' ' ' ALA . . . . . 0.755 ' HB3' ' HD3' ' B' ' 270' ' ' PRO . . . -170.18 -60.82 0.0 OUTLIER Pre-proline 0 N--CA 1.499 1.998 0 O-C-N 121.48 -0.762 . . . . 0.0 110.423 179.723 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 270' ' ' PRO . . . . . 0.755 ' HD3' ' HB3' ' B' ' 269' ' ' ALA . 29.9 Cg_endo -68.09 125.58 13.24 Favored 'Trans proline' 0 N--CA 1.488 1.194 0 O-C-N 123.151 1.08 . . . . 0.0 110.327 179.676 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 271' ' ' SER . . . . . . . . . . . . . 89.1 p -68.49 -32.25 72.1 Favored 'General case' 0 N--CA 1.5 2.026 0 O-C-N 121.736 -0.602 . . . . 0.0 110.351 179.928 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 272' ' ' ASP . . . . . . . . . . . . . 20.0 t70 -95.95 143.39 27.18 Favored 'General case' 0 N--CA 1.495 1.805 0 O-C-N 121.652 -0.655 . . . . 0.0 110.176 -179.687 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 273' ' ' LEU . . . . . 0.412 ' HA ' HD22 ' B' ' 273' ' ' LEU . 0.2 OUTLIER 53.52 95.93 0.02 OUTLIER 'General case' 0 N--CA 1.506 2.345 0 O-C-N 121.67 -0.644 . . . . 0.0 111.008 179.953 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' B' B ' 274' ' ' ALA . . . . . . . . . . . . . . . -166.0 119.24 1.12 Allowed 'General case' 0 N--CA 1.496 1.838 0 O-C-N 121.588 -0.695 . . . . 0.0 110.071 179.669 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 275' ' ' THR . . . . . . . . . . . . . 35.6 p -127.39 92.19 44.12 Favored Pre-proline 0 N--CA 1.495 1.814 0 O-C-N 121.783 -0.573 . . . . 0.0 110.198 -179.578 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 276' ' ' PRO . . . . . . . . . . . . . 22.5 Cg_endo -66.1 -25.39 51.12 Favored 'Trans proline' 0 N--CA 1.489 1.225 0 O-C-N 123.542 1.285 . . . . 0.0 111.168 -179.18 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 277' ' ' GLN . . . . . . . . . . . . . 3.9 mp0 -62.81 -58.74 15.08 Favored Pre-proline 0 N--CA 1.502 2.128 0 O-C-N 121.258 -0.901 . . . . 0.0 110.811 -177.243 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 278' ' ' PRO . . . . . . . . . . . . . 30.8 Cg_endo -68.16 -31.29 29.89 Favored 'Trans proline' 0 N--CA 1.488 1.189 0 O-C-N 123.148 1.078 . . . . 0.0 110.535 179.296 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 279' ' ' SER . . . . . . . . . . . . . 49.0 m -68.01 160.19 29.23 Favored 'General case' 0 N--CA 1.499 1.995 0 O-C-N 121.594 -0.691 . . . . 0.0 110.283 -179.851 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 280' ' ' THR . . . . . . . . . . . . . 9.9 t -130.62 164.85 24.06 Favored 'General case' 0 N--CA 1.498 1.935 0 O-C-N 121.666 -0.646 . . . . 0.0 110.302 -179.492 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 281' ' ' PHE . . . . . 0.418 ' CB ' ' CD ' ' B' ' 282' ' ' PRO . 2.9 m-85 -166.92 -61.62 0.01 OUTLIER Pre-proline 0 N--CA 1.498 1.959 0 O-C-N 121.677 -0.64 . . . . 0.0 110.543 -178.11 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 282' ' ' PRO . . . . . 0.418 ' CD ' ' CB ' ' B' ' 281' ' ' PHE . 28.2 Cg_endo -66.95 -30.27 39.82 Favored 'Trans proline' 0 N--CA 1.49 1.315 0 O-C-N 123.145 1.076 . . . . 0.0 110.829 -179.328 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 283' ' ' GLN . . . . . . . . . . . . . 28.2 mt-30 -65.8 -57.95 12.63 Favored Pre-proline 0 N--CA 1.5 2.033 0 O-C-N 121.483 -0.76 . . . . 0.0 110.679 -177.831 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 284' ' ' PRO . . . . . . . . . . . . . 32.4 Cg_endo -68.91 162.66 40.61 Favored 'Trans proline' 0 N--CA 1.488 1.151 0 O-C-N 123.183 1.096 . . . . 0.0 110.251 178.838 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 285' ' ' PRO . . . . . . . . . . . . . 21.4 Cg_exo -61.7 139.98 83.74 Favored 'Trans proline' 0 N--CA 1.49 1.288 0 O-C-N 123.573 1.302 . . . . 0.0 110.64 -179.83 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 286' ' ' VAL . . . . . . . . . . . . . 12.6 p -134.42 144.19 35.82 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.882 0 O-C-N 121.783 -0.573 . . . . 0.0 110.198 179.989 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 287' ' ' GLU . . . . . . . . . . . . . 54.5 mt-10 -102.16 147.08 27.06 Favored 'General case' 0 N--CA 1.495 1.776 0 O-C-N 121.712 -0.618 . . . . 0.0 110.244 179.69 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 288' ' ' SER . . . . . . . . . . . . . 30.2 t -125.62 143.94 50.8 Favored 'General case' 0 N--CA 1.497 1.89 0 O-C-N 121.78 -0.575 . . . . 0.0 110.206 -179.807 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 289' ' ' HIS . . . . . . . . . . . . . 48.5 p-80 -125.33 145.9 49.82 Favored 'General case' 0 N--CA 1.497 1.891 0 O-C-N 121.658 -0.651 . . . . 0.0 110.256 179.762 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 290' ' ' SER . . . . . . . . . . . . . 49.5 m -120.05 148.0 44.12 Favored 'General case' 0 N--CA 1.495 1.808 0 O-C-N 121.685 -0.634 . . . . 0.0 110.227 -179.839 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 291' ' ' SER . . . . . . . . . . . . . 9.0 t . . . . . 0 N--CA 1.494 1.764 0 CA-C-O 118.038 -0.982 . . . . 0.0 110.203 -179.982 . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' -1' ' ' MET . . . . . . . . . . . . . 85.4 mtp . . . . . 0 N--CA 1.494 1.757 0 CA-C-O 120.991 0.424 . . . . 0.0 110.145 . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 0' ' ' GLY . . . . . . . . . . . . . . . -143.32 -126.33 2.01 Favored Glycine 0 N--CA 1.494 2.558 0 N-CA-C 109.509 -1.436 . . . . 0.0 109.509 -179.962 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 65.3 mtt -105.92 147.86 28.29 Favored 'General case' 0 N--CA 1.495 1.782 0 O-C-N 121.674 -0.898 . . . . 0.0 110.275 179.938 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 68.4 m -100.98 172.46 7.01 Favored 'General case' 0 N--CA 1.495 1.782 0 O-C-N 121.774 -0.579 . . . . 0.0 110.256 -179.651 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 3' ' ' VAL . . . . . 0.437 HG12 ' CE1' ' A' ' 7' ' ' TYR . 67.3 t -66.45 -27.78 41.4 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.085 0 O-C-N 121.676 -0.64 . . . . 0.0 110.379 -178.98 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -54.91 -30.67 58.9 Favored 'General case' 0 N--CA 1.505 2.296 0 O-C-N 121.451 -0.781 . . . . 0.0 110.538 -177.906 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 74.5 m-20 -69.01 -30.55 68.95 Favored 'General case' 0 N--CA 1.499 1.982 0 O-C-N 121.827 -0.546 . . . . 0.0 110.321 175.018 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 97.2 m-85 -95.49 10.12 37.64 Favored 'General case' 0 N--CA 1.497 1.898 0 O-C-N 121.628 -0.67 . . . . 0.0 111.512 -178.208 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 7' ' ' TYR . . . . . 0.437 ' CE1' HG12 ' A' ' 3' ' ' VAL . 3.8 m-30 -67.18 140.25 57.46 Favored 'General case' 0 N--CA 1.502 2.156 0 O-C-N 121.158 -0.964 . . . . 0.0 110.134 174.735 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 83.15 -2.04 87.66 Favored Glycine 0 N--CA 1.498 2.79 0 N-CA-C 110.67 -0.972 . . . . 0.0 110.67 -176.118 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 67.1 m -75.31 140.95 43.43 Favored 'General case' 0 N--CA 1.497 1.902 0 O-C-N 121.11 -1.229 . . . . 0.0 110.554 -179.536 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 10' ' ' ASN . . . . . 0.695 ' OD1' HG22 ' A' ' 24' ' ' VAL . 4.3 m-80 -85.63 117.82 24.76 Favored 'General case' 0 N--CA 1.497 1.893 0 N-CA-C 109.492 -0.558 . . . . 0.0 109.492 173.525 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 11' ' ' VAL . . . . . 0.48 HG12 ' HA ' ' A' ' 57' ' ' ILE . 35.3 m -142.55 162.32 18.52 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.889 0 O-C-N 121.675 -0.641 . . . . 0.0 109.746 179.591 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 12' ' ' GLU . . . . . 0.617 ' HB2' HD11 ' A' ' 58' ' ' LEU . 45.3 tt0 -109.41 129.98 55.52 Favored 'General case' 0 N--CA 1.492 1.65 0 C-N-CA 119.851 -0.74 . . . . 0.0 109.887 176.069 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 13' ' ' VAL . . . . . 0.566 HG22 ' CD2' ' A' ' 55' ' ' LEU . 60.3 t -106.74 125.58 62.67 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.714 0 O-C-N 121.725 -0.61 . . . . 0.0 109.831 179.731 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.473 HD13 ' HG2' ' A' ' 20' ' ' LYS . 28.6 tp -95.82 126.28 40.97 Favored 'General case' 0 N--CA 1.493 1.707 0 N-CA-C 109.128 -0.693 . . . . 0.0 109.128 175.225 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 87.1 mt -95.85 168.05 10.88 Favored 'General case' 0 N--CA 1.496 1.839 0 O-C-N 121.689 -0.632 . . . . 0.0 111.087 -172.989 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 24.3 p30 -58.15 -21.86 48.77 Favored 'General case' 0 N--CA 1.507 2.39 0 O-C-N 121.835 -0.54 . . . . 0.0 111.583 -176.896 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 44.0 p-10 -92.2 22.79 4.19 Favored 'General case' 0 N--CA 1.498 1.973 0 O-C-N 121.561 -0.712 . . . . 0.0 110.968 -176.636 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 74.3 m-20 58.75 27.52 16.08 Favored 'General case' 0 N--CA 1.505 2.298 0 O-C-N 121.364 -0.835 . . . . 0.0 110.662 175.77 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 51.1 m -106.86 142.01 37.17 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.473 -0.767 . . . . 0.0 109.568 172.645 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 20' ' ' LYS . . . . . 0.473 ' HG2' HD13 ' A' ' 14' ' ' LEU . 94.6 mttt -109.62 146.42 34.78 Favored 'General case' 0 N--CA 1.496 1.83 0 O-C-N 121.611 -0.681 . . . . 0.0 110.646 -176.183 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -153.11 151.16 29.86 Favored 'General case' 0 N--CA 1.497 1.877 0 O-C-N 121.825 -0.547 . . . . 0.0 109.991 175.277 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 22' ' ' ARG . . . . . 0.489 ' O ' HD13 ' A' ' 39' ' ' LEU . 31.0 ptt180 -140.02 146.17 38.69 Favored 'General case' 0 N--CA 1.499 2.001 0 O-C-N 121.568 -0.707 . . . . 0.0 110.654 -179.853 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -171.77 171.49 44.13 Favored Glycine 0 N--CA 1.495 2.609 0 N-CA-C 108.768 -1.733 . . . . 0.0 108.768 -174.378 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 24' ' ' VAL . . . . . 0.695 HG22 ' OD1' ' A' ' 10' ' ' ASN . 25.2 t -94.55 120.1 43.48 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.907 0 O-C-N 121.49 -1.006 . . . . 0.0 109.34 -176.119 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 25' ' ' ILE . . . . . 0.458 HD11 HG21 ' A' ' 11' ' ' VAL . 87.2 mt -63.45 143.33 15.72 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.24 0 O-C-N 121.479 -0.763 . . . . 0.0 110.462 -172.729 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 26' ' ' THR . . . . . 0.624 HG21 ' HB2' ' A' ' 38' ' ' ARG . 6.7 p -121.15 -28.73 4.67 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.671 -0.643 . . . . 0.0 111.329 179.079 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 26.9 t30 -161.97 158.78 25.67 Favored 'General case' 0 N--CA 1.499 2.004 0 O-C-N 120.985 -1.072 . . . . 0.0 111.661 -177.095 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 28' ' ' PHE . . . . . 0.519 ' HE1' HG21 ' A' ' 49' ' ' THR . 84.3 t80 -150.08 126.86 11.03 Favored 'General case' 0 N--CA 1.497 1.882 0 N-CA-C 109.132 -0.692 . . . . 0.0 109.132 170.78 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 21.3 t70 -100.53 130.92 46.67 Favored 'General case' 0 N--CA 1.491 1.581 0 N-CA-C 109.04 -0.726 . . . . 0.0 109.04 -176.772 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 20.9 m -69.29 -49.99 50.87 Favored 'General case' 0 N--CA 1.498 1.946 0 C-N-CA 120.062 -0.655 . . . . 0.0 110.504 -176.679 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 22.6 m -59.76 -42.72 93.88 Favored 'General case' 0 N--CA 1.502 2.135 0 O-C-N 121.648 -0.658 . . . . 0.0 110.84 -174.478 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 29.6 m120 -103.71 -10.1 18.61 Favored 'General case' 0 N--CA 1.496 1.873 0 O-C-N 121.667 -0.646 . . . . 0.0 111.553 -178.069 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 1.8 m 49.88 67.38 0.91 Allowed 'General case' 0 N--CA 1.507 2.424 0 O-C-N 121.103 -0.998 . . . . 0.0 110.87 -174.795 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 34' ' ' ILE . . . . . 1.106 HD12 HG22 ' A' ' 48' ' ' VAL . 47.4 mm -125.43 126.86 71.25 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.006 0 O-C-N 121.557 -0.715 . . . . 0.0 109.469 -176.061 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.422 HD12 ' HB2' ' A' ' 28' ' ' PHE . 6.7 tp -115.85 120.03 37.93 Favored 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.678 -0.639 . . . . 0.0 110.335 -169.237 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 99.5 mt-30 -90.98 134.68 34.29 Favored 'General case' 0 N--CA 1.492 1.63 0 C-N-CA 120.268 -0.573 . . . . 0.0 109.477 175.386 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 0.442 HD23 ' HA ' ' A' ' 25' ' ' ILE . 17.2 mt -117.82 123.87 46.98 Favored 'General case' 0 N--CA 1.495 1.781 0 O-C-N 121.854 -0.529 . . . . 0.0 110.023 174.818 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 38' ' ' ARG . . . . . 0.624 ' HB2' HG21 ' A' ' 26' ' ' THR . 74.9 ttt-85 -97.26 108.5 21.25 Favored 'General case' 0 N--CA 1.497 1.88 0 O-C-N 121.756 -0.59 . . . . 0.0 109.778 175.215 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.489 HD13 ' O ' ' A' ' 22' ' ' ARG . 17.8 tp -85.28 151.67 23.88 Favored 'General case' 0 N--CA 1.495 1.797 0 O-C-N 121.703 -0.623 . . . . 0.0 110.981 -174.206 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -62.99 -9.25 9.31 Favored 'General case' 0 N--CA 1.503 2.193 0 O-C-N 121.965 -0.459 . . . . 0.0 111.895 -172.668 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 30.1 m120 -85.38 29.05 0.69 Allowed 'General case' 0 N--CA 1.499 1.981 0 O-C-N 121.086 -1.009 . . . . 0.0 110.95 174.33 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 74.4 m-20 59.33 31.15 20.92 Favored 'General case' 0 N--CA 1.505 2.302 0 O-C-N 121.136 -0.978 . . . . 0.0 110.366 174.378 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 48.7 m -122.81 137.93 54.79 Favored 'General case' 0 N--CA 1.495 1.795 0 O-C-N 121.42 -0.8 . . . . 0.0 110.395 179.121 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 9.0 t -97.19 149.41 22.04 Favored 'General case' 0 N--CA 1.498 1.949 0 O-C-N 121.814 -0.554 . . . . 0.0 110.233 176.77 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 74.7 tttt -149.89 119.2 6.83 Favored 'General case' 0 N--CA 1.494 1.755 0 O-C-N 121.602 -0.687 . . . . 0.0 110.255 178.515 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 88.7 p -95.0 123.97 38.78 Favored 'General case' 0 N--CA 1.496 1.828 0 O-C-N 121.694 -0.629 . . . . 0.0 110.175 179.214 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 82.4 mt -129.32 134.47 63.71 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.9 0 N-CA-C 109.246 -0.649 . . . . 0.0 109.246 -179.967 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 48' ' ' VAL . . . . . 1.106 HG22 HD12 ' A' ' 34' ' ' ILE . 63.1 t -82.11 127.59 39.49 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.891 0 O-C-N 121.574 -0.704 . . . . 0.0 109.268 179.668 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 49' ' ' THR . . . . . 0.519 HG21 ' HE1' ' A' ' 28' ' ' PHE . 38.6 p -59.97 -24.93 64.82 Favored 'General case' 0 N--CA 1.503 2.216 0 O-C-N 121.592 -0.692 . . . . 0.0 112.065 -171.141 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 80.8 mttt -56.82 -25.29 55.65 Favored 'General case' 0 N--CA 1.502 2.174 0 O-C-N 121.445 -0.784 . . . . 0.0 111.03 -176.405 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 6.3 p30 -84.62 5.2 28.91 Favored 'General case' 0 N--CA 1.498 1.947 0 C-N-CA 119.726 -0.79 . . . . 0.0 111.441 176.318 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 98.6 mt -75.56 127.94 37.12 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.146 0 O-C-N 121.136 -0.977 . . . . 0.0 109.92 175.972 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 40.0 tttp -91.92 -32.76 15.15 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.782 -0.573 . . . . 0.0 109.528 168.942 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -161.46 156.82 24.12 Favored 'General case' 0 N--CA 1.499 1.977 0 O-C-N 121.76 -0.587 . . . . 0.0 109.958 -176.936 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 55' ' ' LEU . . . . . 0.566 ' CD2' HG22 ' A' ' 13' ' ' VAL . 86.2 mt -133.05 150.09 52.14 Favored 'General case' 0 N--CA 1.497 1.922 0 O-C-N 121.639 -0.663 . . . . 0.0 110.517 -179.425 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 20.1 ptp180 -151.86 142.85 23.09 Favored 'General case' 0 N--CA 1.495 1.81 0 O-C-N 121.741 -0.599 . . . . 0.0 110.065 175.518 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 57' ' ' ILE . . . . . 0.48 ' HA ' HG12 ' A' ' 11' ' ' VAL . 66.5 mt -86.49 133.19 30.41 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.912 0 O-C-N 121.558 -0.714 . . . . 0.0 109.835 173.428 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 58' ' ' LEU . . . . . 0.617 HD11 ' HB2' ' A' ' 12' ' ' GLU . 50.8 mt -85.19 123.18 73.64 Favored Pre-proline 0 N--CA 1.497 1.924 0 O-C-N 121.583 -0.698 . . . . 0.0 110.091 179.41 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 29.4 Cg_endo -67.95 150.82 78.25 Favored 'Trans proline' 0 N--CA 1.487 1.13 0 O-C-N 123.233 1.122 . . . . 0.0 110.19 176.744 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 60.0 mttm -88.18 139.06 30.89 Favored 'General case' 0 N--CA 1.497 1.877 0 O-C-N 121.657 -0.652 . . . . 0.0 110.147 -179.676 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 90.8 m-20 -65.25 -38.39 90.19 Favored 'General case' 0 N--CA 1.5 2.028 0 O-C-N 121.737 -0.602 . . . . 0.0 110.415 -179.095 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 78.3 mt-10 52.01 -166.43 0.05 Allowed 'General case' 0 N--CA 1.507 2.404 0 O-C-N 121.647 -0.658 . . . . 0.0 110.828 179.983 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 33.5 pt -105.67 147.66 11.07 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.969 0 O-C-N 121.521 -0.737 . . . . 0.0 110.096 178.113 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 64' ' ' MET . . . . . . . . . . . . . 36.6 ttm 51.65 56.68 16.38 Favored Pre-proline 0 N--CA 1.506 2.326 0 O-C-N 121.596 -0.69 . . . . 0.0 110.663 -176.517 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 29.3 Cg_endo -67.39 155.29 71.01 Favored 'Trans proline' 0 N--CA 1.488 1.193 0 O-C-N 123.543 1.286 . . . . 0.0 110.537 -177.986 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 18.6 tptm 54.02 57.19 6.19 Favored 'General case' 0 N--CA 1.506 2.343 0 O-C-N 121.621 -0.674 . . . . 0.0 110.856 179.072 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 16.4 t-20 -63.28 -40.2 96.71 Favored 'General case' 0 N--CA 1.501 2.122 0 O-C-N 121.434 -0.791 . . . . 0.0 110.268 179.171 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . -95.98 179.45 35.32 Favored Glycine 0 N--CA 1.495 2.568 0 N-CA-C 109.284 -1.527 . . . . 0.0 109.284 177.888 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 9.8 t -138.38 147.49 43.46 Favored 'General case' 0 N--CA 1.496 1.867 0 O-C-N 121.659 -0.906 . . . . 0.0 110.421 179.444 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 60.1 tttt -107.51 -44.97 4.16 Favored 'General case' 0 N--CA 1.495 1.781 0 O-C-N 121.75 -0.593 . . . . 0.0 110.089 178.713 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 20.9 m 53.1 65.14 6.17 Favored Pre-proline 0 N--CA 1.504 2.256 0 O-C-N 121.61 -0.681 . . . . 0.0 110.902 179.625 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 27.9 Cg_endo -67.08 145.45 73.4 Favored 'Trans proline' 0 N--CA 1.489 1.212 0 O-C-N 123.416 1.219 . . . . 0.0 110.297 178.486 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 26.1 t -110.75 28.99 8.15 Favored 'General case' 0 N--CA 1.497 1.885 0 O-C-N 121.698 -0.626 . . . . 0.0 110.615 -179.17 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 24.4 m -68.81 -42.96 76.56 Favored 'General case' 0 N--CA 1.499 2.023 0 O-C-N 121.514 -0.741 . . . . 0.0 110.071 179.029 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 91.6 m-20 -131.84 143.9 50.51 Favored 'General case' 0 N--CA 1.495 1.815 0 O-C-N 121.735 -0.603 . . . . 0.0 110.136 179.193 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 50.6 m -121.84 146.17 47.35 Favored 'General case' 0 N--CA 1.495 1.813 0 O-C-N 121.716 -0.615 . . . . 0.0 110.201 -179.716 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 40.0 p -124.45 155.51 38.76 Favored 'General case' 0 N--CA 1.496 1.828 0 O-C-N 121.71 -0.619 . . . . 0.0 110.213 179.319 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 72.1 mttt -97.91 -40.05 8.68 Favored 'General case' 0 N--CA 1.495 1.797 0 O-C-N 121.71 -0.619 . . . . 0.0 110.284 179.993 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 15.1 tp -106.59 137.45 44.57 Favored 'General case' 0 N--CA 1.494 1.775 0 O-C-N 121.707 -0.62 . . . . 0.0 110.246 -179.014 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 96.4 mttt -82.51 155.04 24.76 Favored 'General case' 0 N--CA 1.497 1.881 0 O-C-N 121.59 -0.694 . . . . 0.0 110.01 178.747 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 48.7 m -114.08 140.11 48.74 Favored 'General case' 0 N--CA 1.495 1.81 0 O-C-N 121.629 -0.67 . . . . 0.0 110.309 -178.612 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -163.17 -63.17 0.04 OUTLIER 'General case' 0 N--CA 1.495 1.807 0 O-C-N 121.72 -0.612 . . . . 0.0 109.944 178.749 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 35.6 tt0 -127.54 141.4 51.66 Favored 'General case' 0 N--CA 1.495 1.781 0 O-C-N 121.723 -0.611 . . . . 0.0 109.977 178.025 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 36.9 p -103.46 30.05 5.24 Favored 'General case' 0 N--CA 1.496 1.85 0 O-C-N 121.629 -0.669 . . . . 0.0 110.586 -177.665 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 57.5 t80 -142.04 128.65 20.29 Favored 'General case' 0 N--CA 1.493 1.711 0 O-C-N 121.507 -0.745 . . . . 0.0 110.304 179.822 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 50.2 m -130.87 146.78 52.4 Favored 'General case' 0 N--CA 1.495 1.816 0 O-C-N 121.689 -0.632 . . . . 0.0 110.195 179.057 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 2.9 m -154.98 -67.45 0.13 Allowed 'General case' 0 N--CA 1.495 1.786 0 O-C-N 121.664 -0.648 . . . . 0.0 110.256 179.339 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 56.6 tttt -162.17 34.17 0.12 Allowed 'General case' 0 N--CA 1.494 1.753 0 O-C-N 121.58 -0.7 . . . . 0.0 110.135 179.884 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 89.2 m-20 53.21 40.32 31.08 Favored 'General case' 0 N--CA 1.505 2.319 0 O-C-N 121.477 -0.764 . . . . 0.0 110.87 179.905 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 52.1 mtmt -65.45 -34.98 79.56 Favored 'General case' 0 N--CA 1.499 2.019 0 O-C-N 121.59 -0.694 . . . . 0.0 110.443 -179.143 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 91' ' ' TRP . . . . . . . . . . . . . 12.7 m-90 -84.27 -53.38 5.53 Favored 'General case' 0 N--CA 1.497 1.919 0 O-C-N 121.701 -0.624 . . . . 0.0 110.321 -178.814 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 29.4 t -125.83 132.75 52.17 Favored 'General case' 0 N--CA 1.496 1.837 0 O-C-N 121.598 -0.689 . . . . 0.0 110.241 179.935 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 93' ' ' MET . . . . . . . . . . . . . 65.4 mtt -67.13 -35.66 80.21 Favored 'General case' 0 N--CA 1.499 2.018 0 O-C-N 121.624 -0.672 . . . . 0.0 110.296 179.954 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 3.8 p30 . . . . . 0 N--CA 1.496 1.872 0 CA-C-O 117.954 -1.022 . . . . 0.0 110.28 -179.637 . . . . . . . . 0 0 . 1 . 017 nuclear build full ' B' B ' 240' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.325 0 N-CA-C 109.517 -1.433 . . . . 0.0 109.517 . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' B' B ' 241' ' ' ALA . . . . . . . . . . . . . . . -69.64 145.75 52.2 Favored 'General case' 0 N--CA 1.498 1.956 0 O-C-N 121.714 -0.874 . . . . 0.0 110.118 179.969 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 242' ' ' THR . . . . . . . . . . . . . 38.1 p -107.33 29.88 6.74 Favored 'General case' 0 N--CA 1.495 1.82 0 O-C-N 121.696 -0.627 . . . . 0.0 110.495 -179.741 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 243' ' ' THR . . . . . . . . . . . . . 9.8 t -136.14 152.6 50.99 Favored 'General case' 0 N--CA 1.496 1.847 0 O-C-N 121.567 -0.708 . . . . 0.0 110.336 179.855 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 244' ' ' LYS . . . . . . . . . . . . . 33.7 pttt -139.49 146.83 40.47 Favored 'General case' 0 N--CA 1.495 1.821 0 O-C-N 121.727 -0.608 . . . . 0.0 110.434 179.946 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 245' ' ' GLU . . . . . . . . . . . . . 12.3 pt-20 -136.61 142.47 43.3 Favored 'General case' 0 N--CA 1.497 1.884 0 O-C-N 121.682 -0.636 . . . . 0.0 110.285 179.159 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 246' ' ' LYS . . . . . . . . . . . . . 24.2 mmmt -107.43 120.23 41.61 Favored 'General case' 0 N--CA 1.495 1.79 0 O-C-N 121.657 -0.652 . . . . 0.0 110.254 -179.679 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 247' ' ' ASN . . . . . . . . . . . . . 15.0 t-20 52.78 38.2 25.88 Favored 'General case' 0 N--CA 1.506 2.341 0 O-C-N 121.621 -0.674 . . . . 0.0 110.988 179.17 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 248' ' ' ILE . . . . . 0.503 HG22 ' O ' ' B' ' 248' ' ' ILE . 68.6 mt 52.29 59.77 0.29 Allowed 'Isoleucine or valine' 0 N--CA 1.507 2.392 0 O-C-N 121.522 -0.736 . . . . 0.0 110.421 -179.143 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 249' ' ' SER . . . . . 0.422 ' C ' HG13 ' B' ' 250' ' ' VAL . 50.3 m -118.14 152.09 36.31 Favored 'General case' 0 N--CA 1.495 1.8 0 O-C-N 121.554 -0.716 . . . . 0.0 110.246 -179.133 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 250' ' ' VAL . . . . . 0.53 ' O ' HG23 ' B' ' 250' ' ' VAL . 29.3 m -150.16 81.81 0.08 OUTLIER 'Isoleucine or valine' 0 N--CA 1.498 1.929 0 CA-C-O 121.387 0.613 . . . . 0.0 110.11 -179.57 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 251' ' ' ASP . . . . . . . . . . . . . 74.5 m-20 -81.64 133.77 35.4 Favored 'General case' 0 N--CA 1.497 1.911 0 O-C-N 121.513 -0.742 . . . . 0.0 110.169 179.775 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 252' ' ' VAL . . . . . . . . . . . . . 94.7 t 56.2 -86.6 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.508 2.435 0 O-C-N 121.829 -0.544 . . . . 0.0 110.735 -179.33 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 253' ' ' ASP . . . . . . . . . . . . . 74.7 m-20 51.89 52.2 14.97 Favored 'General case' 0 N--CA 1.506 2.351 0 O-C-N 121.006 -1.058 . . . . 0.0 110.969 -178.435 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 254' ' ' ALA . . . . . . . . . . . . . . . -66.02 -31.77 72.86 Favored 'General case' 0 N--CA 1.501 2.094 0 O-C-N 121.524 -0.735 . . . . 0.0 110.393 -179.128 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 255' ' ' ASP . . . . . . . . . . . . . 11.6 p-10 -72.01 -35.42 69.43 Favored 'General case' 0 N--CA 1.499 1.993 0 O-C-N 121.58 -0.7 . . . . 0.0 110.198 179.415 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 256' ' ' ALA . . . . . . . . . . . . . . . -65.02 -42.78 94.11 Favored 'General case' 0 N--CA 1.501 2.079 0 O-C-N 121.651 -0.655 . . . . 0.0 110.186 178.325 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 257' ' ' SER . . . . . . . . . . . . . 43.2 t -55.19 -35.39 64.78 Favored 'General case' 0 N--CA 1.503 2.195 0 O-C-N 121.66 -0.65 . . . . 0.0 110.499 177.998 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 258' ' ' SER . . . . . . . . . . . . . 25.2 m -68.89 -30.87 69.45 Favored 'General case' 0 N--CA 1.498 1.968 0 C-N-CA 120.436 -0.506 . . . . 0.0 110.389 -179.769 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 259' ' ' GLN . . . . . . . . . . . . . 48.9 tt0 -63.56 -39.98 95.81 Favored 'General case' 0 N--CA 1.501 2.108 0 O-C-N 121.589 -0.694 . . . . 0.0 110.43 -179.903 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 260' ' ' LEU . . . . . 0.513 ' HA ' HD12 ' B' ' 263' ' ' LEU . 83.7 mt -67.37 -43.53 81.18 Favored 'General case' 0 N--CA 1.5 2.055 0 O-C-N 121.609 -0.682 . . . . 0.0 110.247 -179.661 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 261' ' ' LEU . . . . . . . . . . . . . 17.1 tp -70.38 -36.77 74.33 Favored 'General case' 0 N--CA 1.498 1.962 0 O-C-N 121.634 -0.666 . . . . 0.0 109.629 177.078 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 262' ' ' SER . . . . . . . . . . . . . 22.8 t -62.79 -35.84 81.2 Favored 'General case' 0 N--CA 1.501 2.076 0 O-C-N 121.776 -0.578 . . . . 0.0 110.565 176.671 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 263' ' ' LEU . . . . . 0.513 HD12 ' HA ' ' B' ' 260' ' ' LEU . 19.9 mt -64.55 -44.6 90.28 Favored 'General case' 0 N--CA 1.501 2.078 0 O-C-N 121.598 -0.689 . . . . 0.0 110.247 -179.331 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 264' ' ' LEU . . . . . 0.477 ' CD1' HD11 ' A' ' 55' ' ' LEU . 86.3 mt -62.42 -34.72 77.31 Favored 'General case' 0 N--CA 1.502 2.158 0 O-C-N 121.762 -0.586 . . . . 0.0 110.566 177.872 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 265' ' ' LYS . . . . . . . . . . . . . 81.3 tttt -75.66 -40.71 55.64 Favored 'General case' 0 N--CA 1.498 1.945 0 O-C-N 121.7 -0.625 . . . . 0.0 110.115 -179.048 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 266' ' ' SER . . . . . . . . . . . . . 85.9 p -163.11 165.84 24.17 Favored 'General case' 0 N--CA 1.496 1.828 0 O-C-N 121.637 -0.665 . . . . 0.0 110.2 -179.696 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 267' ' ' SER . . . . . . . . . . . . . 91.1 p -143.36 163.49 32.9 Favored 'General case' 0 N--CA 1.495 1.8 0 O-C-N 121.73 -0.607 . . . . 0.0 110.269 179.73 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 268' ' ' THR . . . . . . . . . . . . . 23.8 m -95.82 137.69 34.53 Favored 'General case' 0 N--CA 1.494 1.772 0 O-C-N 121.668 -0.645 . . . . 0.0 110.159 179.881 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 269' ' ' ALA . . . . . . . . . . . . . . . 48.72 65.88 6.48 Favored Pre-proline 0 N--CA 1.506 2.358 0 O-C-N 121.693 -0.629 . . . . 0.0 111.139 -178.177 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 270' ' ' PRO . . . . . . . . . . . . . 27.0 Cg_endo -66.78 135.6 38.95 Favored 'Trans proline' 0 N--CA 1.488 1.161 0 O-C-N 123.525 1.276 . . . . 0.0 110.476 -178.963 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 271' ' ' SER . . . . . . . . . . . . . 29.4 t -148.2 139.89 23.76 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.674 -0.642 . . . . 0.0 110.142 179.061 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 272' ' ' ASP . . . . . . . . . . . . . 2.6 p30 -161.04 32.57 0.14 Allowed 'General case' 0 N--CA 1.496 1.861 0 O-C-N 121.696 -0.627 . . . . 0.0 110.489 179.859 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 273' ' ' LEU . . . . . . . . . . . . . 21.3 tp -83.18 126.32 32.5 Favored 'General case' 0 N--CA 1.497 1.876 0 O-C-N 121.631 -0.668 . . . . 0.0 110.097 179.848 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 274' ' ' ALA . . . . . . . . . . . . . . . 49.68 92.72 0.02 OUTLIER 'General case' 0 N--CA 1.506 2.357 0 O-C-N 121.741 -0.6 . . . . 0.0 111.304 -178.862 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 275' ' ' THR . . . . . . . . . . . . . 8.2 t -125.27 149.64 64.72 Favored Pre-proline 0 N--CA 1.498 1.927 0 O-C-N 121.57 -0.706 . . . . 0.0 110.161 -179.837 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 276' ' ' PRO . . . . . . . . . . . . . 28.7 Cg_endo -67.34 148.14 79.27 Favored 'Trans proline' 0 N--CA 1.489 1.235 0 O-C-N 123.52 1.274 . . . . 0.0 110.413 179.567 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 277' ' ' GLN . . . . . . . . . . . . . 24.2 tt0 -123.72 88.17 52.17 Favored Pre-proline 0 N--CA 1.495 1.782 0 O-C-N 121.696 -0.628 . . . . 0.0 110.168 179.692 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 278' ' ' PRO . . . . . . . . . . . . . 21.2 Cg_exo -61.97 144.9 96.89 Favored 'Trans proline' 0 N--CA 1.49 1.318 0 O-C-N 123.49 1.258 . . . . 0.0 110.693 -179.6 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 279' ' ' SER . . . . . . . . . . . . . 35.1 t -142.1 -59.59 0.46 Allowed 'General case' 0 N--CA 1.495 1.818 0 O-C-N 121.719 -0.613 . . . . 0.0 110.225 179.96 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 280' ' ' THR . . . . . . . . . . . . . 45.5 p -127.09 32.04 5.15 Favored 'General case' 0 N--CA 1.495 1.813 0 O-C-N 121.64 -0.663 . . . . 0.0 110.358 -179.84 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 281' ' ' PHE . . . . . 0.408 ' N ' ' HD2' ' B' ' 282' ' ' PRO . 2.6 m-85 -66.36 -57.1 13.45 Favored Pre-proline 0 N--CA 1.498 1.936 0 O-C-N 121.6 -0.687 . . . . 0.0 110.7 -179.549 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 282' ' ' PRO . . . . . 0.408 ' HD2' ' N ' ' B' ' 281' ' ' PHE . 29.1 Cg_endo -68.36 -32.68 25.39 Favored 'Trans proline' 0 N--CA 1.487 1.138 0 O-C-N 123.277 1.146 . . . . 0.0 110.57 -177.44 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 283' ' ' GLN . . . . . . . . . . . . . 71.6 mt-30 -144.67 153.23 54.4 Favored Pre-proline 0 N--CA 1.494 1.735 0 O-C-N 121.615 -0.678 . . . . 0.0 110.33 179.448 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 284' ' ' PRO . . . . . . . . . . . . . 38.0 Cg_endo -71.82 156.91 56.21 Favored 'Trans proline' 0 N--CA 1.486 1.064 0 O-C-N 123.684 1.36 . . . . 0.0 110.309 179.428 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 285' ' ' PRO . . . . . . . . . . . . . 29.2 Cg_endo -67.66 144.32 65.58 Favored 'Trans proline' 0 N--CA 1.488 1.193 0 O-C-N 123.679 1.357 . . . . 0.0 110.315 178.894 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 286' ' ' VAL . . . . . . . . . . . . . 61.2 t -117.54 131.32 70.61 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.919 0 O-C-N 121.648 -0.658 . . . . 0.0 109.724 -179.776 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 287' ' ' GLU . . . . . . . . . . . . . 41.8 tt0 -120.88 134.93 55.29 Favored 'General case' 0 N--CA 1.495 1.796 0 O-C-N 121.654 -0.653 . . . . 0.0 110.047 179.256 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 288' ' ' SER . . . . . . . . . . . . . 32.3 t -143.16 140.03 30.61 Favored 'General case' 0 N--CA 1.494 1.736 0 O-C-N 121.691 -0.63 . . . . 0.0 110.288 179.637 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 289' ' ' HIS . . . . . . . . . . . . . 99.3 m-70 -95.3 -62.3 1.33 Allowed 'General case' 0 N--CA 1.495 1.808 0 O-C-N 121.702 -0.624 . . . . 0.0 110.191 179.499 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 290' ' ' SER . . . . . . . . . . . . . 31.1 m -66.06 -34.49 78.18 Favored 'General case' 0 N--CA 1.5 2.06 0 O-C-N 121.68 -0.637 . . . . 0.0 110.32 179.547 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 291' ' ' SER . . . . . . . . . . . . . 10.9 m . . . . . 0 N--CA 1.505 2.282 0 CA-C-O 117.997 -1.002 . . . . 0.0 111.074 -179.901 . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' -1' ' ' MET . . . . . . . . . . . . . 13.0 tpt . . . . . 0 N--CA 1.492 1.627 0 CA-C-O 121.118 0.485 . . . . 0.0 110.153 . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 0' ' ' GLY . . . . . . . . . . . . . . . -75.55 142.97 29.74 Favored Glycine 0 N--CA 1.495 2.625 0 N-CA-C 109.39 -1.484 . . . . 0.0 109.39 179.215 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 90.0 mtp -123.76 141.13 52.31 Favored 'General case' 0 N--CA 1.496 1.845 0 O-C-N 121.71 -0.876 . . . . 0.0 110.28 -179.59 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 65.5 m -101.01 163.42 12.29 Favored 'General case' 0 N--CA 1.494 1.77 0 O-C-N 121.678 -0.639 . . . . 0.0 109.976 178.433 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 3' ' ' VAL . . . . . 0.466 HG12 ' CE1' ' A' ' 7' ' ' TYR . 69.3 t -66.81 -27.82 41.09 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.082 0 O-C-N 121.596 -0.69 . . . . 0.0 110.097 179.823 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -55.21 -30.62 60.33 Favored 'General case' 0 N--CA 1.504 2.25 0 O-C-N 121.401 -0.812 . . . . 0.0 110.313 179.711 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -68.17 -31.48 71.06 Favored 'General case' 0 N--CA 1.498 1.948 0 O-C-N 121.847 -0.533 . . . . 0.0 110.151 174.533 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 88.2 m-85 -95.73 9.53 40.08 Favored 'General case' 0 N--CA 1.497 1.888 0 O-C-N 121.711 -0.618 . . . . 0.0 111.342 179.869 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 7' ' ' TYR . . . . . 0.466 ' CE1' HG12 ' A' ' 3' ' ' VAL . 3.5 m-30 -67.3 142.15 56.94 Favored 'General case' 0 N--CA 1.501 2.123 0 O-C-N 121.181 -0.949 . . . . 0.0 110.113 174.324 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 8' ' ' GLY . . . . . 0.425 ' O ' HG13 ' A' ' 24' ' ' VAL . . . 82.45 -0.2 89.32 Favored Glycine 0 N--CA 1.498 2.769 0 N-CA-C 110.648 -0.981 . . . . 0.0 110.648 -176.746 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 9' ' ' SER . . . . . 0.554 ' OG ' HD12 ' A' ' 25' ' ' ILE . 84.5 p -77.4 137.37 38.68 Favored 'General case' 0 N--CA 1.497 1.909 0 O-C-N 121.081 -1.247 . . . . 0.0 110.478 179.32 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 12.1 t-20 -84.05 119.09 24.54 Favored 'General case' 0 N--CA 1.497 1.923 0 O-C-N 121.644 -0.66 . . . . 0.0 109.45 172.944 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 11' ' ' VAL . . . . . 0.576 HG12 ' HA ' ' A' ' 57' ' ' ILE . 35.6 m -142.64 164.0 17.39 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.63 0 O-C-N 121.829 -0.545 . . . . 0.0 109.541 -179.166 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 12' ' ' GLU . . . . . 0.434 ' HB2' HD11 ' A' ' 58' ' ' LEU . 35.6 tt0 -109.32 129.13 55.53 Favored 'General case' 0 N--CA 1.493 1.687 0 C-N-CA 119.929 -0.708 . . . . 0.0 109.916 177.183 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 13' ' ' VAL . . . . . 0.46 HG22 HD23 ' A' ' 55' ' ' LEU . 61.4 t -106.69 127.92 61.78 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.713 0 O-C-N 121.581 -0.7 . . . . 0.0 109.818 179.763 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 29.9 tp -95.94 128.33 42.74 Favored 'General case' 0 N--CA 1.493 1.718 0 N-CA-C 109.26 -0.644 . . . . 0.0 109.26 176.511 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 86.1 mt -95.02 160.94 14.34 Favored 'General case' 0 N--CA 1.495 1.813 0 O-C-N 121.615 -0.678 . . . . 0.0 111.015 -173.687 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 24.3 p30 -58.05 -21.87 47.56 Favored 'General case' 0 N--CA 1.506 2.343 0 O-C-N 121.819 -0.55 . . . . 0.0 111.571 -178.166 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 38.3 p-10 -93.28 24.02 4.1 Favored 'General case' 0 N--CA 1.497 1.923 0 O-C-N 121.507 -0.745 . . . . 0.0 110.782 -177.378 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 74.2 m-20 59.24 27.88 17.04 Favored 'General case' 0 N--CA 1.505 2.311 0 O-C-N 121.437 -0.789 . . . . 0.0 110.661 175.812 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 50.8 m -103.65 142.3 34.55 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.551 -0.718 . . . . 0.0 109.517 172.182 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 96.5 mttt -109.6 142.75 40.28 Favored 'General case' 0 N--CA 1.494 1.77 0 O-C-N 121.633 -0.667 . . . . 0.0 110.581 -175.806 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -153.07 152.82 31.77 Favored 'General case' 0 N--CA 1.497 1.897 0 O-C-N 121.725 -0.609 . . . . 0.0 110.304 176.376 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 22' ' ' ARG . . . . . 0.508 ' O ' HD13 ' A' ' 39' ' ' LEU . 32.9 ptt180 -144.08 149.13 36.11 Favored 'General case' 0 N--CA 1.498 1.951 0 O-C-N 121.691 -0.631 . . . . 0.0 110.519 177.574 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -171.77 171.46 44.11 Favored Glycine 0 N--CA 1.496 2.656 0 N-CA-C 108.954 -1.658 . . . . 0.0 108.954 -176.365 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 24' ' ' VAL . . . . . 0.425 HG13 ' O ' ' A' ' 8' ' ' GLY . 46.7 t -94.62 119.32 42.44 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.909 0 O-C-N 121.444 -1.033 . . . . 0.0 109.298 -177.27 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 25' ' ' ILE . . . . . 0.644 ' HA ' HD23 ' A' ' 37' ' ' LEU . 95.8 mt -64.39 143.59 15.56 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.179 0 O-C-N 121.69 -0.631 . . . . 0.0 110.601 -171.312 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 26' ' ' THR . . . . . 0.603 HG21 ' HB2' ' A' ' 38' ' ' ARG . 7.9 p -121.17 -26.91 5.0 Favored 'General case' 0 N--CA 1.494 1.758 0 O-C-N 121.779 -0.575 . . . . 0.0 111.258 178.988 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 27' ' ' ASN . . . . . 0.478 ' O ' HD12 ' A' ' 35' ' ' LEU . 6.4 t30 -161.9 159.25 26.5 Favored 'General case' 0 N--CA 1.499 2.02 0 C-N-CA 118.969 -1.092 . . . . 0.0 111.671 -179.08 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 28' ' ' PHE . . . . . 0.523 ' HE1' HG21 ' A' ' 49' ' ' THR . 75.6 t80 -150.13 125.93 10.42 Favored 'General case' 0 N--CA 1.497 1.876 0 N-CA-C 109.089 -0.708 . . . . 0.0 109.089 170.478 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 17.9 t70 -99.64 130.61 45.88 Favored 'General case' 0 N--CA 1.491 1.605 0 N-CA-C 108.981 -0.748 . . . . 0.0 108.981 -177.395 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 34.7 m -69.64 -50.94 39.46 Favored 'General case' 0 N--CA 1.498 1.944 0 C-N-CA 120.01 -0.676 . . . . 0.0 110.534 -176.349 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 5.4 t -59.58 -42.74 93.21 Favored 'General case' 0 N--CA 1.502 2.138 0 O-C-N 121.477 -0.764 . . . . 0.0 110.791 -174.818 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 28.6 m120 -103.27 -10.06 19.03 Favored 'General case' 0 N--CA 1.497 1.893 0 O-C-N 121.573 -0.705 . . . . 0.0 111.446 -177.416 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 1.8 m 49.72 67.29 0.92 Allowed 'General case' 0 N--CA 1.507 2.407 0 O-C-N 121.054 -1.029 . . . . 0.0 111.08 -175.202 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 34' ' ' ILE . . . . . 1.13 HD12 HG22 ' A' ' 48' ' ' VAL . 47.6 mm -124.91 126.19 70.9 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.092 0 O-C-N 121.595 -0.691 . . . . 0.0 109.438 -175.899 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.478 HD12 ' O ' ' A' ' 27' ' ' ASN . 11.5 tp -115.86 121.07 41.28 Favored 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.596 -0.69 . . . . 0.0 110.622 -169.897 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 58.1 mt-30 -91.78 133.83 35.28 Favored 'General case' 0 N--CA 1.491 1.618 0 N-CA-C 109.435 -0.58 . . . . 0.0 109.435 173.49 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 0.644 HD23 ' HA ' ' A' ' 25' ' ' ILE . 90.5 mt -117.96 123.8 46.66 Favored 'General case' 0 N--CA 1.497 1.884 0 O-C-N 121.801 -0.562 . . . . 0.0 109.921 174.963 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 38' ' ' ARG . . . . . 0.603 ' HB2' HG21 ' A' ' 26' ' ' THR . 64.9 ttt180 -96.07 105.06 17.05 Favored 'General case' 0 N--CA 1.497 1.877 0 O-C-N 121.682 -0.636 . . . . 0.0 109.777 175.99 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.508 HD13 ' O ' ' A' ' 22' ' ' ARG . 20.1 tp -85.0 155.31 21.62 Favored 'General case' 0 N--CA 1.495 1.791 0 O-C-N 121.701 -0.624 . . . . 0.0 110.951 -173.692 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -68.63 -2.99 10.31 Favored 'General case' 0 N--CA 1.503 2.178 0 O-C-N 121.943 -0.473 . . . . 0.0 112.203 -169.494 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 43.3 p-10 -86.91 25.78 1.25 Allowed 'General case' 0 N--CA 1.499 1.994 0 O-C-N 121.004 -1.06 . . . . 0.0 110.853 173.637 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 7.8 t70 61.74 28.07 17.25 Favored 'General case' 0 N--CA 1.504 2.267 0 O-C-N 121.115 -0.991 . . . . 0.0 110.484 178.717 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 36.7 m -120.54 137.93 54.13 Favored 'General case' 0 N--CA 1.496 1.87 0 O-C-N 121.396 -0.815 . . . . 0.0 110.431 -179.893 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 8.7 t -97.86 151.01 20.67 Favored 'General case' 0 N--CA 1.496 1.864 0 O-C-N 121.719 -0.613 . . . . 0.0 110.172 175.98 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 70.3 tttt -149.44 119.13 7.0 Favored 'General case' 0 N--CA 1.496 1.847 0 O-C-N 121.612 -0.68 . . . . 0.0 110.27 178.762 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 88.4 p -95.71 122.8 38.88 Favored 'General case' 0 N--CA 1.495 1.801 0 O-C-N 121.713 -0.617 . . . . 0.0 110.208 179.057 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 81.7 mt -129.39 136.48 59.27 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.813 0 O-C-N 121.584 -0.697 . . . . 0.0 109.385 179.64 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 48' ' ' VAL . . . . . 1.13 HG22 HD12 ' A' ' 34' ' ' ILE . 57.8 t -81.8 127.53 39.52 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.896 0 N-CA-C 109.1 -0.704 . . . . 0.0 109.1 178.276 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 49' ' ' THR . . . . . 0.523 HG21 ' HE1' ' A' ' 28' ' ' PHE . 42.2 p -59.49 -25.74 64.7 Favored 'General case' 0 N--CA 1.504 2.229 0 O-C-N 121.558 -0.714 . . . . 0.0 112.071 -169.029 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 19.2 tptm -57.93 -23.39 53.3 Favored 'General case' 0 N--CA 1.502 2.154 0 O-C-N 121.512 -0.742 . . . . 0.0 111.346 -174.95 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 9.8 p30 -80.95 -4.32 54.61 Favored 'General case' 0 N--CA 1.499 2.02 0 C-N-CA 119.734 -0.786 . . . . 0.0 110.993 176.135 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 52' ' ' ILE . . . . . 0.794 HG21 HD11 ' A' ' 55' ' ' LEU . 85.5 mt -80.57 135.58 24.98 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.056 0 O-C-N 121.209 -0.932 . . . . 0.0 110.127 178.329 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 62.0 tttt -91.32 -30.66 16.45 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.84 -0.537 . . . . 0.0 109.62 169.567 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 54' ' ' ASP . . . . . 0.404 ' HA ' HD13 ' B' ' 261' ' ' LEU . 1.7 m-20 -165.31 159.97 17.78 Favored 'General case' 0 N--CA 1.502 2.156 0 O-C-N 121.833 -0.542 . . . . 0.0 110.505 -176.53 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 55' ' ' LEU . . . . . 0.794 HD11 HG21 ' A' ' 52' ' ' ILE . 4.4 mp -132.96 157.37 45.34 Favored 'General case' 0 N--CA 1.496 1.845 0 O-C-N 121.726 -0.609 . . . . 0.0 110.227 177.179 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 7.9 ptm180 -150.61 146.58 26.61 Favored 'General case' 0 N--CA 1.495 1.813 0 O-C-N 121.634 -0.666 . . . . 0.0 109.672 174.538 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 57' ' ' ILE . . . . . 0.576 ' HA ' HG12 ' A' ' 11' ' ' VAL . 55.9 mt -86.04 133.31 29.96 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.876 0 O-C-N 121.508 -0.745 . . . . 0.0 109.952 175.49 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 58' ' ' LEU . . . . . 0.434 HD11 ' HB2' ' A' ' 12' ' ' GLU . 79.2 mt -83.63 151.93 62.54 Favored Pre-proline 0 N--CA 1.498 1.942 0 O-C-N 121.589 -0.695 . . . . 0.0 110.076 -178.932 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 33.2 Cg_endo -69.26 113.23 3.22 Favored 'Trans proline' 0 N--CA 1.487 1.134 0 O-C-N 123.523 1.275 . . . . 0.0 110.384 -178.531 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 48.6 tttm -161.93 89.24 0.71 Allowed 'General case' 0 N--CA 1.495 1.811 0 O-C-N 121.655 -0.653 . . . . 0.0 110.072 178.006 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 24.3 p30 -161.37 36.35 0.14 Allowed 'General case' 0 N--CA 1.497 1.902 0 O-C-N 121.606 -0.684 . . . . 0.0 110.313 -179.706 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 79.2 mt-10 -90.47 136.03 33.32 Favored 'General case' 0 N--CA 1.496 1.871 0 O-C-N 121.689 -0.632 . . . . 0.0 110.161 -179.332 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 82.1 mt -119.75 131.28 72.67 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.996 0 O-C-N 121.719 -0.613 . . . . 0.0 109.635 179.799 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 64' ' ' MET . . . . . . . . . . . . . 35.1 mtt 52.0 58.53 15.5 Favored Pre-proline 0 N--CA 1.505 2.316 0 O-C-N 121.581 -0.699 . . . . 0.0 111.014 179.842 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 28.1 Cg_endo -67.79 -54.89 0.3 Allowed 'Trans proline' 0 N--CA 1.488 1.154 0 O-C-N 123.51 1.268 . . . . 0.0 110.39 179.845 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 62.4 mttm -100.07 -36.73 9.25 Favored 'General case' 0 N--CA 1.494 1.772 0 O-C-N 121.607 -0.683 . . . . 0.0 110.255 179.567 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 91.6 m-20 -107.47 138.81 43.0 Favored 'General case' 0 N--CA 1.496 1.839 0 O-C-N 121.751 -0.593 . . . . 0.0 110.142 -179.673 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . -179.09 -113.41 0.38 Allowed Glycine 0 N--CA 1.494 2.511 0 N-CA-C 109.525 -1.43 . . . . 0.0 109.525 179.992 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 24.5 m -68.64 -38.01 80.13 Favored 'General case' 0 N--CA 1.498 1.954 0 O-C-N 121.717 -0.872 . . . . 0.0 110.145 178.886 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 45.0 mmtm -66.02 -41.39 91.03 Favored 'General case' 0 N--CA 1.5 2.061 0 O-C-N 121.74 -0.6 . . . . 0.0 110.545 -178.786 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 4.7 m -145.31 159.32 49.17 Favored Pre-proline 0 N--CA 1.495 1.824 0 O-C-N 121.679 -0.638 . . . . 0.0 110.244 -179.215 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 22.2 Cg_exo -61.05 140.39 89.5 Favored 'Trans proline' 0 N--CA 1.49 1.323 0 O-C-N 123.611 1.322 . . . . 0.0 110.743 -179.701 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 17.4 t -89.3 -31.44 17.84 Favored 'General case' 0 N--CA 1.497 1.88 0 O-C-N 121.718 -0.614 . . . . 0.0 110.379 179.645 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 9.8 t -129.09 161.75 29.3 Favored 'General case' 0 N--CA 1.497 1.893 0 O-C-N 121.656 -0.653 . . . . 0.0 110.321 -179.816 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 91.3 m-20 -92.28 145.21 24.66 Favored 'General case' 0 N--CA 1.496 1.873 0 O-C-N 121.711 -0.618 . . . . 0.0 110.17 -179.502 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 50.9 m -116.34 153.09 32.62 Favored 'General case' 0 N--CA 1.495 1.798 0 O-C-N 121.641 -0.662 . . . . 0.0 110.119 -179.662 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 24.0 m -64.14 -38.19 90.17 Favored 'General case' 0 N--CA 1.501 2.105 0 O-C-N 121.654 -0.654 . . . . 0.0 110.389 -179.357 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 71.7 tttt -65.01 -42.36 94.53 Favored 'General case' 0 N--CA 1.5 2.067 0 O-C-N 121.653 -0.654 . . . . 0.0 110.294 179.709 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER 52.37 94.24 0.02 OUTLIER 'General case' 0 N--CA 1.505 2.305 0 O-C-N 121.629 -0.67 . . . . 0.0 111.174 179.561 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 98.6 mttt -89.74 104.44 17.0 Favored 'General case' 0 N--CA 1.497 1.906 0 O-C-N 121.716 -0.615 . . . . 0.0 110.112 179.702 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 86.4 p -160.24 174.51 14.11 Favored 'General case' 0 N--CA 1.494 1.76 0 O-C-N 121.692 -0.63 . . . . 0.0 110.205 -179.848 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -94.67 143.28 26.56 Favored 'General case' 0 N--CA 1.495 1.798 0 O-C-N 121.734 -0.604 . . . . 0.0 110.1 179.198 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 54.6 mt-10 -101.36 141.67 33.89 Favored 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.676 -0.64 . . . . 0.0 110.309 -179.044 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 24.6 m -127.94 142.25 51.3 Favored 'General case' 0 N--CA 1.495 1.793 0 O-C-N 121.729 -0.607 . . . . 0.0 110.103 179.48 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 70.4 t80 -103.66 130.93 51.2 Favored 'General case' 0 N--CA 1.494 1.771 0 O-C-N 121.645 -0.659 . . . . 0.0 110.203 179.735 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 30.6 t -124.01 146.97 48.18 Favored 'General case' 0 N--CA 1.495 1.814 0 O-C-N 121.693 -0.629 . . . . 0.0 110.189 -179.803 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 87.3 p -92.95 156.8 16.69 Favored 'General case' 0 N--CA 1.496 1.831 0 O-C-N 121.684 -0.635 . . . . 0.0 110.199 179.954 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 49.8 mttm -96.06 136.25 36.77 Favored 'General case' 0 N--CA 1.496 1.852 0 O-C-N 121.672 -0.643 . . . . 0.0 110.152 -179.827 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 17.3 t-20 -107.22 104.37 13.98 Favored 'General case' 0 N--CA 1.495 1.782 0 O-C-N 121.729 -0.607 . . . . 0.0 110.136 179.82 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 35.2 ttmt -95.21 -61.7 1.43 Allowed 'General case' 0 N--CA 1.494 1.761 0 O-C-N 121.659 -0.65 . . . . 0.0 110.259 179.652 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 91' ' ' TRP . . . . . . . . . . . . . 98.0 m95 -114.16 141.93 46.89 Favored 'General case' 0 N--CA 1.495 1.783 0 O-C-N 121.634 -0.666 . . . . 0.0 110.175 -179.919 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 8.0 t -133.34 33.61 3.57 Favored 'General case' 0 N--CA 1.494 1.77 0 O-C-N 121.737 -0.602 . . . . 0.0 110.274 179.81 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 93' ' ' MET . . . . . . . . . . . . . 90.2 mtp -65.03 -35.71 82.05 Favored 'General case' 0 N--CA 1.5 2.044 0 O-C-N 121.555 -0.716 . . . . 0.0 110.406 -179.683 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 18.6 t70 . . . . . 0 N--CA 1.505 2.294 0 CA-C-O 118.048 -0.977 . . . . 0.0 110.944 -179.901 . . . . . . . . 0 0 . 1 . 018 nuclear build full ' B' B ' 240' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.292 0 N-CA-C 109.566 -1.413 . . . . 0.0 109.566 . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' B' B ' 241' ' ' ALA . . . . . . . . . . . . . . . -104.68 145.49 30.27 Favored 'General case' 0 N--CA 1.494 1.768 0 O-C-N 121.594 -0.945 . . . . 0.0 110.186 179.972 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 242' ' ' THR . . . . . . . . . . . . . 40.4 p -121.75 159.56 26.4 Favored 'General case' 0 N--CA 1.496 1.829 0 O-C-N 121.689 -0.632 . . . . 0.0 110.238 179.711 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 243' ' ' THR . . . . . . . . . . . . . 24.8 m -124.43 137.42 54.45 Favored 'General case' 0 N--CA 1.495 1.812 0 O-C-N 121.643 -0.661 . . . . 0.0 110.19 -179.542 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 244' ' ' LYS . . . . . . . . . . . . . 54.8 mttm -103.85 146.23 28.95 Favored 'General case' 0 N--CA 1.495 1.787 0 O-C-N 121.654 -0.654 . . . . 0.0 110.083 179.233 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 245' ' ' GLU . . . . . . . . . . . . . 25.7 tp10 59.63 156.8 0.03 OUTLIER 'General case' 0 N--CA 1.508 2.444 0 O-C-N 121.672 -0.643 . . . . 0.0 110.762 -177.905 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 246' ' ' LYS . . . . . . . . . . . . . 48.4 mttp -88.57 124.69 34.29 Favored 'General case' 0 N--CA 1.497 1.907 0 O-C-N 121.525 -0.734 . . . . 0.0 110.188 179.98 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 247' ' ' ASN . . . . . . . . . . . . . 63.2 t30 -82.71 -34.15 27.37 Favored 'General case' 0 N--CA 1.497 1.919 0 O-C-N 121.679 -0.638 . . . . 0.0 110.196 179.585 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 248' ' ' ILE . . . . . . . . . . . . . 82.7 mt 53.4 76.77 0.08 OUTLIER 'Isoleucine or valine' 0 N--CA 1.506 2.364 0 O-C-N 121.485 -0.76 . . . . 0.0 110.411 -179.519 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 249' ' ' SER . . . . . . . . . . . . . 88.3 p -67.38 -30.24 69.97 Favored 'General case' 0 N--CA 1.501 2.083 0 O-C-N 121.602 -0.686 . . . . 0.0 110.416 179.409 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 250' ' ' VAL . . . . . . . . . . . . . 60.6 t -88.58 147.91 4.9 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.992 0 O-C-N 121.615 -0.678 . . . . 0.0 109.643 179.861 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 251' ' ' ASP . . . . . 0.615 ' CG ' ' HB2' ' B' ' 254' ' ' ALA . 6.8 t0 66.27 -65.03 0.2 Allowed 'General case' 0 N--CA 1.509 2.484 0 O-C-N 121.987 -0.445 . . . . 0.0 110.899 -177.22 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 252' ' ' VAL . . . . . . . . . . . . . 38.3 t 60.28 117.37 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.509 2.509 0 O-C-N 121.626 -0.671 . . . . 0.0 110.648 -179.384 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 253' ' ' ASP . . . . . . . . . . . . . 74.3 m-20 52.77 47.32 24.93 Favored 'General case' 0 N--CA 1.506 2.344 0 O-C-N 121.559 -0.713 . . . . 0.0 110.766 -178.848 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 254' ' ' ALA . . . . . 0.615 ' HB2' ' CG ' ' B' ' 251' ' ' ASP . . . -68.09 -31.31 70.85 Favored 'General case' 0 N--CA 1.498 1.972 0 O-C-N 121.681 -0.637 . . . . 0.0 110.474 179.435 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 255' ' ' ASP . . . . . . . . . . . . . 74.3 m-20 -72.52 -32.18 65.93 Favored 'General case' 0 N--CA 1.499 1.995 0 O-C-N 121.663 -0.648 . . . . 0.0 110.443 -177.544 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 256' ' ' ALA . . . . . . . . . . . . . . . -63.52 -50.09 70.93 Favored 'General case' 0 N--CA 1.502 2.157 0 O-C-N 121.439 -0.788 . . . . 0.0 110.393 -178.264 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 257' ' ' SER . . . . . . . . . . . . . 24.2 m -56.34 -36.11 68.38 Favored 'General case' 0 N--CA 1.503 2.204 0 O-C-N 121.691 -0.631 . . . . 0.0 110.521 177.44 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 258' ' ' SER . . . . . . . . . . . . . 22.7 t -69.46 -38.25 77.66 Favored 'General case' 0 N--CA 1.498 1.925 0 C-N-CA 120.481 -0.487 . . . . 0.0 110.317 -179.04 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 259' ' ' GLN . . . . . . . . . . . . . 88.7 mm-40 -64.73 -35.44 81.07 Favored 'General case' 0 N--CA 1.501 2.087 0 O-C-N 121.6 -0.687 . . . . 0.0 110.407 -179.748 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 260' ' ' LEU . . . . . . . . . . . . . 83.6 mt -67.56 -38.62 84.38 Favored 'General case' 0 N--CA 1.498 1.971 0 O-C-N 121.639 -0.663 . . . . 0.0 110.27 179.269 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 261' ' ' LEU . . . . . 0.61 HD13 HD12 ' A' ' 55' ' ' LEU . 47.9 tp -67.99 -39.89 83.19 Favored 'General case' 0 N--CA 1.498 1.957 0 O-C-N 121.57 -0.706 . . . . 0.0 109.994 178.668 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 262' ' ' SER . . . . . . . . . . . . . 21.0 m -63.18 -40.65 98.14 Favored 'General case' 0 N--CA 1.5 2.072 0 O-C-N 121.695 -0.628 . . . . 0.0 110.488 177.323 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 263' ' ' LEU . . . . . . . . . . . . . 51.5 mt -65.51 -42.63 91.88 Favored 'General case' 0 N--CA 1.501 2.083 0 O-C-N 121.715 -0.615 . . . . 0.0 110.23 179.327 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 264' ' ' LEU . . . . . 0.531 ' CD1' HD13 ' A' ' 55' ' ' LEU . 60.8 mt -62.41 -34.95 77.75 Favored 'General case' 0 N--CA 1.501 2.092 0 O-C-N 121.708 -0.62 . . . . 0.0 110.454 178.053 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 265' ' ' LYS . . . . . . . . . . . . . 51.2 tttm -76.11 -41.15 51.13 Favored 'General case' 0 N--CA 1.498 1.936 0 O-C-N 121.688 -0.632 . . . . 0.0 109.953 179.255 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 266' ' ' SER . . . . . . . . . . . . . 58.3 m 51.5 -174.35 0.02 OUTLIER 'General case' 0 N--CA 1.506 2.347 0 O-C-N 121.775 -0.578 . . . . 0.0 111.326 179.75 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 267' ' ' SER . . . . . . . . . . . . . 95.2 p -136.83 162.84 32.11 Favored 'General case' 0 N--CA 1.495 1.79 0 O-C-N 121.694 -0.629 . . . . 0.0 110.086 179.323 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 268' ' ' THR . . . . . . . . . . . . . 39.3 p -75.33 135.88 40.86 Favored 'General case' 0 N--CA 1.498 1.932 0 O-C-N 121.656 -0.652 . . . . 0.0 110.059 -179.437 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 269' ' ' ALA . . . . . . . . . . . . . . . -170.02 162.2 6.64 Favored Pre-proline 0 N--CA 1.498 1.935 0 O-C-N 121.571 -0.705 . . . . 0.0 109.962 179.761 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 270' ' ' PRO . . . . . . . . . . . . . 17.2 Cg_exo -63.31 126.05 16.97 Favored 'Trans proline' 0 N--CA 1.49 1.284 0 O-C-N 123.603 1.317 . . . . 0.0 110.573 179.473 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 271' ' ' SER . . . . . . . . . . . . . 3.1 m -95.99 -33.36 12.17 Favored 'General case' 0 N--CA 1.496 1.852 0 O-C-N 121.632 -0.667 . . . . 0.0 110.289 179.112 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 272' ' ' ASP . . . . . . . . . . . . . 11.4 p-10 -128.55 -163.75 1.31 Allowed 'General case' 0 N--CA 1.496 1.871 0 O-C-N 121.601 -0.687 . . . . 0.0 110.15 -179.136 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 273' ' ' LEU . . . . . . . . . . . . . 44.4 mt 54.5 101.79 0.01 OUTLIER 'General case' 0 N--CA 1.507 2.392 0 O-C-N 121.71 -0.619 . . . . 0.0 111.297 179.894 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 274' ' ' ALA . . . . . . . . . . . . . . . 55.66 99.46 0.02 OUTLIER 'General case' 0 N--CA 1.505 2.286 0 O-C-N 121.607 -0.683 . . . . 0.0 111.045 179.889 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 275' ' ' THR . . . . . . . . . . . . . 22.5 m -119.88 91.16 44.97 Favored Pre-proline 0 N--CA 1.496 1.825 0 O-C-N 121.814 -0.554 . . . . 0.0 110.001 178.431 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 276' ' ' PRO . . . . . . . . . . . . . 18.5 Cg_endo -64.01 -30.8 66.54 Favored 'Trans proline' 0 N--CA 1.491 1.335 0 O-C-N 123.457 1.24 . . . . 0.0 110.736 -177.589 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 277' ' ' GLN . . . . . . . . . . . . . 50.0 mm-40 -81.56 152.26 69.6 Favored Pre-proline 0 N--CA 1.497 1.884 0 O-C-N 121.624 -0.673 . . . . 0.0 110.088 179.559 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 278' ' ' PRO . . . . . . . . . . . . . 28.4 Cg_endo -67.3 136.17 39.34 Favored 'Trans proline' 0 N--CA 1.487 1.133 0 O-C-N 123.599 1.315 . . . . 0.0 110.365 -179.845 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 279' ' ' SER . . . . . . . . . . . . . 88.6 p -149.47 162.35 40.31 Favored 'General case' 0 N--CA 1.495 1.802 0 O-C-N 121.763 -0.586 . . . . 0.0 110.289 -179.628 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 280' ' ' THR . . . . . . . . . . . . . 9.7 t -134.68 158.19 44.73 Favored 'General case' 0 N--CA 1.497 1.877 0 O-C-N 121.711 -0.618 . . . . 0.0 110.3 179.08 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 281' ' ' PHE . . . . . . . . . . . . . 24.3 p90 -76.92 147.7 77.76 Favored Pre-proline 0 N--CA 1.499 1.991 0 O-C-N 121.624 -0.672 . . . . 0.0 110.109 -179.225 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 282' ' ' PRO . . . . . . . . . . . . . 37.5 Cg_endo -70.62 152.25 64.71 Favored 'Trans proline' 0 N--CA 1.487 1.114 0 O-C-N 123.515 1.271 . . . . 0.0 110.198 179.644 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 283' ' ' GLN . . . . . . . . . . . . . 7.9 mt-30 -89.52 -52.37 0.34 Allowed Pre-proline 0 N--CA 1.499 1.986 0 O-C-N 121.635 -0.666 . . . . 0.0 111.326 -176.312 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 284' ' ' PRO . . . . . 0.417 ' N ' ' CD ' ' B' ' 285' ' ' PRO . 26.9 Cg_exo -54.32 -48.1 23.32 Favored 'Trans proline' 0 N--CA 1.493 1.472 0 O-C-N 123.053 1.028 . . . . 0.0 112.055 -174.439 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 285' ' ' PRO . . . . . 0.417 ' CD ' ' N ' ' B' ' 284' ' ' PRO . 19.8 Cg_exo -62.21 100.62 0.22 Allowed 'Trans proline' 0 N--CA 1.493 1.451 0 O-C-N 123.091 1.048 . . . . 0.0 110.785 -177.65 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 286' ' ' VAL . . . . . . . . . . . . . 57.6 t -70.34 -34.94 60.33 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.099 0 O-C-N 121.717 -0.614 . . . . 0.0 109.647 178.273 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 287' ' ' GLU . . . . . . . . . . . . . 77.6 mt-10 54.06 177.31 0.02 OUTLIER 'General case' 0 N--CA 1.506 2.368 0 O-C-N 121.686 -0.634 . . . . 0.0 111.222 -179.48 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 288' ' ' SER . . . . . . . . . . . . . 3.5 m -99.49 -36.16 9.65 Favored 'General case' 0 N--CA 1.494 1.773 0 O-C-N 121.571 -0.706 . . . . 0.0 110.409 -178.889 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 289' ' ' HIS . . . . . . . . . . . . . 76.9 m80 -115.76 139.02 50.56 Favored 'General case' 0 N--CA 1.496 1.84 0 O-C-N 121.672 -0.643 . . . . 0.0 110.277 -178.165 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 290' ' ' SER . . . . . . . . . . . . . 33.2 t -130.83 142.6 50.4 Favored 'General case' 0 N--CA 1.496 1.844 0 O-C-N 121.765 -0.585 . . . . 0.0 110.123 179.033 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 291' ' ' SER . . . . . . . . . . . . . 3.5 t . . . . . 0 N--CA 1.495 1.814 0 CA-C-O 118.037 -0.983 . . . . 0.0 110.166 -179.925 . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' -1' ' ' MET . . . . . . . . . . . . . 22.9 ttt . . . . . 0 N--CA 1.492 1.649 0 CA-C-O 121.065 0.459 . . . . 0.0 110.257 . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 0' ' ' GLY . . . . . . . . . . . . . . . 91.26 168.03 41.35 Favored Glycine 0 N--CA 1.493 2.478 0 N-CA-C 109.535 -1.426 . . . . 0.0 109.535 -179.875 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 65.6 mtt -136.36 158.67 43.86 Favored 'General case' 0 N--CA 1.495 1.791 0 O-C-N 121.637 -0.919 . . . . 0.0 110.275 179.989 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 70.5 m -101.04 170.58 8.18 Favored 'General case' 0 N--CA 1.494 1.768 0 O-C-N 121.658 -0.651 . . . . 0.0 110.067 178.809 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 3' ' ' VAL . . . . . 0.43 HG11 ' CB ' ' A' ' 28' ' ' PHE . 51.0 t -64.7 -28.33 44.56 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.207 0 O-C-N 121.625 -0.672 . . . . 0.0 110.245 -179.283 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -56.09 -32.55 64.26 Favored 'General case' 0 N--CA 1.503 2.215 0 O-C-N 121.479 -0.763 . . . . 0.0 110.35 179.609 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 9.7 m-20 -68.8 -35.63 77.25 Favored 'General case' 0 N--CA 1.498 1.958 0 O-C-N 121.862 -0.524 . . . . 0.0 109.932 175.725 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 6' ' ' PHE . . . . . 0.402 ' CD1' HD21 ' B' ' 260' ' ' LEU . 97.0 m-85 -97.94 10.08 41.17 Favored 'General case' 0 N--CA 1.497 1.891 0 O-C-N 121.723 -0.611 . . . . 0.0 111.24 178.904 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -67.51 128.2 35.56 Favored 'General case' 0 N--CA 1.5 2.047 0 O-C-N 121.294 -0.879 . . . . 0.0 109.927 179.134 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 8' ' ' GLY . . . . . 0.466 ' O ' HG13 ' A' ' 24' ' ' VAL . . . 82.27 -0.33 88.99 Favored Glycine 0 N--CA 1.496 2.694 0 N-CA-C 110.616 -0.994 . . . . 0.0 110.616 -174.976 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 32.0 t -77.17 137.69 39.03 Favored 'General case' 0 N--CA 1.498 1.93 0 O-C-N 121.144 -1.21 . . . . 0.0 110.432 177.599 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 14.6 t-20 -83.96 119.23 24.65 Favored 'General case' 0 N--CA 1.498 1.953 0 O-C-N 121.671 -0.643 . . . . 0.0 109.782 174.642 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 11' ' ' VAL . . . . . 0.521 HG12 ' HA ' ' A' ' 57' ' ' ILE . 34.6 m -143.01 161.83 17.54 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.811 0 N-CA-C 109.567 -0.531 . . . . 0.0 109.567 -179.854 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 12' ' ' GLU . . . . . 0.451 ' HB2' HD11 ' A' ' 58' ' ' LEU . 35.4 tt0 -109.41 129.59 55.54 Favored 'General case' 0 N--CA 1.493 1.685 0 C-N-CA 119.87 -0.732 . . . . 0.0 110.126 178.448 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 13' ' ' VAL . . . . . 0.562 HG22 ' CD2' ' A' ' 55' ' ' LEU . 58.9 t -106.74 127.65 62.08 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.772 0 O-C-N 121.68 -0.638 . . . . 0.0 109.827 -179.402 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 28.5 tp -95.86 126.05 40.85 Favored 'General case' 0 N--CA 1.494 1.746 0 N-CA-C 109.077 -0.712 . . . . 0.0 109.077 174.485 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 86.7 mt -96.01 166.93 11.53 Favored 'General case' 0 N--CA 1.495 1.794 0 C-N-CA 120.087 -0.645 . . . . 0.0 111.166 -172.496 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 24.1 p30 -58.4 -21.82 51.82 Favored 'General case' 0 N--CA 1.505 2.323 0 O-C-N 121.82 -0.55 . . . . 0.0 111.668 -177.029 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 42.5 p-10 -92.73 23.45 4.11 Favored 'General case' 0 N--CA 1.498 1.966 0 O-C-N 121.576 -0.703 . . . . 0.0 110.811 -176.041 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 74.4 m-20 58.85 27.29 15.93 Favored 'General case' 0 N--CA 1.507 2.379 0 O-C-N 121.558 -0.714 . . . . 0.0 110.608 175.805 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 50.5 m -106.96 145.44 32.25 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.526 -0.734 . . . . 0.0 109.575 172.831 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 98.1 mttt -109.61 147.72 32.55 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.59 -0.694 . . . . 0.0 110.571 -176.345 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -153.08 153.97 33.91 Favored 'General case' 0 N--CA 1.497 1.911 0 O-C-N 121.796 -0.565 . . . . 0.0 110.254 176.204 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 33.0 ptt180 -142.69 150.35 40.04 Favored 'General case' 0 N--CA 1.496 1.842 0 O-C-N 121.648 -0.658 . . . . 0.0 110.308 178.364 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 23' ' ' GLY . . . . . 0.425 ' HA2' HD13 ' A' ' 39' ' ' LEU . . . -171.9 171.17 43.98 Favored Glycine 0 N--CA 1.492 2.429 0 N-CA-C 109.167 -1.573 . . . . 0.0 109.167 -179.871 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 24' ' ' VAL . . . . . 0.466 HG13 ' O ' ' A' ' 8' ' ' GLY . 45.2 t -94.61 126.65 46.99 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.88 0 O-C-N 121.7 -0.882 . . . . 0.0 109.237 176.363 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 25' ' ' ILE . . . . . 0.468 ' HA ' HD23 ' A' ' 37' ' ' LEU . 47.7 mt -61.73 138.0 22.94 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.249 0 O-C-N 121.57 -0.706 . . . . 0.0 110.854 -170.373 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 26' ' ' THR . . . . . 0.671 HG21 ' HB2' ' A' ' 38' ' ' ARG . 13.2 p -121.24 -19.65 7.0 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.9 -0.5 . . . . 0.0 111.515 -179.937 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 1.5 t-20 -165.98 158.18 14.47 Favored 'General case' 0 N--CA 1.504 2.25 0 O-C-N 120.826 -1.172 . . . . 0.0 111.922 176.221 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 28' ' ' PHE . . . . . 0.43 ' CB ' HG11 ' A' ' 3' ' ' VAL . 65.0 t80 -150.3 120.7 7.37 Favored 'General case' 0 N--CA 1.495 1.818 0 N-CA-C 109.166 -0.679 . . . . 0.0 109.166 173.431 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 17.9 t70 -97.81 127.42 43.75 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.593 -0.692 . . . . 0.0 109.212 -177.713 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 22.1 m -66.41 -46.53 76.24 Favored 'General case' 0 N--CA 1.499 2.0 0 O-C-N 121.524 -0.735 . . . . 0.0 110.772 -175.174 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 21.1 m -58.92 -47.36 85.3 Favored 'General case' 0 N--CA 1.502 2.174 0 O-C-N 121.602 -0.686 . . . . 0.0 110.957 -173.796 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 92.4 m-20 -106.29 -3.22 21.45 Favored 'General case' 0 N--CA 1.497 1.889 0 O-C-N 121.536 -0.727 . . . . 0.0 111.711 -178.188 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 15.3 m 49.14 67.15 0.92 Allowed 'General case' 0 N--CA 1.507 2.419 0 O-C-N 121.049 -1.032 . . . . 0.0 110.907 -174.314 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 34' ' ' ILE . . . . . 1.067 HD12 HG22 ' A' ' 48' ' ' VAL . 43.7 mm -114.64 125.78 72.04 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.936 0 O-C-N 121.545 -0.722 . . . . 0.0 109.21 -175.55 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 14.5 tp -115.98 119.03 34.6 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.609 -0.682 . . . . 0.0 110.47 -169.858 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 44.6 mt-30 -91.04 131.94 36.32 Favored 'General case' 0 N--CA 1.491 1.593 0 N-CA-C 109.182 -0.673 . . . . 0.0 109.182 170.838 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 0.468 HD23 ' HA ' ' A' ' 25' ' ' ILE . 49.4 mt -117.73 123.49 46.17 Favored 'General case' 0 N--CA 1.493 1.707 0 C-N-CA 120.177 -0.609 . . . . 0.0 110.041 175.926 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 38' ' ' ARG . . . . . 0.671 ' HB2' HG21 ' A' ' 26' ' ' THR . 57.2 ttt85 -105.0 104.95 14.78 Favored 'General case' 0 N--CA 1.495 1.782 0 O-C-N 121.77 -0.582 . . . . 0.0 110.076 173.877 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.425 HD13 ' HA2' ' A' ' 23' ' ' GLY . 65.3 tp -83.29 157.23 22.71 Favored 'General case' 0 N--CA 1.497 1.923 0 O-C-N 121.626 -0.671 . . . . 0.0 110.669 -176.344 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -67.89 -2.94 8.28 Favored 'General case' 0 N--CA 1.503 2.193 0 O-C-N 121.823 -0.548 . . . . 0.0 112.208 -170.819 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 29.9 m120 -86.63 29.21 0.8 Allowed 'General case' 0 N--CA 1.498 1.971 0 O-C-N 121.05 -1.031 . . . . 0.0 110.789 173.591 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 73.7 m-20 60.33 31.47 20.42 Favored 'General case' 0 N--CA 1.506 2.334 0 O-C-N 121.164 -0.96 . . . . 0.0 110.258 175.699 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 68.1 m -126.05 144.72 50.61 Favored 'General case' 0 N--CA 1.494 1.755 0 O-C-N 121.477 -0.765 . . . . 0.0 110.112 177.873 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 9.8 t -128.17 147.82 50.58 Favored 'General case' 0 N--CA 1.496 1.828 0 O-C-N 121.653 -0.654 . . . . 0.0 109.919 179.604 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 45' ' ' LYS . . . . . 0.778 ' HE2' HD11 ' A' ' 47' ' ' ILE . 6.0 ttpm? -150.38 130.04 13.15 Favored 'General case' 0 N--CA 1.495 1.82 0 O-C-N 121.716 -0.615 . . . . 0.0 110.505 -177.369 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 88.5 p -95.89 123.47 39.49 Favored 'General case' 0 N--CA 1.494 1.77 0 O-C-N 121.683 -0.635 . . . . 0.0 110.396 179.748 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 47' ' ' ILE . . . . . 0.778 HD11 ' HE2' ' A' ' 45' ' ' LYS . 80.6 mt -129.31 138.25 54.86 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.889 0 N-CA-C 109.19 -0.67 . . . . 0.0 109.19 177.647 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 48' ' ' VAL . . . . . 1.067 HG22 HD12 ' A' ' 34' ' ' ILE . 67.9 t -82.05 127.65 39.43 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.876 0 O-C-N 121.6 -0.687 . . . . 0.0 109.183 177.766 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 49' ' ' THR . . . . . 0.47 ' HB ' HD22 ' B' ' 264' ' ' LEU . 47.3 p -58.13 -24.92 60.59 Favored 'General case' 0 N--CA 1.505 2.283 0 O-C-N 121.539 -0.726 . . . . 0.0 111.964 -169.142 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 31.5 tttp -56.92 -26.87 60.17 Favored 'General case' 0 N--CA 1.502 2.131 0 O-C-N 121.529 -0.732 . . . . 0.0 110.963 -177.08 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 4.7 p30 -85.21 7.37 22.23 Favored 'General case' 0 N--CA 1.499 1.99 0 C-N-CA 119.677 -0.809 . . . . 0.0 111.353 176.538 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 98.2 mt -75.04 125.59 34.78 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.111 0 O-C-N 121.119 -0.988 . . . . 0.0 109.878 175.186 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 50.4 tttm -92.16 -31.34 15.52 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.812 -0.555 . . . . 0.0 109.718 170.68 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 54' ' ' ASP . . . . . 0.405 ' HA ' HD22 ' B' ' 261' ' ' LEU . 1.0 OUTLIER -161.11 153.38 20.17 Favored 'General case' 0 N--CA 1.499 1.991 0 O-C-N 121.699 -0.626 . . . . 0.0 110.072 -176.418 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 55' ' ' LEU . . . . . 0.562 ' CD2' HG22 ' A' ' 13' ' ' VAL . 85.2 mt -132.92 149.92 52.2 Favored 'General case' 0 N--CA 1.497 1.925 0 O-C-N 121.745 -0.597 . . . . 0.0 110.523 -179.311 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 4.9 ptm180 -152.27 140.86 20.79 Favored 'General case' 0 N--CA 1.496 1.869 0 O-C-N 121.783 -0.573 . . . . 0.0 109.856 175.118 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 57' ' ' ILE . . . . . 0.521 ' HA ' HG12 ' A' ' 11' ' ' VAL . 59.3 mt -85.28 133.3 29.73 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.863 0 O-C-N 121.428 -0.795 . . . . 0.0 109.856 174.667 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 58' ' ' LEU . . . . . 0.451 HD11 ' HB2' ' A' ' 12' ' ' GLU . 83.1 mt -82.87 159.92 62.07 Favored Pre-proline 0 N--CA 1.498 1.942 0 O-C-N 121.631 -0.668 . . . . 0.0 110.051 -179.09 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 19.6 Cg_endo -64.53 145.29 87.21 Favored 'Trans proline' 0 N--CA 1.489 1.233 0 O-C-N 123.64 1.337 . . . . 0.0 110.563 -178.699 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 18.9 tptm -125.55 148.55 48.87 Favored 'General case' 0 N--CA 1.496 1.855 0 O-C-N 121.72 -0.612 . . . . 0.0 110.164 -179.775 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 37.0 t30 -90.15 134.34 34.34 Favored 'General case' 0 N--CA 1.496 1.845 0 O-C-N 121.603 -0.686 . . . . 0.0 110.21 -179.306 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 75.0 mm-40 -97.66 177.88 5.34 Favored 'General case' 0 N--CA 1.496 1.835 0 O-C-N 121.656 -0.652 . . . . 0.0 110.166 -179.638 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 63' ' ' ILE . . . . . 0.514 ' O ' HG23 ' A' ' 63' ' ' ILE . 16.2 tt -138.94 64.26 0.21 Allowed 'Isoleucine or valine' 0 N--CA 1.497 1.916 0 O-C-N 121.719 -0.613 . . . . 0.0 110.211 -179.148 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 64' ' ' MET . . . . . . . . . . . . . 2.9 ptt? 37.25 54.1 3.12 Favored Pre-proline 0 N--CA 1.513 2.692 0 N-CA-C 112.709 0.633 . . . . 0.0 112.709 179.153 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 23.3 Cg_endo -65.47 -30.5 52.52 Favored 'Trans proline' 0 N--CA 1.49 1.265 0 O-C-N 123.393 1.207 . . . . 0.0 110.602 -179.761 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 27.0 mtpp -91.23 156.0 18.15 Favored 'General case' 0 N--CA 1.496 1.842 0 O-C-N 121.595 -0.691 . . . . 0.0 110.153 179.917 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 17.0 t-20 -94.61 130.48 41.04 Favored 'General case' 0 N--CA 1.496 1.836 0 O-C-N 121.691 -0.63 . . . . 0.0 110.261 -179.042 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 81.48 33.46 28.14 Favored Glycine 0 N--CA 1.495 2.598 0 N-CA-C 109.714 -1.354 . . . . 0.0 109.714 179.872 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 24.7 m -128.96 137.12 51.19 Favored 'General case' 0 N--CA 1.495 1.796 0 O-C-N 121.653 -0.91 . . . . 0.0 110.097 179.444 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 53.8 mttp -111.45 117.54 33.34 Favored 'General case' 0 N--CA 1.496 1.843 0 O-C-N 121.714 -0.616 . . . . 0.0 110.218 179.787 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -77.15 -56.43 1.24 Allowed Pre-proline 0 N--CA 1.496 1.867 0 O-C-N 121.696 -0.628 . . . . 0.0 110.626 179.265 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 38.0 Cg_endo -72.41 154.89 55.87 Favored 'Trans proline' 0 N--CA 1.486 1.062 0 O-C-N 123.337 1.177 . . . . 0.0 110.376 -177.756 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 23.0 t -64.34 -33.02 74.87 Favored 'General case' 0 N--CA 1.502 2.142 0 O-C-N 121.685 -0.634 . . . . 0.0 110.418 179.751 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 10.0 t -130.74 152.74 49.76 Favored 'General case' 0 N--CA 1.496 1.828 0 O-C-N 121.673 -0.642 . . . . 0.0 110.366 179.718 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 12.6 t-20 -117.66 115.66 25.52 Favored 'General case' 0 N--CA 1.495 1.819 0 O-C-N 121.739 -0.601 . . . . 0.0 110.104 -179.554 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 30.3 t -122.05 120.41 34.25 Favored 'General case' 0 N--CA 1.496 1.835 0 O-C-N 121.716 -0.615 . . . . 0.0 110.259 -179.928 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 69.6 p 44.25 30.26 0.44 Allowed 'General case' 0 N--CA 1.51 2.563 0 CA-C-O 120.972 0.415 . . . . 0.0 111.969 177.975 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 18.6 tptm -68.83 -44.81 72.67 Favored 'General case' 0 N--CA 1.498 1.97 0 O-C-N 121.531 -0.731 . . . . 0.0 110.117 -179.388 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 82.8 mt -110.21 134.56 52.1 Favored 'General case' 0 N--CA 1.496 1.853 0 O-C-N 121.651 -0.655 . . . . 0.0 110.254 -179.924 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 52.4 pttt -65.42 -32.12 73.58 Favored 'General case' 0 N--CA 1.498 1.971 0 O-C-N 121.599 -0.688 . . . . 0.0 110.653 179.631 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 23.4 t -63.86 -37.8 88.73 Favored 'General case' 0 N--CA 1.502 2.141 0 O-C-N 121.662 -0.649 . . . . 0.0 110.503 -178.838 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -113.14 29.98 7.56 Favored 'General case' 0 N--CA 1.496 1.849 0 O-C-N 121.659 -0.65 . . . . 0.0 110.484 179.931 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 41.1 tt0 -69.56 -38.08 77.27 Favored 'General case' 0 N--CA 1.499 2.001 0 O-C-N 121.583 -0.698 . . . . 0.0 110.167 -179.968 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 42.0 p -77.88 -35.57 50.71 Favored 'General case' 0 N--CA 1.498 1.966 0 O-C-N 121.677 -0.64 . . . . 0.0 110.351 -179.034 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 99.1 m-85 -121.64 132.46 54.67 Favored 'General case' 0 N--CA 1.496 1.847 0 O-C-N 121.696 -0.627 . . . . 0.0 110.314 -179.568 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 11.3 t -101.03 -51.88 3.42 Favored 'General case' 0 N--CA 1.494 1.768 0 O-C-N 121.737 -0.602 . . . . 0.0 110.233 178.906 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 50.4 m -129.4 147.6 51.23 Favored 'General case' 0 N--CA 1.496 1.865 0 O-C-N 121.718 -0.614 . . . . 0.0 110.185 179.562 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 25.3 mmmt -127.37 144.1 51.11 Favored 'General case' 0 N--CA 1.496 1.859 0 O-C-N 121.672 -0.643 . . . . 0.0 110.163 179.704 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 29.8 m120 -106.38 119.95 40.6 Favored 'General case' 0 N--CA 1.495 1.813 0 O-C-N 121.677 -0.639 . . . . 0.0 110.1 179.276 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 52.4 mttp -94.75 -68.97 0.77 Allowed 'General case' 0 N--CA 1.495 1.795 0 O-C-N 121.719 -0.613 . . . . 0.0 110.321 -179.263 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 91' ' ' TRP . . . . . . . . . . . . . 86.6 t90 -133.33 133.21 42.23 Favored 'General case' 0 N--CA 1.495 1.777 0 O-C-N 121.525 -0.734 . . . . 0.0 110.269 -179.185 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 3.7 m -151.24 -70.84 0.17 Allowed 'General case' 0 N--CA 1.495 1.786 0 O-C-N 121.729 -0.607 . . . . 0.0 110.119 178.355 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 93' ' ' MET . . . . . . . . . . . . . 89.1 mmm -70.98 -38.77 72.75 Favored 'General case' 0 N--CA 1.499 2.005 0 O-C-N 121.63 -0.669 . . . . 0.0 110.087 178.966 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 2.6 p30 . . . . . 0 N--CA 1.498 1.952 0 CA-C-O 118.078 -0.963 . . . . 0.0 110.219 -179.659 . . . . . . . . 0 0 . 1 . 019 nuclear build full ' B' B ' 240' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.267 0 N-CA-C 109.532 -1.427 . . . . 0.0 109.532 . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' B' B ' 241' ' ' ALA . . . . . . . . . . . . . . . -148.02 157.99 43.81 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.692 -0.887 . . . . 0.0 110.262 -179.995 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 242' ' ' THR . . . . . . . . . . . . . 51.5 p -127.11 158.02 38.13 Favored 'General case' 0 N--CA 1.496 1.871 0 O-C-N 121.613 -0.679 . . . . 0.0 110.181 -179.847 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 243' ' ' THR . . . . . 0.469 HG22 ' O ' ' B' ' 243' ' ' THR . 15.5 m 51.84 29.85 6.42 Favored 'General case' 0 N--CA 1.506 2.345 0 O-C-N 121.655 -0.653 . . . . 0.0 111.197 -179.518 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 244' ' ' LYS . . . . . . . . . . . . . 17.0 ttmm -112.27 -48.73 3.01 Favored 'General case' 0 N--CA 1.496 1.834 0 O-C-N 121.641 -0.662 . . . . 0.0 110.202 179.669 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 245' ' ' GLU . . . . . . . . . . . . . 45.7 tt0 -100.84 140.39 35.19 Favored 'General case' 0 N--CA 1.494 1.757 0 O-C-N 121.721 -0.612 . . . . 0.0 110.227 -179.446 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 246' ' ' LYS . . . . . . . . . . . . . 72.5 tttt -92.49 140.42 29.59 Favored 'General case' 0 N--CA 1.495 1.812 0 O-C-N 121.718 -0.614 . . . . 0.0 110.146 179.76 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 247' ' ' ASN . . . . . . . . . . . . . 17.4 t-20 -94.4 114.76 26.85 Favored 'General case' 0 N--CA 1.495 1.821 0 O-C-N 121.738 -0.601 . . . . 0.0 110.165 -179.801 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 248' ' ' ILE . . . . . 0.414 HG23 ' N ' ' B' ' 249' ' ' SER . 7.1 tp -163.48 -40.24 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.498 1.951 0 O-C-N 121.692 -0.63 . . . . 0.0 110.502 -179.585 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 249' ' ' SER . . . . . 0.414 ' N ' HG23 ' B' ' 248' ' ' ILE . 87.0 p -69.18 170.71 9.59 Favored 'General case' 0 N--CA 1.498 1.964 0 O-C-N 121.516 -0.74 . . . . 0.0 110.245 -179.984 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 250' ' ' VAL . . . . . . . . . . . . . 28.6 m -149.02 161.23 5.26 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.98 0 O-C-N 121.658 -0.651 . . . . 0.0 109.989 -179.466 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 251' ' ' ASP . . . . . . . . . . . . . 74.5 m-20 52.3 -176.93 0.02 OUTLIER 'General case' 0 N--CA 1.506 2.366 0 O-C-N 121.614 -0.679 . . . . 0.0 111.195 -179.028 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 252' ' ' VAL . . . . . 0.441 HG12 ' N ' ' B' ' 253' ' ' ASP . 42.3 t 57.54 165.46 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.51 2.569 0 O-C-N 121.767 -0.583 . . . . 0.0 110.718 -179.008 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 253' ' ' ASP . . . . . 0.551 ' OD2' ' HB2' ' B' ' 256' ' ' ALA . 11.4 p-10 -162.28 146.03 11.89 Favored 'General case' 0 N--CA 1.497 1.879 0 O-C-N 121.383 -0.823 . . . . 0.0 110.42 178.506 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 254' ' ' ALA . . . . . . . . . . . . . . . -67.49 -27.92 67.41 Favored 'General case' 0 N--CA 1.499 2.016 0 O-C-N 121.684 -0.635 . . . . 0.0 110.781 -179.398 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 255' ' ' ASP . . . . . . . . . . . . . 26.1 t0 -71.24 -32.33 68.64 Favored 'General case' 0 N--CA 1.498 1.972 0 O-C-N 121.542 -0.724 . . . . 0.0 110.306 -177.362 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 256' ' ' ALA . . . . . 0.551 ' HB2' ' OD2' ' B' ' 253' ' ' ASP . . . -64.26 -47.13 80.76 Favored 'General case' 0 N--CA 1.5 2.07 0 O-C-N 121.563 -0.711 . . . . 0.0 110.353 179.896 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 257' ' ' SER . . . . . . . . . . . . . 49.0 m -55.64 -35.76 66.29 Favored 'General case' 0 N--CA 1.503 2.21 0 O-C-N 121.678 -0.639 . . . . 0.0 110.482 178.181 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 258' ' ' SER . . . . . . . . . . . . . 25.1 m -69.29 -31.79 70.52 Favored 'General case' 0 N--CA 1.497 1.892 0 O-C-N 121.864 -0.523 . . . . 0.0 110.351 -179.937 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 259' ' ' GLN . . . . . . . . . . . . . 58.2 tp60 -62.65 -40.04 95.78 Favored 'General case' 0 N--CA 1.501 2.1 0 O-C-N 121.601 -0.687 . . . . 0.0 110.494 -178.665 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 260' ' ' LEU . . . . . 0.488 ' HA ' HD12 ' B' ' 263' ' ' LEU . 82.8 mt -68.83 -43.04 76.36 Favored 'General case' 0 N--CA 1.499 1.996 0 O-C-N 121.691 -0.631 . . . . 0.0 110.293 179.958 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 261' ' ' LEU . . . . . 0.405 HD22 ' HA ' ' A' ' 54' ' ' ASP . 17.6 tp -69.24 -36.22 76.94 Favored 'General case' 0 N--CA 1.498 1.941 0 O-C-N 121.586 -0.696 . . . . 0.0 109.768 177.87 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 262' ' ' SER . . . . . . . . . . . . . 22.7 t -62.33 -37.33 85.22 Favored 'General case' 0 N--CA 1.501 2.105 0 O-C-N 121.762 -0.586 . . . . 0.0 110.424 176.864 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 263' ' ' LEU . . . . . 0.488 HD12 ' HA ' ' B' ' 260' ' ' LEU . 33.0 mt -64.93 -41.72 95.3 Favored 'General case' 0 N--CA 1.5 2.068 0 O-C-N 121.726 -0.609 . . . . 0.0 110.31 179.552 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 264' ' ' LEU . . . . . 0.505 ' CD1' HD11 ' A' ' 55' ' ' LEU . 86.4 mt -62.05 -33.4 74.31 Favored 'General case' 0 N--CA 1.503 2.182 0 O-C-N 121.671 -0.643 . . . . 0.0 110.49 177.261 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 265' ' ' LYS . . . . . . . . . . . . . 79.5 mttt -75.17 -29.71 60.51 Favored 'General case' 0 N--CA 1.499 2.004 0 O-C-N 121.663 -0.648 . . . . 0.0 110.51 179.615 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 266' ' ' SER . . . . . . . . . . . . . 83.6 p -77.46 158.37 30.02 Favored 'General case' 0 N--CA 1.497 1.913 0 O-C-N 121.521 -0.737 . . . . 0.0 110.157 -179.824 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 267' ' ' SER . . . . . . . . . . . . . 10.5 t -92.69 -41.5 10.13 Favored 'General case' 0 N--CA 1.495 1.805 0 O-C-N 121.689 -0.632 . . . . 0.0 110.446 -178.155 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 268' ' ' THR . . . . . . . . . . . . . 39.9 p -126.82 151.17 48.66 Favored 'General case' 0 N--CA 1.496 1.835 0 O-C-N 121.636 -0.665 . . . . 0.0 110.323 -179.355 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 269' ' ' ALA . . . . . . . . . . . . . . . -72.89 159.75 84.56 Favored Pre-proline 0 N--CA 1.498 1.953 0 C-N-CA 120.351 -0.54 . . . . 0.0 110.095 178.762 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 270' ' ' PRO . . . . . . . . . . . . . 20.7 Cg_exo -61.73 -32.55 86.51 Favored 'Trans proline' 0 N--CA 1.492 1.387 0 O-C-N 123.627 1.33 . . . . 0.0 110.654 178.986 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 271' ' ' SER . . . . . . . . . . . . . 50.0 m -126.11 150.38 48.25 Favored 'General case' 0 N--CA 1.496 1.86 0 O-C-N 121.736 -0.603 . . . . 0.0 110.229 179.969 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 272' ' ' ASP . . . . . . . . . . . . . 74.4 m-20 -70.67 143.18 51.46 Favored 'General case' 0 N--CA 1.498 1.97 0 O-C-N 121.711 -0.618 . . . . 0.0 110.107 179.413 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 273' ' ' LEU . . . . . 0.515 ' O ' HG23 ' B' ' 275' ' ' THR . 83.1 mt 56.48 -82.74 0.01 OUTLIER 'General case' 0 N--CA 1.506 2.352 0 O-C-N 121.943 -0.473 . . . . 0.0 111.279 -178.574 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 274' ' ' ALA . . . . . . . . . . . . . . . 51.84 36.52 18.28 Favored 'General case' 0 N--CA 1.506 2.362 0 O-C-N 121.16 -0.963 . . . . 0.0 111.017 -178.755 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 275' ' ' THR . . . . . 0.515 HG23 ' O ' ' B' ' 273' ' ' LEU . 22.6 p -125.01 78.51 66.18 Favored Pre-proline 0 N--CA 1.495 1.821 0 O-C-N 121.567 -0.708 . . . . 0.0 110.127 179.355 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 276' ' ' PRO . . . . . . . . . . . . . 29.4 Cg_endo -67.82 155.46 69.78 Favored 'Trans proline' 0 N--CA 1.487 1.113 0 O-C-N 123.486 1.256 . . . . 0.0 110.412 179.672 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 277' ' ' GLN . . . . . . . . . . . . . 34.1 mt-30 -86.9 162.44 44.22 Favored Pre-proline 0 N--CA 1.497 1.895 0 O-C-N 121.689 -0.632 . . . . 0.0 110.134 179.662 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 278' ' ' PRO . . . . . . . . . . . . . 25.2 Cg_endo -66.35 138.85 52.33 Favored 'Trans proline' 0 N--CA 1.488 1.173 0 O-C-N 123.622 1.327 . . . . 0.0 110.415 -179.339 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 279' ' ' SER . . . . . . . . . . . . . 24.7 m -66.4 -34.12 77.24 Favored 'General case' 0 N--CA 1.499 2.008 0 O-C-N 121.661 -0.65 . . . . 0.0 110.313 -179.957 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 280' ' ' THR . . . . . . . . . . . . . 9.7 t -135.39 161.87 34.21 Favored 'General case' 0 N--CA 1.496 1.866 0 O-C-N 121.67 -0.644 . . . . 0.0 110.419 -179.292 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 281' ' ' PHE . . . . . . . . . . . . . 17.1 p90 -68.41 154.9 93.68 Favored Pre-proline 0 N--CA 1.498 1.97 0 O-C-N 121.722 -0.611 . . . . 0.0 110.25 179.818 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 282' ' ' PRO . . . . . . . . . . . . . 28.7 Cg_endo -67.26 -43.82 5.66 Favored 'Trans proline' 0 N--CA 1.488 1.196 0 O-C-N 123.711 1.374 . . . . 0.0 110.477 -179.322 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 283' ' ' GLN . . . . . . . . . . . . . 15.6 mt-30 -141.58 160.14 57.71 Favored Pre-proline 0 N--CA 1.494 1.762 0 O-C-N 121.652 -0.655 . . . . 0.0 110.211 179.681 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 284' ' ' PRO . . . . . . . . . . . . . 15.9 Cg_exo -64.32 154.87 68.87 Favored 'Trans proline' 0 N--CA 1.488 1.201 0 O-C-N 123.591 1.311 . . . . 0.0 110.536 -179.807 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 285' ' ' PRO . . . . . . . . . . . . . 33.0 Cg_endo -69.22 173.9 9.81 Favored 'Trans proline' 0 N--CA 1.488 1.193 0 O-C-N 123.713 1.375 . . . . 0.0 110.243 178.8 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 286' ' ' VAL . . . . . . . . . . . . . 13.4 p -128.0 137.34 57.8 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.885 0 O-C-N 121.731 -0.606 . . . . 0.0 110.107 179.617 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 287' ' ' GLU . . . . . . . . . . . . . 46.3 mt-10 -71.95 -36.54 69.91 Favored 'General case' 0 N--CA 1.499 2.018 0 O-C-N 121.645 -0.66 . . . . 0.0 110.359 -178.594 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 288' ' ' SER . . . . . . . . . . . . . 30.8 t -110.91 143.72 41.1 Favored 'General case' 0 N--CA 1.495 1.823 0 O-C-N 121.61 -0.681 . . . . 0.0 110.297 -178.676 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 289' ' ' HIS . . . . . . . . . . . . . 30.5 p80 -125.12 152.21 44.71 Favored 'General case' 0 N--CA 1.495 1.814 0 O-C-N 121.744 -0.597 . . . . 0.0 110.228 179.757 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 290' ' ' SER . . . . . . . . . . . . . 38.7 t 52.22 30.38 7.75 Favored 'General case' 0 N--CA 1.505 2.325 0 O-C-N 121.599 -0.688 . . . . 0.0 111.088 -179.637 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 291' ' ' SER . . . . . . . . . . . . . 29.5 t . . . . . 0 N--CA 1.494 1.765 0 CA-C-O 117.957 -1.021 . . . . 0.0 110.231 -179.819 . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' -1' ' ' MET . . . . . . . . . . . . . 61.1 mtt . . . . . 0 N--CA 1.493 1.678 0 CA-C-O 121.02 0.438 . . . . 0.0 110.213 . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 0' ' ' GLY . . . . . . . . . . . . . . . -85.09 -176.88 50.83 Favored Glycine 0 N--CA 1.493 2.49 0 N-CA-C 109.612 -1.395 . . . . 0.0 109.612 -179.923 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 24.8 ptm -124.02 52.25 1.48 Allowed 'General case' 0 N--CA 1.498 1.965 0 O-C-N 121.643 -0.916 . . . . 0.0 110.2 179.86 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 73.1 m -97.39 175.83 6.11 Favored 'General case' 0 N--CA 1.494 1.751 0 O-C-N 121.611 -0.681 . . . . 0.0 110.285 -178.387 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 3' ' ' VAL . . . . . 0.424 HG12 ' CE1' ' A' ' 7' ' ' TYR . 83.2 t -67.74 -27.64 38.78 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.095 0 O-C-N 121.754 -0.591 . . . . 0.0 110.251 -179.407 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -54.99 -30.33 59.12 Favored 'General case' 0 N--CA 1.505 2.281 0 O-C-N 121.446 -0.783 . . . . 0.0 110.533 -178.196 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 74.5 m-20 -68.74 -30.69 69.36 Favored 'General case' 0 N--CA 1.499 1.998 0 O-C-N 121.82 -0.55 . . . . 0.0 110.298 174.859 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 96.0 m-85 -95.59 10.03 38.14 Favored 'General case' 0 N--CA 1.497 1.903 0 O-C-N 121.538 -0.726 . . . . 0.0 111.485 -178.24 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 7' ' ' TYR . . . . . 0.424 ' CE1' HG12 ' A' ' 3' ' ' VAL . 3.6 m-30 -67.3 138.6 56.95 Favored 'General case' 0 N--CA 1.501 2.095 0 O-C-N 121.154 -0.966 . . . . 0.0 110.166 174.27 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 83.3 -2.27 87.35 Favored Glycine 0 N--CA 1.498 2.8 0 N-CA-C 110.757 -0.937 . . . . 0.0 110.757 -177.289 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 27.7 t -76.24 138.2 40.44 Favored 'General case' 0 N--CA 1.497 1.878 0 O-C-N 121.117 -1.225 . . . . 0.0 110.446 179.581 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 10' ' ' ASN . . . . . 0.684 ' CG ' HG22 ' A' ' 24' ' ' VAL . 2.5 m120 -83.4 118.37 23.67 Favored 'General case' 0 N--CA 1.498 1.937 0 O-C-N 121.629 -0.669 . . . . 0.0 109.411 173.882 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 11' ' ' VAL . . . . . 0.594 HG21 HD11 ' A' ' 25' ' ' ILE . 35.2 m -143.21 161.0 17.42 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.836 0 O-C-N 121.812 -0.555 . . . . 0.0 109.638 -178.361 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 12' ' ' GLU . . . . . 0.566 ' HB2' HD11 ' A' ' 58' ' ' LEU . 40.6 tt0 -109.48 126.02 53.08 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.481 -0.762 . . . . 0.0 110.111 178.075 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 13' ' ' VAL . . . . . 0.588 HG22 ' CD2' ' A' ' 55' ' ' LEU . 60.0 t -106.81 124.4 62.44 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.782 0 O-C-N 121.663 -0.648 . . . . 0.0 110.005 -178.521 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 21.9 tp -95.96 129.27 43.26 Favored 'General case' 0 N--CA 1.494 1.758 0 O-C-N 121.697 -0.627 . . . . 0.0 109.495 174.073 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 85.9 mt -98.86 167.24 10.88 Favored 'General case' 0 N--CA 1.495 1.803 0 O-C-N 121.607 -0.683 . . . . 0.0 111.052 -172.75 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 9.6 p30 -57.95 -22.35 48.63 Favored 'General case' 0 N--CA 1.505 2.313 0 O-C-N 121.832 -0.543 . . . . 0.0 111.555 -177.412 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 43.5 p-10 -92.46 23.28 4.05 Favored 'General case' 0 N--CA 1.498 1.97 0 O-C-N 121.428 -0.795 . . . . 0.0 110.847 -176.823 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 58.77 27.83 16.52 Favored 'General case' 0 N--CA 1.505 2.279 0 O-C-N 121.498 -0.751 . . . . 0.0 110.714 175.194 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 50.8 m -105.54 133.98 49.4 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.531 -0.731 . . . . 0.0 109.542 171.754 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 33.0 ttmt -109.81 141.86 41.88 Favored 'General case' 0 N--CA 1.495 1.799 0 O-C-N 121.714 -0.616 . . . . 0.0 110.46 -176.044 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -153.12 156.09 37.99 Favored 'General case' 0 N--CA 1.496 1.836 0 O-C-N 121.625 -0.672 . . . . 0.0 110.267 178.941 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 22' ' ' ARG . . . . . 0.5 ' O ' HD13 ' A' ' 39' ' ' LEU . 31.1 ptt180 -140.55 146.58 38.25 Favored 'General case' 0 N--CA 1.497 1.9 0 O-C-N 121.623 -0.673 . . . . 0.0 110.558 179.832 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -171.73 171.48 44.11 Favored Glycine 0 N--CA 1.495 2.589 0 N-CA-C 108.829 -1.709 . . . . 0.0 108.829 -175.132 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 24' ' ' VAL . . . . . 0.684 HG22 ' CG ' ' A' ' 10' ' ' ASN . 39.8 t -94.56 120.54 44.13 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.874 0 O-C-N 121.419 -1.048 . . . . 0.0 109.309 -175.904 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 25' ' ' ILE . . . . . 0.648 ' HA ' HD23 ' A' ' 37' ' ' LEU . 75.2 mt -64.31 141.98 17.47 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.102 0 O-C-N 121.545 -0.722 . . . . 0.0 110.402 -172.093 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 26' ' ' THR . . . . . 0.645 HG21 ' HB2' ' A' ' 38' ' ' ARG . 5.7 p -121.26 -26.44 5.06 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.653 -0.654 . . . . 0.0 111.345 -179.949 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 27' ' ' ASN . . . . . 0.51 ' O ' HD12 ' A' ' 35' ' ' LEU . 2.1 t-20 -162.09 160.41 27.34 Favored 'General case' 0 N--CA 1.5 2.053 0 C-N-CA 118.877 -1.129 . . . . 0.0 111.872 -179.244 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 28' ' ' PHE . . . . . 0.534 ' HE1' HG21 ' A' ' 49' ' ' THR . 85.0 t80 -150.01 126.57 10.9 Favored 'General case' 0 N--CA 1.497 1.904 0 N-CA-C 109.116 -0.698 . . . . 0.0 109.116 169.436 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 26.7 t0 -99.77 130.4 45.97 Favored 'General case' 0 N--CA 1.491 1.599 0 N-CA-C 109.064 -0.717 . . . . 0.0 109.064 -177.019 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 22.8 t -68.85 -50.15 52.39 Favored 'General case' 0 N--CA 1.498 1.962 0 C-N-CA 120.037 -0.665 . . . . 0.0 110.597 -176.662 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 19.8 m -59.7 -42.55 93.26 Favored 'General case' 0 N--CA 1.502 2.146 0 O-C-N 121.614 -0.679 . . . . 0.0 110.915 -174.366 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 91.4 m-20 -103.97 -10.08 18.38 Favored 'General case' 0 N--CA 1.497 1.921 0 O-C-N 121.565 -0.709 . . . . 0.0 111.66 -178.136 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 3.0 m 50.09 67.21 0.95 Allowed 'General case' 0 N--CA 1.508 2.443 0 O-C-N 121.0 -1.062 . . . . 0.0 110.943 -174.345 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 34' ' ' ILE . . . . . 1.122 HD12 HG22 ' A' ' 48' ' ' VAL . 47.4 mm -124.72 126.95 72.36 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.072 0 O-C-N 121.541 -0.724 . . . . 0.0 109.469 -175.711 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.51 HD12 ' O ' ' A' ' 27' ' ' ASN . 11.7 tp -115.78 120.57 39.73 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.675 -0.641 . . . . 0.0 110.501 -169.851 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 99.1 mt-30 -91.06 134.66 34.33 Favored 'General case' 0 N--CA 1.491 1.607 0 N-CA-C 109.39 -0.596 . . . . 0.0 109.39 174.24 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 0.648 HD23 ' HA ' ' A' ' 25' ' ' ILE . 88.8 mt -117.87 123.8 46.75 Favored 'General case' 0 N--CA 1.497 1.915 0 O-C-N 121.772 -0.58 . . . . 0.0 109.896 173.527 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 38' ' ' ARG . . . . . 0.645 ' HB2' HG21 ' A' ' 26' ' ' THR . 73.3 ttt-85 -97.11 109.09 21.91 Favored 'General case' 0 N--CA 1.497 1.877 0 O-C-N 121.699 -0.626 . . . . 0.0 109.8 175.863 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.5 HD13 ' O ' ' A' ' 22' ' ' ARG . 17.6 tp -85.07 150.63 24.73 Favored 'General case' 0 N--CA 1.494 1.774 0 O-C-N 121.706 -0.621 . . . . 0.0 110.928 -173.91 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -62.3 -10.39 10.86 Favored 'General case' 0 N--CA 1.504 2.233 0 O-C-N 121.907 -0.495 . . . . 0.0 111.892 -173.059 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 39.7 t30 -85.16 29.14 0.67 Allowed 'General case' 0 N--CA 1.499 2.008 0 O-C-N 121.151 -0.968 . . . . 0.0 110.94 174.651 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 74.3 m-20 59.68 31.69 21.03 Favored 'General case' 0 N--CA 1.505 2.307 0 O-C-N 121.213 -0.929 . . . . 0.0 110.424 174.031 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 52.2 m -123.3 137.91 54.74 Favored 'General case' 0 N--CA 1.495 1.797 0 O-C-N 121.413 -0.805 . . . . 0.0 110.348 178.609 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 8.9 t -98.06 149.5 22.42 Favored 'General case' 0 N--CA 1.497 1.902 0 O-C-N 121.694 -0.629 . . . . 0.0 110.274 176.937 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 78.0 tttt -149.72 119.16 6.89 Favored 'General case' 0 N--CA 1.495 1.805 0 O-C-N 121.577 -0.702 . . . . 0.0 110.33 177.897 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 88.7 p -95.52 123.98 39.33 Favored 'General case' 0 N--CA 1.494 1.767 0 O-C-N 121.673 -0.642 . . . . 0.0 110.24 179.009 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 81.4 mt -129.35 135.3 62.05 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.838 0 O-C-N 121.621 -0.674 . . . . 0.0 109.311 179.555 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 48' ' ' VAL . . . . . 1.122 HG22 HD12 ' A' ' 34' ' ' ILE . 59.7 t -82.21 127.59 39.49 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.883 0 O-C-N 121.581 -0.699 . . . . 0.0 109.265 179.122 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 49' ' ' THR . . . . . 0.534 HG21 ' HE1' ' A' ' 28' ' ' PHE . 37.7 p -59.21 -24.95 63.57 Favored 'General case' 0 N--CA 1.504 2.25 0 O-C-N 121.611 -0.681 . . . . 0.0 112.06 -169.721 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 57.9 mttm -56.55 -22.91 36.5 Favored 'General case' 0 N--CA 1.503 2.213 0 O-C-N 121.466 -0.771 . . . . 0.0 110.991 -176.833 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 51.0 p30 -83.98 1.26 44.49 Favored 'General case' 0 N--CA 1.499 1.995 0 O-C-N 121.406 -0.809 . . . . 0.0 111.288 176.376 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 99.0 mt -75.63 126.66 36.63 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.066 0 O-C-N 121.171 -0.956 . . . . 0.0 110.042 178.883 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 37.6 ttpt -93.08 -29.27 15.88 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.851 -0.53 . . . . 0.0 109.893 170.562 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 5.1 m-20 -164.07 155.86 16.57 Favored 'General case' 0 N--CA 1.5 2.056 0 O-C-N 121.748 -0.595 . . . . 0.0 109.952 -178.251 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 55' ' ' LEU . . . . . 0.588 ' CD2' HG22 ' A' ' 13' ' ' VAL . 82.7 mt -132.89 149.69 52.23 Favored 'General case' 0 N--CA 1.496 1.849 0 O-C-N 121.645 -0.659 . . . . 0.0 110.62 -178.804 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 9.5 ptp85 -151.43 144.55 24.63 Favored 'General case' 0 N--CA 1.496 1.838 0 O-C-N 121.71 -0.619 . . . . 0.0 110.083 174.438 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 57' ' ' ILE . . . . . 0.482 ' HA ' HG12 ' A' ' 11' ' ' VAL . 66.6 mt -86.33 133.16 30.43 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.745 0 O-C-N 121.523 -0.736 . . . . 0.0 109.66 171.697 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 58' ' ' LEU . . . . . 0.566 HD11 ' HB2' ' A' ' 12' ' ' GLU . 61.8 mt -83.05 138.29 42.78 Favored Pre-proline 0 N--CA 1.497 1.884 0 O-C-N 121.626 -0.671 . . . . 0.0 109.981 -179.781 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 32.3 Cg_endo -68.54 -32.49 24.62 Favored 'Trans proline' 0 N--CA 1.489 1.23 0 O-C-N 123.511 1.269 . . . . 0.0 110.512 -178.995 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 18.3 tptm -84.29 134.75 34.51 Favored 'General case' 0 N--CA 1.497 1.891 0 O-C-N 121.644 -0.66 . . . . 0.0 110.237 -178.881 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 24.3 p30 -140.3 -175.69 4.35 Favored 'General case' 0 N--CA 1.496 1.858 0 O-C-N 121.708 -0.62 . . . . 0.0 110.323 179.728 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 29.9 tp10 -95.16 139.37 31.6 Favored 'General case' 0 N--CA 1.495 1.785 0 O-C-N 121.662 -0.649 . . . . 0.0 110.155 -179.931 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 7.5 tp -68.96 137.69 23.82 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.949 0 O-C-N 121.697 -0.627 . . . . 0.0 110.191 -179.732 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 64' ' ' MET . . . . . . . . . . . . . 2.0 ttt -161.73 90.25 1.46 Allowed Pre-proline 0 N--CA 1.496 1.835 0 O-C-N 121.773 -0.58 . . . . 0.0 110.069 -179.741 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 18.7 Cg_exo -62.67 140.22 79.66 Favored 'Trans proline' 0 N--CA 1.489 1.263 0 O-C-N 123.543 1.286 . . . . 0.0 110.608 179.645 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 32.1 ttmt -159.7 33.07 0.19 Allowed 'General case' 0 N--CA 1.494 1.769 0 O-C-N 121.661 -0.649 . . . . 0.0 110.25 179.847 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 18.0 t-20 -140.55 57.39 1.58 Allowed 'General case' 0 N--CA 1.494 1.773 0 O-C-N 121.647 -0.658 . . . . 0.0 110.039 179.979 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 85.53 -160.21 34.18 Favored Glycine 0 N--CA 1.494 2.525 0 N-CA-C 109.477 -1.449 . . . . 0.0 109.477 -179.6 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 40.0 p -117.88 157.66 26.26 Favored 'General case' 0 N--CA 1.496 1.847 0 O-C-N 121.66 -0.906 . . . . 0.0 110.14 -179.913 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 30.5 mtmm -92.21 -64.57 1.09 Allowed 'General case' 0 N--CA 1.496 1.86 0 O-C-N 121.667 -0.645 . . . . 0.0 110.207 -179.932 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 17.0 p -94.06 161.9 28.34 Favored Pre-proline 0 N--CA 1.494 1.737 0 O-C-N 121.649 -0.657 . . . . 0.0 110.233 -179.215 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 23.3 Cg_endo -65.88 164.67 26.24 Favored 'Trans proline' 0 N--CA 1.489 1.25 0 O-C-N 123.689 1.363 . . . . 0.0 110.397 179.677 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 84.4 p -96.95 25.96 4.98 Favored 'General case' 0 N--CA 1.497 1.876 0 O-C-N 121.684 -0.635 . . . . 0.0 110.848 -179.091 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 36.0 p -105.34 29.52 6.39 Favored 'General case' 0 N--CA 1.497 1.894 0 O-C-N 121.441 -0.787 . . . . 0.0 110.491 179.642 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 10.5 t-20 57.76 166.91 0.04 OUTLIER 'General case' 0 N--CA 1.506 2.342 0 O-C-N 121.57 -0.706 . . . . 0.0 111.022 -178.99 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 93.7 p -141.8 155.04 45.6 Favored 'General case' 0 N--CA 1.496 1.839 0 O-C-N 121.646 -0.659 . . . . 0.0 110.152 179.169 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 77' ' ' THR . . . . . 0.646 HG23 ' H ' ' A' ' 80' ' ' LYS . 6.3 t -138.99 151.27 46.72 Favored 'General case' 0 N--CA 1.498 1.956 0 O-C-N 121.637 -0.665 . . . . 0.0 110.366 179.666 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 23.5 ttpp -70.11 -42.55 72.51 Favored 'General case' 0 N--CA 1.499 1.98 0 O-C-N 121.694 -0.629 . . . . 0.0 110.22 179.161 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 79' ' ' LEU . . . . . 0.493 HD23 ' OG ' ' A' ' 81' ' ' SER . 22.4 tp -66.12 -34.83 78.95 Favored 'General case' 0 N--CA 1.501 2.077 0 O-C-N 121.683 -0.636 . . . . 0.0 110.256 -178.904 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 80' ' ' LYS . . . . . 0.646 ' H ' HG23 ' A' ' 77' ' ' THR . 54.7 mttp 54.19 41.01 32.2 Favored 'General case' 0 N--CA 1.507 2.389 0 O-C-N 121.696 -0.628 . . . . 0.0 110.947 178.662 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 81' ' ' SER . . . . . 0.493 ' OG ' HD23 ' A' ' 79' ' ' LEU . 97.7 p -112.26 130.58 55.89 Favored 'General case' 0 N--CA 1.496 1.83 0 O-C-N 121.601 -0.687 . . . . 0.0 110.117 178.524 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -165.05 -174.32 3.25 Favored 'General case' 0 N--CA 1.497 1.875 0 O-C-N 121.595 -0.691 . . . . 0.0 110.19 -179.942 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 77.6 mt-10 -96.95 152.87 18.29 Favored 'General case' 0 N--CA 1.495 1.777 0 O-C-N 121.636 -0.665 . . . . 0.0 109.97 178.503 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 23.7 m -96.99 134.15 40.73 Favored 'General case' 0 N--CA 1.495 1.782 0 O-C-N 121.685 -0.634 . . . . 0.0 110.35 -178.279 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 97.2 m-85 -123.76 153.07 41.45 Favored 'General case' 0 N--CA 1.495 1.803 0 O-C-N 121.716 -0.615 . . . . 0.0 110.079 178.461 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 22.9 t -74.14 112.87 10.71 Favored 'General case' 0 N--CA 1.498 1.951 0 O-C-N 121.718 -0.614 . . . . 0.0 110.097 -179.603 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 24.8 t -160.27 172.31 17.59 Favored 'General case' 0 N--CA 1.494 1.731 0 O-C-N 121.727 -0.608 . . . . 0.0 110.215 -179.601 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 94.1 mttt -87.45 143.47 27.21 Favored 'General case' 0 N--CA 1.497 1.896 0 O-C-N 121.649 -0.657 . . . . 0.0 110.043 179.299 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 91.6 m-20 -103.21 125.06 49.7 Favored 'General case' 0 N--CA 1.495 1.794 0 O-C-N 121.71 -0.619 . . . . 0.0 110.242 -179.468 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 18.9 tptm -95.44 -61.55 1.45 Allowed 'General case' 0 N--CA 1.495 1.787 0 O-C-N 121.734 -0.604 . . . . 0.0 110.144 179.696 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 91' ' ' TRP . . . . . . . . . . . . . 98.1 m95 -121.1 154.87 35.58 Favored 'General case' 0 N--CA 1.496 1.832 0 O-C-N 121.627 -0.671 . . . . 0.0 110.157 179.878 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 50.5 m -112.63 146.46 38.59 Favored 'General case' 0 N--CA 1.495 1.794 0 O-C-N 121.771 -0.581 . . . . 0.0 110.206 -179.889 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 93' ' ' MET . . . . . . . . . . . . . 4.1 mmt -65.62 -34.7 78.84 Favored 'General case' 0 N--CA 1.501 2.111 0 O-C-N 121.735 -0.603 . . . . 0.0 110.419 -179.519 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 20.3 t0 . . . . . 0 N--CA 1.495 1.804 0 CA-C-O 118.007 -0.996 . . . . 0.0 110.176 -179.908 . . . . . . . . 0 0 . 1 . 020 nuclear build full ' B' B ' 240' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.284 0 N-CA-C 109.553 -1.419 . . . . 0.0 109.553 . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' B' B ' 241' ' ' ALA . . . . . . . . . . . . . . . -144.01 156.31 44.35 Favored 'General case' 0 N--CA 1.495 1.776 0 O-C-N 121.713 -0.875 . . . . 0.0 110.256 -179.898 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 242' ' ' THR . . . . . . . . . . . . . 24.2 m -121.31 141.93 50.45 Favored 'General case' 0 N--CA 1.495 1.784 0 O-C-N 121.712 -0.617 . . . . 0.0 110.199 -179.843 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 243' ' ' THR . . . . . . . . . . . . . 40.1 p -123.36 159.92 27.87 Favored 'General case' 0 N--CA 1.496 1.853 0 O-C-N 121.762 -0.587 . . . . 0.0 110.138 -179.935 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 244' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER 52.57 -177.75 0.02 OUTLIER 'General case' 0 N--CA 1.508 2.435 0 O-C-N 121.688 -0.633 . . . . 0.0 111.153 -179.829 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 245' ' ' GLU . . . . . . . . . . . . . 74.5 mm-40 -126.92 157.13 40.23 Favored 'General case' 0 N--CA 1.496 1.83 0 O-C-N 121.554 -0.716 . . . . 0.0 110.157 179.421 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 246' ' ' LYS . . . . . . . . . . . . . 27.0 mtpp -94.14 76.26 4.04 Favored 'General case' 0 N--CA 1.495 1.825 0 O-C-N 121.658 -0.651 . . . . 0.0 110.151 179.632 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 247' ' ' ASN . . . . . . . . . . . . . 89.8 m-20 52.8 35.7 19.44 Favored 'General case' 0 N--CA 1.506 2.35 0 O-C-N 121.522 -0.736 . . . . 0.0 111.006 179.536 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 248' ' ' ILE . . . . . . . . . . . . . 50.2 mm 52.25 90.34 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.507 2.402 0 O-C-N 121.572 -0.705 . . . . 0.0 110.652 -179.888 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 249' ' ' SER . . . . . . . . . . . . . 86.0 p -102.93 29.19 5.59 Favored 'General case' 0 N--CA 1.495 1.804 0 O-C-N 121.689 -0.632 . . . . 0.0 110.556 179.92 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 250' ' ' VAL . . . . . . . . . . . . . 12.5 p -152.79 147.19 14.75 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.867 0 O-C-N 121.53 -0.731 . . . . 0.0 110.151 -179.033 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 251' ' ' ASP . . . . . . . . . . . . . 75.9 m-20 53.07 47.5 24.42 Favored 'General case' 0 N--CA 1.506 2.371 0 O-C-N 121.592 -0.693 . . . . 0.0 110.743 179.82 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 252' ' ' VAL . . . . . 0.5 HG12 ' OD1' ' B' ' 253' ' ' ASP . 59.5 t -81.59 138.72 19.09 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.95 0 O-C-N 121.571 -0.705 . . . . 0.0 110.135 -177.277 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 253' ' ' ASP . . . . . 0.5 ' OD1' HG12 ' B' ' 252' ' ' VAL . 1.1 m-20 54.93 177.1 0.03 OUTLIER 'General case' 0 N--CA 1.506 2.359 0 CA-C-O 121.337 0.589 . . . . 0.0 111.506 176.951 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 254' ' ' ALA . . . . . . . . . . . . . . . -72.18 -8.44 54.78 Favored 'General case' 0 N--CA 1.501 2.076 0 O-C-N 121.744 -0.597 . . . . 0.0 111.753 -179.311 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 255' ' ' ASP . . . . . . . . . . . . . 19.5 t0 -68.0 -28.14 67.17 Favored 'General case' 0 N--CA 1.502 2.13 0 O-C-N 121.178 -0.951 . . . . 0.0 110.425 -176.222 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 256' ' ' ALA . . . . . . . . . . . . . . . -63.61 -36.18 82.95 Favored 'General case' 0 N--CA 1.501 2.097 0 O-C-N 121.465 -0.772 . . . . 0.0 110.326 177.906 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 257' ' ' SER . . . . . . . . . . . . . 74.2 m -55.1 -35.01 64.16 Favored 'General case' 0 N--CA 1.503 2.208 0 O-C-N 121.648 -0.657 . . . . 0.0 110.499 178.436 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 258' ' ' SER . . . . . . . . . . . . . 24.9 m -68.16 -33.25 74.11 Favored 'General case' 0 N--CA 1.498 1.949 0 O-C-N 121.914 -0.491 . . . . 0.0 110.248 -179.468 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 259' ' ' GLN . . . . . . . . . . . . . 94.0 mm-40 -63.24 -36.79 84.83 Favored 'General case' 0 N--CA 1.501 2.109 0 O-C-N 121.648 -0.658 . . . . 0.0 110.463 -179.138 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 260' ' ' LEU . . . . . 0.496 ' HA ' HD12 ' B' ' 263' ' ' LEU . 81.9 mt -67.28 -42.43 83.84 Favored 'General case' 0 N--CA 1.499 2.025 0 O-C-N 121.646 -0.659 . . . . 0.0 110.191 178.989 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 261' ' ' LEU . . . . . . . . . . . . . 24.0 tp -69.79 -36.18 75.48 Favored 'General case' 0 N--CA 1.497 1.893 0 O-C-N 121.615 -0.678 . . . . 0.0 109.736 176.407 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 262' ' ' SER . . . . . . . . . . . . . 69.4 m -62.3 -36.34 81.84 Favored 'General case' 0 N--CA 1.5 2.066 0 O-C-N 121.761 -0.587 . . . . 0.0 110.465 177.41 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 263' ' ' LEU . . . . . 0.496 HD12 ' HA ' ' B' ' 260' ' ' LEU . 20.7 mt -65.31 -45.61 83.65 Favored 'General case' 0 N--CA 1.501 2.076 0 O-C-N 121.679 -0.638 . . . . 0.0 110.116 179.779 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 264' ' ' LEU . . . . . 0.418 HD12 ' CD1' ' A' ' 55' ' ' LEU . 85.3 mt -63.11 -33.67 75.96 Favored 'General case' 0 N--CA 1.502 2.16 0 O-C-N 121.749 -0.594 . . . . 0.0 110.493 177.531 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 265' ' ' LYS . . . . . . . . . . . . . 23.2 ttpt -74.8 -32.49 62.01 Favored 'General case' 0 N--CA 1.498 1.954 0 O-C-N 121.757 -0.589 . . . . 0.0 110.259 -178.633 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 266' ' ' SER . . . . . . . . . . . . . 32.3 t -162.47 133.33 4.92 Favored 'General case' 0 N--CA 1.495 1.81 0 O-C-N 121.556 -0.715 . . . . 0.0 110.136 179.831 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 267' ' ' SER . . . . . . . . . . . . . 23.3 t -152.82 174.41 14.1 Favored 'General case' 0 N--CA 1.495 1.797 0 O-C-N 121.74 -0.6 . . . . 0.0 110.032 179.899 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 268' ' ' THR . . . . . . . . . . . . . 23.8 m -70.1 126.82 30.8 Favored 'General case' 0 N--CA 1.498 1.948 0 O-C-N 121.7 -0.625 . . . . 0.0 110.012 179.963 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 269' ' ' ALA . . . . . . . . . . . . . . . -72.5 161.69 77.82 Favored Pre-proline 0 N--CA 1.499 1.987 0 O-C-N 121.683 -0.636 . . . . 0.0 110.272 -179.361 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 270' ' ' PRO . . . . . . . . . . . . . 23.3 Cg_endo -65.79 150.74 85.76 Favored 'Trans proline' 0 N--CA 1.488 1.202 0 O-C-N 123.744 1.391 . . . . 0.0 110.327 178.541 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 271' ' ' SER . . . . . . . . . . . . . 31.2 t -109.41 138.61 45.5 Favored 'General case' 0 N--CA 1.494 1.77 0 O-C-N 121.64 -0.662 . . . . 0.0 110.443 -178.393 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 272' ' ' ASP . . . . . . . . . . . . . 20.2 t0 -134.11 -58.51 0.85 Allowed 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.717 -0.614 . . . . 0.0 109.987 178.46 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 273' ' ' LEU . . . . . . . . . . . . . 11.1 tp -162.45 30.51 0.11 Allowed 'General case' 0 N--CA 1.495 1.798 0 O-C-N 121.723 -0.611 . . . . 0.0 110.315 177.597 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 274' ' ' ALA . . . . . . . . . . . . . . . -76.1 -37.62 57.92 Favored 'General case' 0 N--CA 1.499 1.989 0 O-C-N 121.534 -0.729 . . . . 0.0 110.224 -179.963 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 275' ' ' THR . . . . . . . . . . . . . 7.1 t -139.16 150.4 64.51 Favored Pre-proline 0 N--CA 1.497 1.885 0 O-C-N 121.695 -0.628 . . . . 0.0 110.212 -178.935 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 276' ' ' PRO . . . . . . . . . . . . . 23.8 Cg_endo -65.87 154.64 73.08 Favored 'Trans proline' 0 N--CA 1.489 1.231 0 O-C-N 123.479 1.252 . . . . 0.0 110.472 178.77 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 277' ' ' GLN . . . . . 0.411 ' N ' ' HD2' ' B' ' 278' ' ' PRO . 1.9 mp0 -64.06 -56.22 26.08 Favored Pre-proline 0 N--CA 1.5 2.043 0 O-C-N 121.701 -0.624 . . . . 0.0 110.79 -179.245 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 278' ' ' PRO . . . . . 0.411 ' HD2' ' N ' ' B' ' 277' ' ' GLN . 36.4 Cg_endo -70.93 119.35 6.25 Favored 'Trans proline' 0 N--CA 1.486 1.055 0 O-C-N 123.193 1.102 . . . . 0.0 110.33 -178.316 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 279' ' ' SER . . . . . . . . . . . . . 25.9 t -161.08 -70.13 0.06 Allowed 'General case' 0 N--CA 1.495 1.797 0 O-C-N 121.718 -0.614 . . . . 0.0 110.059 178.272 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 280' ' ' THR . . . . . . . . . . . . . 24.3 m -76.21 -40.23 52.75 Favored 'General case' 0 N--CA 1.498 1.949 0 O-C-N 121.627 -0.671 . . . . 0.0 109.977 178.048 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 281' ' ' PHE . . . . . . . . . . . . . 21.8 m-85 -152.46 93.44 3.32 Favored Pre-proline 0 N--CA 1.494 1.74 0 O-C-N 121.734 -0.604 . . . . 0.0 110.127 179.986 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 282' ' ' PRO . . . . . . . . . . . . . 24.0 Cg_exo -60.1 145.93 97.33 Favored 'Trans proline' 0 N--CA 1.491 1.346 0 O-C-N 123.439 1.231 . . . . 0.0 110.833 -178.7 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 283' ' ' GLN . . . . . . . . . . . . . 9.4 tt0 -119.31 99.38 50.38 Favored Pre-proline 0 N--CA 1.495 1.814 0 O-C-N 121.775 -0.578 . . . . 0.0 110.055 179.949 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 284' ' ' PRO . . . . . . . . . . . . . 20.3 Cg_endo -65.12 155.27 69.25 Favored 'Trans proline' 0 N--CA 1.489 1.245 0 O-C-N 123.338 1.178 . . . . 0.0 110.483 -178.378 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 285' ' ' PRO . . . . . . . . . . . . . 21.2 Cg_exo -61.54 152.87 70.5 Favored 'Trans proline' 0 N--CA 1.491 1.378 0 O-C-N 123.592 1.312 . . . . 0.0 110.745 -179.012 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 286' ' ' VAL . . . . . . . . . . . . . 26.9 m -128.39 157.46 40.81 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.022 0 O-C-N 121.807 -0.558 . . . . 0.0 110.018 178.663 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 287' ' ' GLU . . . . . . . . . . . . . 14.6 pt-20 -144.41 38.82 1.27 Allowed 'General case' 0 N--CA 1.497 1.879 0 O-C-N 121.677 -0.639 . . . . 0.0 110.464 -179.545 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 288' ' ' SER . . . . . . . . . . . . . 16.2 m -65.19 -35.22 80.4 Favored 'General case' 0 N--CA 1.5 2.039 0 O-C-N 121.677 -0.639 . . . . 0.0 110.338 179.527 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 289' ' ' HIS . . . . . . . . . . . . . 99.1 m-70 -133.33 161.57 34.14 Favored 'General case' 0 N--CA 1.495 1.794 0 O-C-N 121.668 -0.645 . . . . 0.0 110.174 179.838 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 290' ' ' SER . . . . . . . . . . . . . 96.9 p -120.47 154.41 35.27 Favored 'General case' 0 N--CA 1.496 1.846 0 O-C-N 121.628 -0.67 . . . . 0.0 110.173 179.881 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 291' ' ' SER . . . . . . . . . . . . . 71.9 p . . . . . 0 N--CA 1.495 1.799 0 CA-C-O 118.02 -0.991 . . . . 0.0 110.188 -179.955 . . . . . . . . 0 0 . 1 . 021 nuclear build full ' A' A ' -1' ' ' MET . . . . . . . . . . . . . 60.9 mtt . . . . . 0 N--CA 1.493 1.72 0 CA-C-O 121.002 0.43 . . . . 0.0 110.157 . . . . . . . . . 0 0 . 1 . 021 nuclear build full ' A' A ' 0' ' ' GLY . . . . . . . . . . . . . . . -144.62 109.67 0.53 Allowed Glycine 0 N--CA 1.494 2.533 0 N-CA-C 109.518 -1.433 . . . . 0.0 109.518 179.779 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 39.6 ttm -109.84 135.95 49.93 Favored 'General case' 0 N--CA 1.495 1.801 0 O-C-N 121.707 -0.878 . . . . 0.0 110.117 179.584 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 69.1 m -100.22 178.23 4.83 Favored 'General case' 0 N--CA 1.495 1.825 0 O-C-N 121.725 -0.61 . . . . 0.0 110.545 -176.528 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 52.2 t -66.13 -27.84 41.97 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.153 0 O-C-N 121.667 -0.645 . . . . 0.0 110.344 -179.059 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -55.43 -31.81 62.19 Favored 'General case' 0 N--CA 1.505 2.29 0 O-C-N 121.538 -0.726 . . . . 0.0 110.371 -178.057 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 73.7 m-20 -68.84 -35.16 76.62 Favored 'General case' 0 N--CA 1.498 1.951 0 O-C-N 121.747 -0.596 . . . . 0.0 109.912 175.24 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 6' ' ' PHE . . . . . 0.468 ' CE2' HD11 ' B' ' 260' ' ' LEU . 97.8 m-85 -97.93 10.02 41.31 Favored 'General case' 0 N--CA 1.497 1.9 0 O-C-N 121.751 -0.593 . . . . 0.0 111.284 178.826 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -67.41 129.53 40.19 Favored 'General case' 0 N--CA 1.501 2.114 0 O-C-N 121.208 -0.932 . . . . 0.0 109.975 178.694 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 8' ' ' GLY . . . . . 0.459 ' O ' HG13 ' A' ' 24' ' ' VAL . . . 82.08 0.93 90.14 Favored Glycine 0 N--CA 1.497 2.734 0 N-CA-C 110.647 -0.981 . . . . 0.0 110.647 -175.397 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 57.6 m -76.08 135.24 39.89 Favored 'General case' 0 N--CA 1.498 1.944 0 O-C-N 121.09 -1.241 . . . . 0.0 110.445 178.24 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 10' ' ' ASN . . . . . 0.405 ' CG ' HG22 ' A' ' 24' ' ' VAL . 0.1 OUTLIER -84.31 114.25 21.72 Favored 'General case' 0 N--CA 1.498 1.958 0 O-C-N 121.67 -0.644 . . . . 0.0 109.695 174.375 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 11' ' ' VAL . . . . . 0.553 HG12 ' HA ' ' A' ' 57' ' ' ILE . 35.8 m -140.23 164.04 22.93 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.835 0 O-C-N 121.772 -0.58 . . . . 0.0 109.463 179.992 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 12' ' ' GLU . . . . . 0.49 ' HB2' HD11 ' A' ' 58' ' ' LEU . 44.1 tt0 -109.36 129.6 55.53 Favored 'General case' 0 N--CA 1.492 1.654 0 C-N-CA 119.782 -0.767 . . . . 0.0 110.02 179.129 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 13' ' ' VAL . . . . . 0.598 HG22 ' CD2' ' A' ' 55' ' ' LEU . 60.3 t -106.69 127.36 62.24 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.726 0 O-C-N 121.546 -0.721 . . . . 0.0 110.015 -179.042 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.445 HD13 ' HG2' ' A' ' 20' ' ' LYS . 27.1 tp -95.87 125.45 40.44 Favored 'General case' 0 N--CA 1.494 1.769 0 N-CA-C 109.031 -0.729 . . . . 0.0 109.031 173.42 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 87.0 mt -95.51 168.29 10.79 Favored 'General case' 0 N--CA 1.496 1.847 0 O-C-N 121.581 -0.7 . . . . 0.0 111.113 -172.73 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 24.4 p30 -58.02 -21.68 46.21 Favored 'General case' 0 N--CA 1.506 2.339 0 O-C-N 121.856 -0.528 . . . . 0.0 111.632 -176.94 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 46.0 p-10 -91.6 22.51 4.02 Favored 'General case' 0 N--CA 1.499 1.996 0 O-C-N 121.517 -0.739 . . . . 0.0 110.919 -176.641 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 74.4 m-20 58.55 27.37 15.56 Favored 'General case' 0 N--CA 1.506 2.35 0 O-C-N 121.469 -0.769 . . . . 0.0 110.712 175.738 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 49.9 m -108.18 144.39 35.68 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.579 -0.701 . . . . 0.0 109.578 172.887 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 20' ' ' LYS . . . . . 0.445 ' HG2' HD13 ' A' ' 14' ' ' LEU . 48.2 mttm -109.57 145.47 36.32 Favored 'General case' 0 N--CA 1.495 1.806 0 O-C-N 121.61 -0.681 . . . . 0.0 110.615 -176.512 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -153.07 154.11 34.2 Favored 'General case' 0 N--CA 1.496 1.865 0 O-C-N 121.784 -0.573 . . . . 0.0 109.868 176.272 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 22' ' ' ARG . . . . . 0.407 ' O ' HD22 ' A' ' 39' ' ' LEU . 30.4 ptt180 -140.4 151.5 44.99 Favored 'General case' 0 N--CA 1.496 1.841 0 O-C-N 121.635 -0.666 . . . . 0.0 110.529 -179.513 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 23' ' ' GLY . . . . . 0.426 ' HA2' HD13 ' A' ' 39' ' ' LEU . . . -171.85 171.09 43.93 Favored Glycine 0 N--CA 1.492 2.419 0 N-CA-C 109.037 -1.625 . . . . 0.0 109.037 -179.846 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 24' ' ' VAL . . . . . 0.459 HG13 ' O ' ' A' ' 8' ' ' GLY . 61.3 t -94.63 127.24 46.77 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.845 0 O-C-N 121.651 -0.911 . . . . 0.0 109.163 176.34 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 25' ' ' ILE . . . . . 0.515 ' HA ' HD23 ' A' ' 37' ' ' LEU . 49.3 mt -61.37 138.4 22.12 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.185 0 O-C-N 121.594 -0.691 . . . . 0.0 110.874 -171.099 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 26' ' ' THR . . . . . 0.674 HG21 ' HB2' ' A' ' 38' ' ' ARG . 11.4 p -121.25 -20.59 6.66 Favored 'General case' 0 N--CA 1.493 1.717 0 O-C-N 121.876 -0.515 . . . . 0.0 111.49 -179.548 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 2.5 t-20 -165.48 158.57 15.99 Favored 'General case' 0 N--CA 1.505 2.311 0 O-C-N 120.945 -1.097 . . . . 0.0 111.871 177.093 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 65.1 t80 -150.41 119.95 6.95 Favored 'General case' 0 N--CA 1.497 1.901 0 N-CA-C 109.226 -0.657 . . . . 0.0 109.226 173.766 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 17.9 t70 -97.14 127.2 42.88 Favored 'General case' 0 N--CA 1.494 1.757 0 O-C-N 121.641 -0.662 . . . . 0.0 109.293 -177.113 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 22.7 t -65.85 -46.34 78.82 Favored 'General case' 0 N--CA 1.5 2.042 0 O-C-N 121.557 -0.715 . . . . 0.0 110.865 -175.11 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 21.4 t -58.61 -48.06 82.25 Favored 'General case' 0 N--CA 1.502 2.13 0 O-C-N 121.505 -0.747 . . . . 0.0 111.0 -173.575 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 92.4 m-20 -107.02 -1.87 21.69 Favored 'General case' 0 N--CA 1.498 1.927 0 O-C-N 121.594 -0.691 . . . . 0.0 111.804 -178.316 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 69.1 m 49.18 67.18 0.92 Allowed 'General case' 0 N--CA 1.508 2.438 0 O-C-N 121.082 -1.011 . . . . 0.0 110.901 -174.437 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 34' ' ' ILE . . . . . 1.102 HD12 HG22 ' A' ' 48' ' ' VAL . 44.2 mm -113.82 125.79 71.18 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.971 0 O-C-N 121.544 -0.723 . . . . 0.0 109.136 -175.215 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 10.9 tp -116.0 119.03 34.56 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.613 -0.679 . . . . 0.0 110.451 -169.816 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 78.2 mt-30 -90.98 132.39 36.0 Favored 'General case' 0 N--CA 1.489 1.523 0 N-CA-C 109.191 -0.67 . . . . 0.0 109.191 170.862 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 0.515 HD23 ' HA ' ' A' ' 25' ' ' ILE . 48.8 mt -117.81 123.47 46.03 Favored 'General case' 0 N--CA 1.493 1.71 0 C-N-CA 120.152 -0.619 . . . . 0.0 109.949 175.218 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 38' ' ' ARG . . . . . 0.674 ' HB2' HG21 ' A' ' 26' ' ' THR . 56.5 ttt85 -105.1 105.85 16.08 Favored 'General case' 0 N--CA 1.495 1.786 0 O-C-N 121.78 -0.575 . . . . 0.0 110.091 174.101 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.426 HD13 ' HA2' ' A' ' 23' ' ' GLY . 63.3 tp -83.37 155.04 23.72 Favored 'General case' 0 N--CA 1.498 1.949 0 O-C-N 121.609 -0.682 . . . . 0.0 110.515 -177.054 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -68.82 -2.91 10.61 Favored 'General case' 0 N--CA 1.504 2.243 0 O-C-N 121.885 -0.51 . . . . 0.0 112.131 -170.347 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 30.1 m120 -88.04 28.59 1.03 Allowed 'General case' 0 N--CA 1.497 1.907 0 O-C-N 121.029 -1.045 . . . . 0.0 110.795 174.878 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 13.5 t0 64.9 29.03 12.6 Favored 'General case' 0 N--CA 1.505 2.295 0 O-C-N 121.205 -0.934 . . . . 0.0 110.387 175.755 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 74.5 m -125.01 137.95 54.23 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.432 -0.792 . . . . 0.0 110.137 177.897 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 9.1 t -128.22 149.72 50.34 Favored 'General case' 0 N--CA 1.496 1.843 0 O-C-N 121.711 -0.618 . . . . 0.0 110.018 178.818 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 45' ' ' LYS . . . . . 0.422 ' HD3' HD11 ' A' ' 47' ' ' ILE . 57.7 tttm -151.15 134.9 16.44 Favored 'General case' 0 N--CA 1.497 1.879 0 O-C-N 121.704 -0.623 . . . . 0.0 110.574 -178.339 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 91.0 p -95.0 120.99 36.15 Favored 'General case' 0 N--CA 1.495 1.796 0 O-C-N 121.727 -0.608 . . . . 0.0 110.215 177.556 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 47' ' ' ILE . . . . . 0.422 HD11 ' HD3' ' A' ' 45' ' ' LYS . 80.9 mt -129.35 136.05 60.31 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.85 0 O-C-N 121.681 -0.637 . . . . 0.0 109.359 -179.597 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 48' ' ' VAL . . . . . 1.102 HG22 HD12 ' A' ' 34' ' ' ILE . 66.4 t -81.71 127.79 39.28 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.001 0 O-C-N 121.631 -0.668 . . . . 0.0 109.202 179.204 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 49' ' ' THR . . . . . 0.626 ' HB ' HD22 ' B' ' 264' ' ' LEU . 51.6 p -57.99 -25.06 60.56 Favored 'General case' 0 N--CA 1.505 2.295 0 O-C-N 121.463 -0.773 . . . . 0.0 111.87 -168.97 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 43.4 tptt -57.19 -26.06 60.02 Favored 'General case' 0 N--CA 1.502 2.134 0 O-C-N 121.507 -0.745 . . . . 0.0 111.066 -176.805 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 5.0 p30 -84.69 5.72 27.08 Favored 'General case' 0 N--CA 1.498 1.95 0 C-N-CA 119.69 -0.804 . . . . 0.0 111.286 176.323 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 96.5 mt -75.77 124.41 33.76 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.144 0 O-C-N 121.146 -0.971 . . . . 0.0 109.837 175.461 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 42.5 tttp -92.36 -28.68 16.76 Favored 'General case' 0 N--CA 1.495 1.803 0 C-N-CA 120.396 -0.521 . . . . 0.0 109.953 171.962 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 5.4 m-20 -163.75 154.57 15.92 Favored 'General case' 0 N--CA 1.501 2.085 0 O-C-N 121.791 -0.568 . . . . 0.0 110.125 -178.461 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 55' ' ' LEU . . . . . 0.598 ' CD2' HG22 ' A' ' 13' ' ' VAL . 84.4 mt -132.96 150.75 52.14 Favored 'General case' 0 N--CA 1.497 1.887 0 O-C-N 121.669 -0.645 . . . . 0.0 110.487 -179.181 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 19.6 ptp180 -151.59 145.71 25.31 Favored 'General case' 0 N--CA 1.495 1.797 0 O-C-N 121.688 -0.632 . . . . 0.0 110.009 174.824 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 57' ' ' ILE . . . . . 0.553 ' HA ' HG12 ' A' ' 11' ' ' VAL . 64.8 mt -86.32 133.27 30.16 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.837 0 O-C-N 121.527 -0.733 . . . . 0.0 109.86 173.864 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 58' ' ' LEU . . . . . 0.49 HD11 ' HB2' ' A' ' 12' ' ' GLU . 61.1 mt -83.27 163.11 51.76 Favored Pre-proline 0 N--CA 1.497 1.893 0 O-C-N 121.594 -0.692 . . . . 0.0 110.145 -178.903 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 31.9 Cg_exo -57.75 -27.78 79.25 Favored 'Trans proline' 0 N--CA 1.493 1.448 0 O-C-N 123.639 1.336 . . . . 0.0 111.109 -178.057 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 60.8 tttt -80.11 114.18 18.83 Favored 'General case' 0 N--CA 1.498 1.958 0 O-C-N 121.603 -0.685 . . . . 0.0 109.974 178.473 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 45.5 p30 -161.75 -167.53 1.72 Allowed 'General case' 0 N--CA 1.498 1.948 0 O-C-N 121.679 -0.638 . . . . 0.0 110.277 -178.576 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 50.9 mt-10 -95.63 158.27 15.53 Favored 'General case' 0 N--CA 1.496 1.845 0 O-C-N 121.687 -0.633 . . . . 0.0 110.122 179.326 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 19.0 tt -63.7 -32.7 57.91 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.052 0 O-C-N 121.709 -0.619 . . . . 0.0 110.509 -178.983 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 64' ' ' MET . . . . . . . . . . . . . 8.2 ttp 51.49 91.0 0.07 OUTLIER Pre-proline 0 N--CA 1.504 2.265 0 O-C-N 121.671 -0.643 . . . . 0.0 111.135 179.807 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 23.8 Cg_endo -65.91 139.49 57.01 Favored 'Trans proline' 0 N--CA 1.489 1.245 0 O-C-N 123.529 1.279 . . . . 0.0 110.43 179.779 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 38.5 ttpt -93.37 -49.63 5.84 Favored 'General case' 0 N--CA 1.495 1.801 0 O-C-N 121.687 -0.633 . . . . 0.0 110.281 -179.172 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 29.9 m120 -101.99 139.12 38.04 Favored 'General case' 0 N--CA 1.495 1.801 0 O-C-N 121.703 -0.623 . . . . 0.0 110.326 -178.747 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . -153.34 110.67 0.46 Allowed Glycine 0 N--CA 1.493 2.489 0 N-CA-C 109.434 -1.466 . . . . 0.0 109.434 179.385 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 40.3 p -125.54 166.57 16.42 Favored 'General case' 0 N--CA 1.496 1.871 0 O-C-N 121.606 -0.938 . . . . 0.0 110.247 -179.262 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 53.3 mttm -91.39 151.34 20.87 Favored 'General case' 0 N--CA 1.497 1.894 0 O-C-N 121.677 -0.639 . . . . 0.0 110.136 179.827 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 66.8 m -79.59 157.28 74.9 Favored Pre-proline 0 N--CA 1.498 1.936 0 O-C-N 121.754 -0.591 . . . . 0.0 110.193 -179.596 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 21.8 Cg_endo -65.29 -30.42 54.21 Favored 'Trans proline' 0 N--CA 1.49 1.291 0 O-C-N 123.729 1.384 . . . . 0.0 110.668 -179.861 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 97.2 p -105.76 156.52 18.22 Favored 'General case' 0 N--CA 1.495 1.795 0 O-C-N 121.58 -0.7 . . . . 0.0 110.207 179.856 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 24.0 m -104.45 138.73 40.4 Favored 'General case' 0 N--CA 1.494 1.775 0 O-C-N 121.815 -0.553 . . . . 0.0 110.225 -179.631 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 39.2 p-10 -142.28 -174.26 4.07 Favored 'General case' 0 N--CA 1.495 1.797 0 O-C-N 121.681 -0.637 . . . . 0.0 110.437 -179.832 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 76' ' ' SER . . . . . 0.401 ' CB ' HD23 ' A' ' 79' ' ' LEU . 11.8 t -74.35 157.92 34.87 Favored 'General case' 0 N--CA 1.498 1.965 0 O-C-N 121.689 -0.632 . . . . 0.0 110.12 179.983 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 23.5 m -105.88 143.44 34.02 Favored 'General case' 0 N--CA 1.495 1.805 0 O-C-N 121.691 -0.631 . . . . 0.0 110.28 -178.71 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 74.6 tttt 54.35 35.56 23.26 Favored 'General case' 0 N--CA 1.505 2.293 0 O-C-N 121.586 -0.696 . . . . 0.0 110.923 179.59 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 79' ' ' LEU . . . . . 0.582 HD13 ' O ' ' A' ' 79' ' ' LEU . 0.3 OUTLIER -68.05 -34.68 76.91 Favored 'General case' 0 N--CA 1.499 1.997 0 O-C-N 121.632 -0.667 . . . . 0.0 110.014 178.476 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 62.5 mttm -63.92 -32.95 74.66 Favored 'General case' 0 N--CA 1.502 2.137 0 O-C-N 121.726 -0.609 . . . . 0.0 110.429 179.742 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 30.6 t 56.7 -82.48 0.01 OUTLIER 'General case' 0 N--CA 1.507 2.412 0 O-C-N 122.046 -0.409 . . . . 0.0 111.367 -179.317 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -136.2 160.23 39.3 Favored 'General case' 0 N--CA 1.495 1.805 0 O-C-N 121.245 -0.909 . . . . 0.0 110.257 -178.233 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 44.7 tt0 -95.19 147.73 23.14 Favored 'General case' 0 N--CA 1.495 1.794 0 O-C-N 121.725 -0.61 . . . . 0.0 110.048 -179.906 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 84' ' ' THR . . . . . 0.475 ' HG1' ' HD1' ' A' ' 85' ' ' TYR . 27.5 p -66.19 -37.94 86.82 Favored 'General case' 0 N--CA 1.501 2.081 0 O-C-N 121.68 -0.638 . . . . 0.0 110.454 -177.972 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 85' ' ' TYR . . . . . 0.475 ' HD1' ' HG1' ' A' ' 84' ' ' THR . 96.4 m-85 -113.98 115.06 27.04 Favored 'General case' 0 N--CA 1.496 1.862 0 O-C-N 121.493 -0.754 . . . . 0.0 110.172 177.394 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 86.7 p -160.88 169.35 22.81 Favored 'General case' 0 N--CA 1.494 1.757 0 O-C-N 121.636 -0.665 . . . . 0.0 110.141 179.531 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 30.8 t -112.28 123.29 49.95 Favored 'General case' 0 N--CA 1.495 1.788 0 O-C-N 121.704 -0.623 . . . . 0.0 110.099 178.775 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 55.5 mtpt -67.77 -41.98 82.41 Favored 'General case' 0 N--CA 1.499 2.023 0 O-C-N 121.768 -0.583 . . . . 0.0 110.281 -179.431 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 91.8 m-20 -136.33 127.82 28.63 Favored 'General case' 0 N--CA 1.495 1.79 0 O-C-N 121.78 -0.575 . . . . 0.0 110.226 -179.976 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 71.6 mttt -65.35 -32.98 74.9 Favored 'General case' 0 N--CA 1.501 2.09 0 O-C-N 121.664 -0.648 . . . . 0.0 110.394 178.848 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 91' ' ' TRP . . . . . . . . . . . . . 48.7 p90 -115.34 155.76 26.75 Favored 'General case' 0 N--CA 1.496 1.852 0 O-C-N 121.718 -0.614 . . . . 0.0 110.275 179.683 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 25.6 t -109.48 141.22 42.22 Favored 'General case' 0 N--CA 1.495 1.784 0 O-C-N 121.72 -0.612 . . . . 0.0 110.28 -179.853 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 93' ' ' MET . . . . . . . . . . . . . 56.5 ttp -99.12 130.95 45.47 Favored 'General case' 0 N--CA 1.495 1.779 0 O-C-N 121.713 -0.617 . . . . 0.0 110.175 -179.824 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 19.7 t70 . . . . . 0 N--CA 1.495 1.807 0 CA-C-O 117.996 -1.002 . . . . 0.0 110.294 -179.736 . . . . . . . . 0 0 . 1 . 021 nuclear build full ' B' B ' 240' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.319 0 N-CA-C 109.537 -1.425 . . . . 0.0 109.537 . . . . . . . . . 0 0 . 1 . 021 nuclear build full ' B' B ' 241' ' ' ALA . . . . . . . . . . . . . . . -67.55 -36.97 81.99 Favored 'General case' 0 N--CA 1.499 1.985 0 O-C-N 121.612 -0.934 . . . . 0.0 110.291 -179.904 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 242' ' ' THR . . . . . 0.479 HG22 ' O ' ' B' ' 244' ' ' LYS . 24.2 m -126.36 133.56 51.3 Favored 'General case' 0 N--CA 1.495 1.823 0 O-C-N 121.7 -0.625 . . . . 0.0 110.186 179.522 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' B' B ' 243' ' ' THR . . . . . . . . . . . . . 41.8 p -83.11 -33.08 26.4 Favored 'General case' 0 N--CA 1.498 1.942 0 O-C-N 121.719 -0.613 . . . . 0.0 110.321 179.923 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 244' ' ' LYS . . . . . 0.479 ' O ' HG22 ' B' ' 242' ' ' THR . 89.0 mttt -110.85 154.35 24.14 Favored 'General case' 0 N--CA 1.496 1.827 0 O-C-N 121.657 -0.652 . . . . 0.0 110.19 -179.542 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' B' B ' 245' ' ' GLU . . . . . . . . . . . . . 54.7 mt-10 -96.12 142.72 27.97 Favored 'General case' 0 N--CA 1.495 1.789 0 O-C-N 121.671 -0.643 . . . . 0.0 110.139 179.463 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 246' ' ' LYS . . . . . . . . . . . . . 81.3 mttt -65.28 -33.66 76.51 Favored 'General case' 0 N--CA 1.5 2.044 0 O-C-N 121.676 -0.64 . . . . 0.0 110.444 -179.458 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 247' ' ' ASN . . . . . . . . . . . . . 15.1 t-20 53.44 72.68 0.42 Allowed 'General case' 0 N--CA 1.505 2.32 0 O-C-N 121.497 -0.752 . . . . 0.0 110.92 179.704 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 248' ' ' ILE . . . . . . . . . . . . . 80.1 mt 53.95 77.94 0.07 OUTLIER 'Isoleucine or valine' 0 N--CA 1.507 2.402 0 O-C-N 121.456 -0.777 . . . . 0.0 110.416 -179.922 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 249' ' ' SER . . . . . . . . . . . . . 3.1 m -93.29 -27.34 16.86 Favored 'General case' 0 N--CA 1.496 1.868 0 O-C-N 121.639 -0.663 . . . . 0.0 110.672 179.149 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 250' ' ' VAL . . . . . . . . . . . . . 13.5 p -87.07 149.05 4.22 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.884 0 O-C-N 121.566 -0.709 . . . . 0.0 110.368 -178.438 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 251' ' ' ASP . . . . . . . . . . . . . 3.7 m-20 52.32 38.09 24.02 Favored 'General case' 0 N--CA 1.507 2.379 0 O-C-N 121.672 -0.643 . . . . 0.0 111.076 -178.817 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 252' ' ' VAL . . . . . 0.502 HG13 ' N ' ' B' ' 253' ' ' ASP . 0.4 OUTLIER 52.04 -177.28 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.507 2.378 0 O-C-N 121.783 -0.573 . . . . 0.0 111.2 177.795 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' B' B ' 253' ' ' ASP . . . . . 0.502 ' N ' HG13 ' B' ' 252' ' ' VAL . 53.4 p-10 -81.64 171.17 14.94 Favored 'General case' 0 N--CA 1.499 1.977 0 O-C-N 121.538 -0.726 . . . . 0.0 110.556 -179.491 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' B' B ' 254' ' ' ALA . . . . . . . . . . . . . . . -69.06 -13.57 62.52 Favored 'General case' 0 N--CA 1.501 2.12 0 O-C-N 121.762 -0.586 . . . . 0.0 111.31 178.662 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 255' ' ' ASP . . . . . . . . . . . . . 9.7 m-20 -70.69 -25.95 63.2 Favored 'General case' 0 N--CA 1.501 2.101 0 O-C-N 121.307 -0.871 . . . . 0.0 110.702 -176.897 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 256' ' ' ALA . . . . . 0.433 ' CB ' HG11 ' B' ' 252' ' ' VAL . . . -62.45 -35.73 80.21 Favored 'General case' 0 N--CA 1.501 2.124 0 O-C-N 121.375 -0.828 . . . . 0.0 110.467 179.945 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' B' B ' 257' ' ' SER . . . . . . . . . . . . . 34.5 t -54.38 -34.96 62.27 Favored 'General case' 0 N--CA 1.503 2.204 0 O-C-N 121.592 -0.692 . . . . 0.0 110.396 176.682 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 258' ' ' SER . . . . . . . . . . . . . 25.3 m -67.99 -31.25 70.82 Favored 'General case' 0 N--CA 1.498 1.934 0 O-C-N 121.888 -0.507 . . . . 0.0 110.25 178.978 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 259' ' ' GLN . . . . . . . . . . . . . 48.7 tt0 -61.47 -37.59 84.17 Favored 'General case' 0 N--CA 1.502 2.134 0 O-C-N 121.635 -0.666 . . . . 0.0 110.381 178.964 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 260' ' ' LEU . . . . . 0.502 ' HA ' HD12 ' B' ' 263' ' ' LEU . 46.0 mt -65.93 -42.36 90.2 Favored 'General case' 0 N--CA 1.5 2.038 0 O-C-N 121.721 -0.612 . . . . 0.0 110.306 178.449 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' B' B ' 261' ' ' LEU . . . . . . . . . . . . . 18.9 tp -69.89 -36.55 75.53 Favored 'General case' 0 N--CA 1.498 1.961 0 O-C-N 121.717 -0.614 . . . . 0.0 109.75 176.83 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 262' ' ' SER . . . . . . . . . . . . . 49.1 m -62.16 -37.0 83.56 Favored 'General case' 0 N--CA 1.501 2.078 0 O-C-N 121.714 -0.616 . . . . 0.0 110.556 176.614 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 263' ' ' LEU . . . . . 0.502 HD12 ' HA ' ' B' ' 260' ' ' LEU . 18.9 mt -64.7 -42.78 95.05 Favored 'General case' 0 N--CA 1.502 2.133 0 O-C-N 121.698 -0.626 . . . . 0.0 110.186 179.64 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' B' B ' 264' ' ' LEU . . . . . 0.626 HD22 ' HB ' ' A' ' 49' ' ' THR . 85.0 mt -62.21 -34.08 75.78 Favored 'General case' 0 N--CA 1.502 2.154 0 O-C-N 121.724 -0.61 . . . . 0.0 110.566 178.513 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' B' B ' 265' ' ' LYS . . . . . . . . . . . . . 29.2 mtpt -74.98 -34.12 61.95 Favored 'General case' 0 N--CA 1.499 1.994 0 O-C-N 121.718 -0.614 . . . . 0.0 109.976 179.915 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 266' ' ' SER . . . . . . . . . . . . . 64.8 m 51.38 -173.34 0.02 OUTLIER 'General case' 0 N--CA 1.506 2.355 0 O-C-N 121.707 -0.621 . . . . 0.0 111.22 179.136 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 267' ' ' SER . . . . . . . . . . . . . 47.3 m -118.33 150.3 39.72 Favored 'General case' 0 N--CA 1.495 1.818 0 O-C-N 121.665 -0.647 . . . . 0.0 110.15 179.531 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 268' ' ' THR . . . . . . . . . . . . . 9.0 t -67.81 144.09 55.51 Favored 'General case' 0 N--CA 1.5 2.034 0 O-C-N 121.717 -0.614 . . . . 0.0 110.375 -179.404 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 269' ' ' ALA . . . . . 0.748 ' HB3' ' HD3' ' B' ' 270' ' ' PRO . . . -171.12 -60.17 0.0 OUTLIER Pre-proline 0 N--CA 1.499 1.978 0 O-C-N 121.636 -0.665 . . . . 0.0 110.383 -179.666 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' B' B ' 270' ' ' PRO . . . . . 0.748 ' HD3' ' HB3' ' B' ' 269' ' ' ALA . 30.7 Cg_endo -68.56 164.09 34.3 Favored 'Trans proline' 0 N--CA 1.488 1.188 0 O-C-N 123.152 1.08 . . . . 0.0 110.282 178.579 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' B' B ' 271' ' ' SER . . . . . . . . . . . . . 50.5 m -66.22 153.54 42.22 Favored 'General case' 0 N--CA 1.499 2.025 0 O-C-N 121.605 -0.684 . . . . 0.0 110.336 -179.381 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 272' ' ' ASP . . . . . . . . . . . . . 25.9 t0 -101.08 154.52 18.65 Favored 'General case' 0 N--CA 1.496 1.828 0 O-C-N 121.69 -0.631 . . . . 0.0 110.247 -179.064 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 273' ' ' LEU . . . . . . . . . . . . . 12.3 tp 52.78 33.01 13.2 Favored 'General case' 0 N--CA 1.506 2.334 0 O-C-N 121.637 -0.664 . . . . 0.0 110.93 179.883 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 274' ' ' ALA . . . . . . . . . . . . . . . -74.5 -40.82 61.58 Favored 'General case' 0 N--CA 1.497 1.921 0 O-C-N 121.635 -0.666 . . . . 0.0 110.07 179.308 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 275' ' ' THR . . . . . . . . . . . . . 20.0 m -135.86 87.58 24.67 Favored Pre-proline 0 N--CA 1.494 1.773 0 O-C-N 121.699 -0.626 . . . . 0.0 110.06 179.324 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 276' ' ' PRO . . . . . . . . . . . . . 30.6 Cg_endo -68.15 78.86 0.59 Allowed 'Trans proline' 0 N--CA 1.488 1.189 0 O-C-N 123.525 1.276 . . . . 0.0 110.392 -179.58 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 277' ' ' GLN . . . . . 0.421 ' N ' ' CD ' ' B' ' 278' ' ' PRO . 1.4 tt0 -85.94 -48.67 0.55 Allowed Pre-proline 0 N--CA 1.498 1.955 0 O-C-N 121.554 -0.716 . . . . 0.0 110.864 179.2 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' B' B ' 278' ' ' PRO . . . . . 0.421 ' CD ' ' N ' ' B' ' 277' ' ' GLN . 23.4 Cg_exo -60.64 154.44 54.61 Favored 'Trans proline' 0 N--CA 1.493 1.449 0 O-C-N 123.037 1.02 . . . . 0.0 110.759 -179.188 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' B' B ' 279' ' ' SER . . . . . . . . . . . . . 29.9 t -104.47 149.92 25.02 Favored 'General case' 0 N--CA 1.495 1.806 0 O-C-N 121.74 -0.6 . . . . 0.0 110.094 179.799 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 280' ' ' THR . . . . . . . . . . . . . 23.6 m -75.77 138.83 41.47 Favored 'General case' 0 N--CA 1.497 1.924 0 O-C-N 121.672 -0.643 . . . . 0.0 110.206 -179.063 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 281' ' ' PHE . . . . . . . . . . . . . 4.7 t80 52.9 68.23 3.2 Favored Pre-proline 0 N--CA 1.506 2.358 0 O-C-N 121.561 -0.712 . . . . 0.0 110.955 -179.858 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 282' ' ' PRO . . . . . . . . . . . . . 16.8 Cg_exo -63.7 -47.09 7.69 Favored 'Trans proline' 0 N--CA 1.49 1.304 0 O-C-N 123.48 1.253 . . . . 0.0 110.514 179.33 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 283' ' ' GLN . . . . . . . . . . . . . 42.2 mt-30 -150.63 155.17 35.95 Favored Pre-proline 0 N--CA 1.494 1.751 0 O-C-N 121.746 -0.596 . . . . 0.0 110.211 179.553 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 284' ' ' PRO . . . . . . . . . . . . . 36.3 Cg_endo -70.47 152.75 65.85 Favored 'Trans proline' 0 N--CA 1.486 1.052 0 O-C-N 123.644 1.339 . . . . 0.0 110.339 179.905 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 285' ' ' PRO . . . . . . . . . . . . . 33.4 Cg_endo -69.19 168.17 21.59 Favored 'Trans proline' 0 N--CA 1.488 1.189 0 O-C-N 123.626 1.329 . . . . 0.0 110.251 179.189 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 286' ' ' VAL . . . . . . . . . . . . . 27.2 m -124.06 140.05 48.63 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.991 0 O-C-N 121.673 -0.642 . . . . 0.0 110.258 179.261 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 287' ' ' GLU . . . . . . . . . . . . . 74.8 mm-40 -76.49 -34.93 58.63 Favored 'General case' 0 N--CA 1.498 1.925 0 O-C-N 121.698 -0.626 . . . . 0.0 110.401 -179.284 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 288' ' ' SER . . . . . . . . . . . . . 48.5 m -119.49 150.5 40.13 Favored 'General case' 0 N--CA 1.496 1.835 0 O-C-N 121.724 -0.61 . . . . 0.0 110.292 -178.157 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 289' ' ' HIS . . . . . . . . . . . . . 32.2 m170 -65.54 -33.57 76.24 Favored 'General case' 0 N--CA 1.5 2.042 0 O-C-N 121.68 -0.638 . . . . 0.0 110.372 179.704 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 290' ' ' SER . . . . . . . . . . . . . 21.2 m -64.63 -34.12 77.53 Favored 'General case' 0 N--CA 1.5 2.042 0 O-C-N 121.692 -0.63 . . . . 0.0 110.409 -179.791 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 291' ' ' SER . . . . . . . . . . . . . 8.8 m . . . . . 0 N--CA 1.505 2.318 0 CA-C-O 117.951 -1.024 . . . . 0.0 111.022 -179.976 . . . . . . . . 0 0 . 1 . 022 nuclear build full ' A' A ' -1' ' ' MET . . . . . . . . . . . . . 48.1 ttm . . . . . 0 N--CA 1.491 1.589 0 CA-C-O 121.043 0.449 . . . . 0.0 110.203 . . . . . . . . . 0 0 . 1 . 022 nuclear build full ' A' A ' 0' ' ' GLY . . . . . . . . . . . . . . . -83.51 -171.22 47.38 Favored Glycine 0 N--CA 1.493 2.478 0 N-CA-C 109.508 -1.437 . . . . 0.0 109.508 179.576 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 49.4 ttm -90.42 131.54 36.13 Favored 'General case' 0 N--CA 1.496 1.854 0 O-C-N 121.614 -0.933 . . . . 0.0 110.149 179.946 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 69.7 m -91.68 178.84 5.81 Favored 'General case' 0 N--CA 1.496 1.843 0 O-C-N 121.757 -0.59 . . . . 0.0 110.247 -178.547 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 3' ' ' VAL . . . . . 0.431 HG12 ' CE1' ' A' ' 7' ' ' TYR . 65.6 t -66.4 -27.73 41.31 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.065 0 O-C-N 121.727 -0.608 . . . . 0.0 110.337 -178.887 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -54.98 -30.63 59.62 Favored 'General case' 0 N--CA 1.505 2.303 0 O-C-N 121.487 -0.758 . . . . 0.0 110.439 -178.422 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 9.7 m-20 -68.89 -30.72 69.27 Favored 'General case' 0 N--CA 1.499 1.995 0 O-C-N 121.753 -0.592 . . . . 0.0 110.244 174.981 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 97.4 m-85 -95.56 10.06 37.96 Favored 'General case' 0 N--CA 1.497 1.909 0 O-C-N 121.636 -0.665 . . . . 0.0 111.502 -178.16 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 7' ' ' TYR . . . . . 0.431 ' CE1' HG12 ' A' ' 3' ' ' VAL . 3.9 m-30 -67.3 139.88 57.29 Favored 'General case' 0 N--CA 1.502 2.135 0 O-C-N 121.171 -0.955 . . . . 0.0 110.077 174.184 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 8' ' ' GLY . . . . . 0.424 ' O ' HG13 ' A' ' 24' ' ' VAL . . . 83.65 -3.14 86.13 Favored Glycine 0 N--CA 1.497 2.746 0 N-CA-C 110.768 -0.933 . . . . 0.0 110.768 -177.089 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 66.2 m -75.27 138.97 42.23 Favored 'General case' 0 N--CA 1.497 1.887 0 O-C-N 121.115 -1.227 . . . . 0.0 110.508 179.685 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 10' ' ' ASN . . . . . 0.669 ' CG ' HG22 ' A' ' 24' ' ' VAL . 2.4 m120 -84.58 118.8 24.57 Favored 'General case' 0 N--CA 1.498 1.971 0 O-C-N 121.651 -0.656 . . . . 0.0 109.454 174.407 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 11' ' ' VAL . . . . . 0.474 HG12 ' HA ' ' A' ' 57' ' ' ILE . 35.8 m -143.19 162.3 17.02 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.822 0 O-C-N 121.693 -0.629 . . . . 0.0 109.854 -179.116 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 12' ' ' GLU . . . . . 0.584 ' HB2' HD11 ' A' ' 58' ' ' LEU . 47.7 tt0 -109.47 127.22 54.26 Favored 'General case' 0 N--CA 1.493 1.692 0 O-C-N 121.56 -0.713 . . . . 0.0 110.047 176.331 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 13' ' ' VAL . . . . . 0.548 HG22 ' CD2' ' A' ' 55' ' ' LEU . 58.0 t -106.89 123.52 62.0 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.747 0 O-C-N 121.48 -0.763 . . . . 0.0 109.951 -178.324 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.637 HD12 ' O ' ' A' ' 19' ' ' SER . 17.6 tp -96.0 135.1 38.22 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.663 -0.648 . . . . 0.0 109.472 175.737 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 86.2 mt -103.67 169.0 8.78 Favored 'General case' 0 N--CA 1.497 1.908 0 O-C-N 121.61 -0.681 . . . . 0.0 111.22 -172.605 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 24.1 p30 -59.05 -21.73 59.59 Favored 'General case' 0 N--CA 1.507 2.391 0 O-C-N 121.843 -0.535 . . . . 0.0 111.677 -177.507 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 47.7 p-10 -93.45 24.53 3.9 Favored 'General case' 0 N--CA 1.498 1.96 0 O-C-N 121.497 -0.752 . . . . 0.0 110.797 -175.309 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 74.3 m-20 59.31 25.64 14.33 Favored 'General case' 0 N--CA 1.505 2.298 0 O-C-N 121.523 -0.736 . . . . 0.0 110.73 176.834 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 19' ' ' SER . . . . . 0.637 ' O ' HD12 ' A' ' 14' ' ' LEU . 70.7 m -97.67 163.07 12.98 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.631 -0.668 . . . . 0.0 109.274 170.657 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 13.0 ptmt -145.4 138.02 25.98 Favored 'General case' 0 N--CA 1.495 1.818 0 O-C-N 121.59 -0.694 . . . . 0.0 110.46 -176.688 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -153.02 161.62 42.31 Favored 'General case' 0 N--CA 1.496 1.863 0 O-C-N 121.728 -0.607 . . . . 0.0 110.299 179.893 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 22' ' ' ARG . . . . . 0.486 ' O ' HD13 ' A' ' 39' ' ' LEU . 32.5 ptt180 -142.06 147.15 36.35 Favored 'General case' 0 N--CA 1.496 1.826 0 O-C-N 121.701 -0.624 . . . . 0.0 110.782 -179.751 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -171.73 171.42 44.08 Favored Glycine 0 N--CA 1.494 2.561 0 N-CA-C 108.76 -1.736 . . . . 0.0 108.76 -175.47 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 24' ' ' VAL . . . . . 0.669 HG22 ' CG ' ' A' ' 10' ' ' ASN . 39.9 t -94.59 120.89 44.65 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.901 0 O-C-N 121.424 -1.045 . . . . 0.0 109.35 -175.451 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 25' ' ' ILE . . . . . 0.662 ' HA ' HD23 ' A' ' 37' ' ' LEU . 92.6 mt -64.29 143.45 15.69 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.118 0 O-C-N 121.566 -0.709 . . . . 0.0 110.498 -171.899 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 26' ' ' THR . . . . . 0.619 HG21 ' HB2' ' A' ' 38' ' ' ARG . 6.3 p -121.23 -28.16 4.75 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.785 -0.572 . . . . 0.0 111.256 179.334 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 27' ' ' ASN . . . . . 0.518 ' O ' HD12 ' A' ' 35' ' ' LEU . 27.5 t30 -161.66 160.77 29.07 Favored 'General case' 0 N--CA 1.5 2.065 0 C-N-CA 118.919 -1.112 . . . . 0.0 111.899 -177.881 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 28' ' ' PHE . . . . . 0.56 ' HE1' HG21 ' A' ' 49' ' ' THR . 82.0 t80 -150.08 125.81 10.38 Favored 'General case' 0 N--CA 1.499 2.002 0 N-CA-C 109.052 -0.721 . . . . 0.0 109.052 169.724 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 17.8 t70 -99.68 128.56 45.78 Favored 'General case' 0 N--CA 1.492 1.664 0 N-CA-C 109.089 -0.708 . . . . 0.0 109.089 -177.484 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 21.8 m -66.43 -46.37 76.71 Favored 'General case' 0 N--CA 1.499 2.015 0 C-N-CA 120.053 -0.659 . . . . 0.0 110.673 -175.736 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 16.3 t -58.22 -48.06 81.55 Favored 'General case' 0 N--CA 1.503 2.206 0 O-C-N 121.485 -0.76 . . . . 0.0 110.957 -173.971 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 90.4 m-20 -104.59 -5.38 21.51 Favored 'General case' 0 N--CA 1.497 1.895 0 O-C-N 121.614 -0.679 . . . . 0.0 111.643 -178.486 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 71.0 m 49.36 67.25 0.91 Allowed 'General case' 0 N--CA 1.507 2.418 0 O-C-N 121.132 -0.98 . . . . 0.0 110.937 -174.32 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 34' ' ' ILE . . . . . 1.034 HD12 HG22 ' A' ' 48' ' ' VAL . 45.5 mm -120.68 126.41 75.21 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.019 0 O-C-N 121.665 -0.647 . . . . 0.0 109.323 -174.959 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.518 HD12 ' O ' ' A' ' 27' ' ' ASN . 11.9 tp -115.76 120.38 39.13 Favored 'General case' 0 N--CA 1.494 1.762 0 O-C-N 121.68 -0.637 . . . . 0.0 110.504 -169.065 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 99.0 mt-30 -90.99 134.68 34.29 Favored 'General case' 0 N--CA 1.491 1.593 0 N-CA-C 109.468 -0.568 . . . . 0.0 109.468 174.485 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 0.662 HD23 ' HA ' ' A' ' 25' ' ' ILE . 90.2 mt -117.82 123.82 46.86 Favored 'General case' 0 N--CA 1.496 1.842 0 O-C-N 121.841 -0.537 . . . . 0.0 109.915 174.342 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 38' ' ' ARG . . . . . 0.619 ' HB2' HG21 ' A' ' 26' ' ' THR . 58.0 ttt85 -96.64 108.54 21.17 Favored 'General case' 0 N--CA 1.496 1.83 0 O-C-N 121.669 -0.645 . . . . 0.0 109.829 175.283 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.486 HD13 ' O ' ' A' ' 22' ' ' ARG . 17.9 tp -84.83 153.37 22.99 Favored 'General case' 0 N--CA 1.494 1.739 0 O-C-N 121.745 -0.597 . . . . 0.0 110.962 -174.155 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -63.57 -9.65 14.4 Favored 'General case' 0 N--CA 1.503 2.183 0 O-C-N 121.985 -0.447 . . . . 0.0 111.928 -171.781 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 30.0 m120 -86.14 27.47 0.91 Allowed 'General case' 0 N--CA 1.498 1.953 0 O-C-N 121.106 -0.996 . . . . 0.0 110.984 175.679 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 15.7 t0 62.89 29.23 16.57 Favored 'General case' 0 N--CA 1.504 2.235 0 O-C-N 120.975 -1.078 . . . . 0.0 110.595 175.481 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 63.8 m -123.14 137.81 54.81 Favored 'General case' 0 N--CA 1.496 1.872 0 O-C-N 121.344 -0.847 . . . . 0.0 110.402 -179.522 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 10.2 t -97.62 151.02 20.51 Favored 'General case' 0 N--CA 1.495 1.82 0 O-C-N 121.735 -0.603 . . . . 0.0 110.281 176.756 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 57.9 tttt -149.24 119.15 7.11 Favored 'General case' 0 N--CA 1.496 1.854 0 O-C-N 121.691 -0.631 . . . . 0.0 110.202 177.812 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 88.1 p -95.21 123.95 38.99 Favored 'General case' 0 N--CA 1.495 1.798 0 O-C-N 121.64 -0.662 . . . . 0.0 110.294 -179.831 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 82.7 mt -129.27 134.83 63.14 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.866 0 O-C-N 121.692 -0.63 . . . . 0.0 109.379 178.889 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 48' ' ' VAL . . . . . 1.034 HG22 HD12 ' A' ' 34' ' ' ILE . 66.6 t -82.71 127.56 39.55 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.889 0 O-C-N 121.622 -0.674 . . . . 0.0 109.306 179.318 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 49' ' ' THR . . . . . 0.56 HG21 ' HE1' ' A' ' 28' ' ' PHE . 67.9 p -58.29 -24.93 61.09 Favored 'General case' 0 N--CA 1.507 2.408 0 O-C-N 121.545 -0.722 . . . . 0.0 111.916 -169.793 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 56.3 tttt -56.51 -23.26 38.39 Favored 'General case' 0 N--CA 1.502 2.135 0 O-C-N 121.464 -0.772 . . . . 0.0 111.149 -177.055 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 50.4 p30 -84.0 1.47 43.59 Favored 'General case' 0 N--CA 1.498 1.941 0 O-C-N 121.419 -0.8 . . . . 0.0 111.301 176.677 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 52' ' ' ILE . . . . . 0.402 HD12 ' HB ' ' A' ' 49' ' ' THR . 97.8 mt -76.13 127.56 37.44 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.074 0 O-C-N 121.163 -0.961 . . . . 0.0 110.055 179.05 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 45.8 tptt -92.14 -30.86 15.74 Favored 'General case' 0 N--CA 1.495 1.789 0 O-C-N 121.868 -0.52 . . . . 0.0 109.602 169.283 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 5.3 m-20 -163.91 159.37 20.86 Favored 'General case' 0 N--CA 1.499 2.007 0 O-C-N 121.87 -0.519 . . . . 0.0 109.89 -178.56 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 55' ' ' LEU . . . . . 0.548 ' CD2' HG22 ' A' ' 13' ' ' VAL . 85.5 mt -132.94 149.33 52.25 Favored 'General case' 0 N--CA 1.496 1.868 0 O-C-N 121.699 -0.626 . . . . 0.0 110.342 -179.241 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 6.8 ptm180 -150.71 137.6 19.1 Favored 'General case' 0 N--CA 1.496 1.832 0 O-C-N 121.716 -0.615 . . . . 0.0 109.978 176.462 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 57' ' ' ILE . . . . . 0.474 ' HA ' HG12 ' A' ' 11' ' ' VAL . 68.6 mt -84.77 133.18 29.89 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.795 0 O-C-N 121.503 -0.748 . . . . 0.0 109.843 175.182 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 58' ' ' LEU . . . . . 0.584 HD11 ' HB2' ' A' ' 12' ' ' GLU . 56.4 mt -85.4 117.04 67.97 Favored Pre-proline 0 N--CA 1.496 1.863 0 O-C-N 121.592 -0.693 . . . . 0.0 110.137 179.404 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 27.3 Cg_endo -66.71 143.95 69.86 Favored 'Trans proline' 0 N--CA 1.489 1.259 0 O-C-N 123.346 1.182 . . . . 0.0 110.311 178.602 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 47.3 tttm -96.67 105.14 17.19 Favored 'General case' 0 N--CA 1.496 1.852 0 O-C-N 121.684 -0.635 . . . . 0.0 110.175 -179.653 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 28.9 t30 -162.63 141.53 8.9 Favored 'General case' 0 N--CA 1.497 1.875 0 O-C-N 121.686 -0.633 . . . . 0.0 110.177 179.513 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 40.2 tt0 54.65 99.0 0.01 OUTLIER 'General case' 0 N--CA 1.507 2.409 0 O-C-N 121.591 -0.693 . . . . 0.0 111.014 179.431 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 81.7 mt -107.62 134.21 50.07 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.914 0 O-C-N 121.66 -0.65 . . . . 0.0 109.677 179.82 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 64' ' ' MET . . . . . . . . . . . . . 20.1 ttm 51.96 58.02 15.76 Favored Pre-proline 0 N--CA 1.504 2.269 0 O-C-N 121.589 -0.694 . . . . 0.0 110.974 -179.277 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 29.0 Cg_endo -67.6 143.86 64.15 Favored 'Trans proline' 0 N--CA 1.488 1.184 0 O-C-N 123.501 1.264 . . . . 0.0 110.367 -179.949 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 82.8 tttt -64.91 -33.79 76.86 Favored 'General case' 0 N--CA 1.501 2.081 0 O-C-N 121.716 -0.615 . . . . 0.0 110.291 179.275 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER 54.85 41.55 31.82 Favored 'General case' 0 N--CA 1.505 2.28 0 O-C-N 121.559 -0.713 . . . . 0.0 110.867 -179.639 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . -105.21 41.86 2.05 Favored Glycine 0 N--CA 1.494 2.512 0 N-CA-C 109.482 -1.447 . . . . 0.0 109.482 179.402 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 22.3 m -96.93 149.26 22.09 Favored 'General case' 0 N--CA 1.495 1.817 0 O-C-N 121.667 -0.902 . . . . 0.0 110.242 -179.336 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 37.6 tttp -62.39 -39.74 94.2 Favored 'General case' 0 N--CA 1.501 2.101 0 O-C-N 121.619 -0.676 . . . . 0.0 110.473 -179.528 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 72.5 m -140.34 158.97 65.33 Favored Pre-proline 0 N--CA 1.494 1.765 0 O-C-N 121.645 -0.659 . . . . 0.0 110.126 179.25 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 18.4 Cg_exo -62.55 135.07 51.02 Favored 'Trans proline' 0 N--CA 1.49 1.268 0 O-C-N 123.617 1.325 . . . . 0.0 110.606 179.092 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 22.7 t -140.55 141.69 35.23 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.652 -0.655 . . . . 0.0 110.161 179.611 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 44.8 p -69.44 -34.2 74.08 Favored 'General case' 0 N--CA 1.499 1.978 0 O-C-N 121.692 -0.63 . . . . 0.0 110.138 179.645 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 91.6 m-20 -118.68 145.46 45.47 Favored 'General case' 0 N--CA 1.496 1.825 0 O-C-N 121.681 -0.637 . . . . 0.0 110.202 179.611 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 47.9 m -120.24 149.31 42.48 Favored 'General case' 0 N--CA 1.495 1.816 0 O-C-N 121.638 -0.664 . . . . 0.0 110.211 -179.893 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 23.7 m -100.99 137.84 38.82 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.646 -0.658 . . . . 0.0 110.13 179.784 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 18.7 tptm -101.47 142.3 33.06 Favored 'General case' 0 N--CA 1.496 1.826 0 O-C-N 121.679 -0.638 . . . . 0.0 110.287 -179.141 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 82.7 mt -89.81 155.72 18.98 Favored 'General case' 0 N--CA 1.497 1.89 0 O-C-N 121.762 -0.586 . . . . 0.0 110.125 179.197 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 49.8 mtpt 53.69 40.77 31.88 Favored 'General case' 0 N--CA 1.506 2.33 0 O-C-N 121.629 -0.669 . . . . 0.0 110.799 179.893 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 22.9 t -138.21 162.9 33.09 Favored 'General case' 0 N--CA 1.495 1.787 0 O-C-N 121.719 -0.613 . . . . 0.0 110.13 -179.998 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -66.12 144.43 56.69 Favored 'General case' 0 N--CA 1.499 2.0 0 O-C-N 121.644 -0.66 . . . . 0.0 110.339 -179.584 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 13.2 mm-40 -67.15 141.57 57.33 Favored 'General case' 0 N--CA 1.499 1.989 0 O-C-N 121.658 -0.651 . . . . 0.0 110.342 -179.04 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 25.0 m -125.16 141.66 51.97 Favored 'General case' 0 N--CA 1.494 1.769 0 O-C-N 121.68 -0.638 . . . . 0.0 110.115 179.937 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 98.0 m-85 -113.61 134.51 54.67 Favored 'General case' 0 N--CA 1.495 1.79 0 O-C-N 121.596 -0.69 . . . . 0.0 110.14 179.515 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 48.0 m -122.6 142.67 50.39 Favored 'General case' 0 N--CA 1.495 1.812 0 O-C-N 121.667 -0.646 . . . . 0.0 110.171 179.921 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 99.4 p -144.59 31.04 1.2 Allowed 'General case' 0 N--CA 1.495 1.796 0 O-C-N 121.7 -0.625 . . . . 0.0 110.396 179.073 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 31.0 ttpt -100.17 129.51 46.2 Favored 'General case' 0 N--CA 1.494 1.74 0 O-C-N 121.517 -0.739 . . . . 0.0 110.157 -179.687 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 91.6 m-20 -111.68 151.41 28.9 Favored 'General case' 0 N--CA 1.496 1.84 0 O-C-N 121.588 -0.695 . . . . 0.0 110.22 179.954 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 63.8 tttt -79.45 134.88 36.55 Favored 'General case' 0 N--CA 1.497 1.903 0 O-C-N 121.65 -0.656 . . . . 0.0 110.142 -179.824 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 91' ' ' TRP . . . . . . . . . . . . . 81.6 t90 -103.82 126.92 51.28 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.64 -0.663 . . . . 0.0 110.238 -179.811 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 27.2 t -146.14 150.21 35.47 Favored 'General case' 0 N--CA 1.494 1.773 0 O-C-N 121.717 -0.614 . . . . 0.0 110.221 179.862 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 93' ' ' MET . . . . . . . . . . . . . 73.2 mtm 56.47 -83.23 0.01 OUTLIER 'General case' 0 N--CA 1.506 2.344 0 O-C-N 121.956 -0.465 . . . . 0.0 111.325 -179.209 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 10.6 p-10 . . . . . 0 N--CA 1.496 1.874 0 O-C-N 121.102 -0.999 . . . . 0.0 110.243 -178.819 . . . . . . . . 0 0 . 1 . 022 nuclear build full ' B' B ' 240' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 2.405 0 N-CA-C 109.501 -1.439 . . . . 0.0 109.501 . . . . . . . . . 0 0 . 1 . 022 nuclear build full ' B' B ' 241' ' ' ALA . . . . . . . . . . . . . . . -68.27 -30.5 69.54 Favored 'General case' 0 N--CA 1.501 2.083 0 O-C-N 121.709 -0.877 . . . . 0.0 110.539 179.718 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 242' ' ' THR . . . . . . . . . . . . . 23.6 m -63.36 -37.04 85.71 Favored 'General case' 0 N--CA 1.501 2.123 0 O-C-N 121.517 -0.739 . . . . 0.0 110.607 -177.875 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 243' ' ' THR . . . . . . . . . . . . . 40.2 p -119.27 154.43 33.47 Favored 'General case' 0 N--CA 1.497 1.917 0 O-C-N 121.601 -0.687 . . . . 0.0 110.39 -178.538 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 244' ' ' LYS . . . . . . . . . . . . . 83.4 tttt -99.35 -41.3 7.5 Favored 'General case' 0 N--CA 1.496 1.826 0 O-C-N 121.673 -0.642 . . . . 0.0 110.171 179.276 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 245' ' ' GLU . . . . . . . . . . . . . 50.6 mt-10 52.72 -177.55 0.02 OUTLIER 'General case' 0 N--CA 1.507 2.387 0 O-C-N 121.601 -0.687 . . . . 0.0 111.132 -179.849 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 246' ' ' LYS . . . . . . . . . . . . . 50.1 pttt -161.14 133.09 5.77 Favored 'General case' 0 N--CA 1.496 1.866 0 O-C-N 121.613 -0.68 . . . . 0.0 110.417 -179.871 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 247' ' ' ASN . . . . . . . . . . . . . 91.8 m-20 -113.46 143.24 44.84 Favored 'General case' 0 N--CA 1.495 1.793 0 O-C-N 121.724 -0.61 . . . . 0.0 110.173 179.744 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 248' ' ' ILE . . . . . 0.509 HG22 ' O ' ' B' ' 248' ' ' ILE . 72.6 mt 52.87 51.48 0.38 Allowed 'Isoleucine or valine' 0 N--CA 1.508 2.428 0 O-C-N 121.508 -0.745 . . . . 0.0 110.227 -179.249 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' B' B ' 249' ' ' SER . . . . . . . . . . . . . 58.5 m -90.32 -28.24 18.88 Favored 'General case' 0 N--CA 1.496 1.862 0 O-C-N 121.512 -0.743 . . . . 0.0 110.783 -178.572 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 250' ' ' VAL . . . . . . . . . . . . . 57.4 t -85.05 -55.23 7.08 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.01 0 O-C-N 121.558 -0.713 . . . . 0.0 109.909 -176.602 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 251' ' ' ASP . . . . . 0.423 ' C ' HG13 ' B' ' 252' ' ' VAL . 16.1 m-20 51.04 -172.39 0.02 OUTLIER 'General case' 0 N--CA 1.506 2.365 0 O-C-N 121.542 -0.724 . . . . 0.0 111.048 -177.936 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' B' B ' 252' ' ' VAL . . . . . 0.423 HG13 ' C ' ' B' ' 251' ' ' ASP . 24.1 m -153.64 127.28 1.24 Allowed 'Isoleucine or valine' 0 N--CA 1.499 2.005 0 O-C-N 121.649 -0.657 . . . . 0.0 109.788 -178.526 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' B' B ' 253' ' ' ASP . . . . . . . . . . . . . 5.3 m-20 -161.54 108.49 1.4 Allowed 'General case' 0 N--CA 1.497 1.882 0 O-C-N 121.822 -0.549 . . . . 0.0 109.847 -179.28 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 254' ' ' ALA . . . . . . . . . . . . . . . -66.82 -35.84 80.98 Favored 'General case' 0 N--CA 1.499 1.977 0 O-C-N 121.584 -0.697 . . . . 0.0 110.372 -179.371 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 255' ' ' ASP . . . . . . . . . . . . . 74.6 m-20 -73.7 -31.72 63.55 Favored 'General case' 0 N--CA 1.5 2.029 0 O-C-N 121.738 -0.601 . . . . 0.0 110.36 -179.593 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 256' ' ' ALA . . . . . . . . . . . . . . . -63.5 -37.09 85.97 Favored 'General case' 0 N--CA 1.501 2.1 0 O-C-N 121.626 -0.671 . . . . 0.0 110.328 179.966 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 257' ' ' SER . . . . . . . . . . . . . 45.4 m -55.53 -36.17 66.46 Favored 'General case' 0 N--CA 1.503 2.219 0 O-C-N 121.668 -0.645 . . . . 0.0 110.422 177.93 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 258' ' ' SER . . . . . . . . . . . . . 25.6 t -69.51 -32.79 71.86 Favored 'General case' 0 N--CA 1.498 1.973 0 C-N-CA 120.365 -0.534 . . . . 0.0 110.274 179.171 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 259' ' ' GLN . . . . . . . . . . . . . 29.2 tt0 -63.27 -38.37 90.88 Favored 'General case' 0 N--CA 1.501 2.1 0 O-C-N 121.629 -0.669 . . . . 0.0 110.472 -179.37 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 260' ' ' LEU . . . . . 0.495 ' HA ' HD12 ' B' ' 263' ' ' LEU . 84.5 mt -67.16 -42.33 84.48 Favored 'General case' 0 N--CA 1.5 2.027 0 O-C-N 121.652 -0.655 . . . . 0.0 110.251 179.872 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' B' B ' 261' ' ' LEU . . . . . . . . . . . . . 21.6 tp -70.01 -36.61 75.24 Favored 'General case' 0 N--CA 1.496 1.873 0 O-C-N 121.668 -0.645 . . . . 0.0 109.757 176.852 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 262' ' ' SER . . . . . . . . . . . . . 22.6 t -62.25 -37.51 85.72 Favored 'General case' 0 N--CA 1.501 2.086 0 O-C-N 121.745 -0.597 . . . . 0.0 110.389 177.036 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 263' ' ' LEU . . . . . 0.495 HD12 ' HA ' ' B' ' 260' ' ' LEU . 28.2 mt -64.91 -41.64 95.4 Favored 'General case' 0 N--CA 1.501 2.093 0 O-C-N 121.651 -0.655 . . . . 0.0 110.314 179.365 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' B' B ' 264' ' ' LEU . . . . . 0.455 ' CD1' HD11 ' A' ' 55' ' ' LEU . 85.8 mt -62.26 -34.73 77.1 Favored 'General case' 0 N--CA 1.503 2.203 0 O-C-N 121.68 -0.638 . . . . 0.0 110.516 178.601 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' B' B ' 265' ' ' LYS . . . . . . . . . . . . . 53.9 tttm -75.19 -34.09 61.49 Favored 'General case' 0 N--CA 1.498 1.952 0 O-C-N 121.692 -0.63 . . . . 0.0 110.065 -179.391 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 266' ' ' SER . . . . . . . . . . . . . 86.6 p -162.48 158.67 24.02 Favored 'General case' 0 N--CA 1.496 1.838 0 O-C-N 121.665 -0.647 . . . . 0.0 110.074 179.834 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 267' ' ' SER . . . . . . . . . . . . . 12.7 t -90.29 -32.27 16.6 Favored 'General case' 0 N--CA 1.496 1.844 0 O-C-N 121.662 -0.649 . . . . 0.0 110.396 -179.348 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 268' ' ' THR . . . . . . . . . . . . . 37.8 p -85.31 132.11 34.3 Favored 'General case' 0 N--CA 1.497 1.917 0 O-C-N 121.598 -0.689 . . . . 0.0 110.263 -179.192 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 269' ' ' ALA . . . . . . . . . . . . . . . -170.31 155.76 5.28 Favored Pre-proline 0 N--CA 1.499 1.994 0 O-C-N 121.658 -0.651 . . . . 0.0 109.915 179.271 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 270' ' ' PRO . . . . . . . . . . . . . 29.1 Cg_endo -67.76 128.13 17.41 Favored 'Trans proline' 0 N--CA 1.488 1.159 0 O-C-N 123.664 1.349 . . . . 0.0 110.323 179.381 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 271' ' ' SER . . . . . . . . . . . . . 4.0 m -161.73 -52.1 0.04 OUTLIER 'General case' 0 N--CA 1.495 1.818 0 O-C-N 121.703 -0.623 . . . . 0.0 110.113 179.887 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 272' ' ' ASP . . . . . . . . . . . . . 74.5 m-20 -100.07 29.75 4.11 Favored 'General case' 0 N--CA 1.496 1.835 0 O-C-N 121.726 -0.609 . . . . 0.0 110.489 179.989 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 273' ' ' LEU . . . . . . . . . . . . . 82.8 mt 57.23 -81.88 0.02 OUTLIER 'General case' 0 N--CA 1.506 2.367 0 O-C-N 121.902 -0.499 . . . . 0.0 111.287 -178.67 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 274' ' ' ALA . . . . . . . . . . . . . . . -75.05 147.3 40.79 Favored 'General case' 0 N--CA 1.498 1.974 0 O-C-N 121.21 -0.931 . . . . 0.0 110.19 -178.431 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 275' ' ' THR . . . . . . . . . . . . . 24.0 p -112.37 161.51 25.83 Favored Pre-proline 0 N--CA 1.494 1.758 0 O-C-N 121.706 -0.621 . . . . 0.0 110.162 179.841 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 276' ' ' PRO . . . . . . . . . . . . . 27.6 Cg_endo -66.89 129.39 20.73 Favored 'Trans proline' 0 N--CA 1.489 1.224 0 O-C-N 123.714 1.376 . . . . 0.0 110.443 -179.794 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 277' ' ' GLN . . . . . . . . . . . . . 4.5 mp0 -88.49 -49.87 0.41 Allowed Pre-proline 0 N--CA 1.497 1.915 0 O-C-N 121.699 -0.625 . . . . 0.0 110.79 179.947 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 278' ' ' PRO . . . . . . . . . . . . . 27.8 Cg_exo -57.49 135.39 69.5 Favored 'Trans proline' 0 N--CA 1.495 1.578 0 O-C-N 123.046 1.024 . . . . 0.0 110.839 179.054 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 279' ' ' SER . . . . . . . . . . . . . 27.3 m -67.14 -37.88 84.57 Favored 'General case' 0 N--CA 1.499 2.002 0 O-C-N 121.715 -0.616 . . . . 0.0 110.274 179.757 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 280' ' ' THR . . . . . . . . . . . . . 11.3 m 52.1 94.27 0.02 OUTLIER 'General case' 0 N--CA 1.506 2.328 0 O-C-N 121.696 -0.627 . . . . 0.0 111.052 -179.389 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 281' ' ' PHE . . . . . . . . . . . . . 50.4 p90 -140.22 130.15 13.66 Favored Pre-proline 0 N--CA 1.496 1.842 0 O-C-N 121.612 -0.68 . . . . 0.0 110.269 -179.532 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 282' ' ' PRO . . . . . . . . . . . . . 58.3 Cg_endo -78.43 91.27 1.2 Allowed 'Trans proline' 0 N--CA 1.485 1.006 0 O-C-N 123.323 1.17 . . . . 0.0 110.503 178.952 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 283' ' ' GLN . . . . . 0.419 ' HB3' ' HD3' ' B' ' 284' ' ' PRO . 3.0 tp60 -80.68 -51.06 1.01 Allowed Pre-proline 0 N--CA 1.497 1.889 0 O-C-N 121.63 -0.669 . . . . 0.0 110.985 178.239 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' B' B ' 284' ' ' PRO . . . . . 0.419 ' HD3' ' HB3' ' B' ' 283' ' ' GLN . 46.7 Cg_endo -75.58 157.09 40.49 Favored 'Trans proline' 0 N--CA 1.486 1.087 0 O-C-N 123.133 1.07 . . . . 0.0 110.316 -176.964 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' B' B ' 285' ' ' PRO . . . . . . . . . . . . . 22.4 Cg_endo -65.46 -31.92 50.51 Favored 'Trans proline' 0 N--CA 1.489 1.228 0 O-C-N 123.715 1.376 . . . . 0.0 110.587 -179.911 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 286' ' ' VAL . . . . . . . . . . . . . 61.3 t -119.42 132.81 68.17 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.929 0 O-C-N 121.687 -0.633 . . . . 0.0 109.689 179.697 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 287' ' ' GLU . . . . . . . . . . . . . 46.1 tt0 -67.54 -35.74 79.64 Favored 'General case' 0 N--CA 1.5 2.031 0 O-C-N 121.714 -0.617 . . . . 0.0 110.133 179.5 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 288' ' ' SER . . . . . . . . . . . . . 4.8 m 51.92 87.27 0.03 OUTLIER 'General case' 0 N--CA 1.507 2.395 0 O-C-N 121.686 -0.634 . . . . 0.0 111.103 -179.816 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 289' ' ' HIS . . . . . . . . . . . . . 76.6 m80 52.09 -173.97 0.03 OUTLIER 'General case' 0 N--CA 1.506 2.356 0 O-C-N 121.486 -0.759 . . . . 0.0 111.116 179.503 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 290' ' ' SER . . . . . . . . . . . . . 97.7 p -134.09 157.77 45.32 Favored 'General case' 0 N--CA 1.495 1.779 0 O-C-N 121.674 -0.641 . . . . 0.0 110.151 179.634 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 291' ' ' SER . . . . . . . . . . . . . 47.9 t . . . . . 0 N--CA 1.495 1.809 0 CA-C-O 117.974 -1.013 . . . . 0.0 110.214 -179.931 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 73.0 m . . . . . 0 N--CA 1.496 1.829 0 CA-C-O 120.983 0.42 . . . . 0.64000000000000001 110.027 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 3' ' ' VAL . . . . . 0.426 HG12 ' CE1' ' A' ' 7' ' ' TYR . 66.8 t -66.55 -27.82 41.43 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.13 0 O-C-N 121.675 -0.641 . . . . 0.69999999999999996 110.301 -178.486 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -55.18 -31.16 61.16 Favored 'General case' 0 N--CA 1.504 2.251 0 O-C-N 121.492 -0.755 . . . . 0.40000000000000002 110.504 -178.262 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 9.7 m-20 -69.05 -30.59 68.96 Favored 'General case' 0 N--CA 1.498 1.962 0 O-C-N 121.833 -0.542 . . . . 1.1699999999999999 110.304 174.903 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 6' ' ' PHE . . . . . 0.423 ' CE1' HD21 ' B' ' 260' ' ' LEU . 95.4 m-85 -95.49 10.01 38.04 Favored 'General case' 0 N--CA 1.497 1.887 0 O-C-N 121.638 -0.664 . . . . 0.66000000000000003 111.537 -177.88 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 7' ' ' TYR . . . . . 0.426 ' CE1' HG12 ' A' ' 3' ' ' VAL . 3.4 m-30 -67.1 136.1 54.64 Favored 'General case' 0 N--CA 1.502 2.144 0 O-C-N 121.2 -0.938 . . . . 2.4100000000000001 109.966 174.172 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 8' ' ' GLY . . . . . 0.423 ' O ' HG13 ' A' ' 24' ' ' VAL . . . 83.13 -0.9 89.5 Favored Glycine 0 N--CA 1.498 2.794 0 N-CA-C 110.583 -1.007 . . . . 0.26000000000000001 110.583 -175.711 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 27.4 t -77.24 134.77 38.49 Favored 'General case' 0 N--CA 1.498 1.951 0 O-C-N 121.2 -1.176 . . . . 1.3 110.451 178.409 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 12.7 t-20 -83.52 120.03 25.43 Favored 'General case' 0 N--CA 1.497 1.896 0 O-C-N 121.623 -0.673 . . . . 2.0899999999999999 109.612 173.227 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . 0.528 HG12 ' HA ' ' A' ' 57' ' ' ILE . 35.9 m -142.73 162.92 17.86 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.714 0 O-C-N 121.79 -0.569 . . . . 0.23999999999999999 109.718 -178.89 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 12' ' ' GLU . . . . . 0.442 ' HB2' HD11 ' A' ' 58' ' ' LEU . 49.4 tt0 -109.39 147.31 32.99 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.654 -0.654 . . . . 1.0600000000000001 109.533 177.04 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 13' ' ' VAL . . . . . 0.671 HG22 ' CD2' ' A' ' 55' ' ' LEU . 57.7 t -136.07 125.16 38.77 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.79 0 O-C-N 121.642 -0.661 . . . . 0.28000000000000003 109.742 -174.259 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . 0.443 HD13 ' HG2' ' A' ' 20' ' ' LYS . 24.1 tp -95.93 127.84 42.3 Favored 'General case' 0 N--CA 1.493 1.701 0 N-CA-C 109.238 -0.653 . . . . 0.34000000000000002 109.238 174.942 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 85.1 mt -92.78 171.83 8.73 Favored 'General case' 0 N--CA 1.496 1.83 0 O-C-N 121.659 -0.651 . . . . 0.28000000000000003 110.887 -173.961 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 24.0 p30 -56.89 -22.39 36.93 Favored 'General case' 0 N--CA 1.505 2.281 0 O-C-N 121.731 -0.606 . . . . 0.35999999999999999 111.518 -177.814 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 53.2 p-10 -92.99 22.92 4.55 Favored 'General case' 0 N--CA 1.498 1.972 0 O-C-N 121.613 -0.679 . . . . 0.71999999999999997 110.835 -178.038 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 74.3 m-20 58.73 27.81 16.44 Favored 'General case' 0 N--CA 1.506 2.334 0 O-C-N 121.446 -0.784 . . . . 1.0 110.647 176.279 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 49.9 m -105.81 146.9 29.28 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.511 -0.743 . . . . 0.32000000000000001 109.697 173.052 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . 0.443 ' HG2' HD13 ' A' ' 14' ' ' LEU . 73.6 mttt -109.55 145.55 36.16 Favored 'General case' 0 N--CA 1.495 1.783 0 O-C-N 121.572 -0.705 . . . . 1.6299999999999999 110.609 -176.64 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -153.07 131.52 12.14 Favored 'General case' 0 N--CA 1.496 1.833 0 O-C-N 121.809 -0.557 . . . . 0.38 110.266 176.74 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . 0.519 ' O ' HD13 ' A' ' 39' ' ' LEU . 16.6 ptp180 -126.17 144.26 50.82 Favored 'General case' 0 N--CA 1.497 1.92 0 O-C-N 121.659 -0.651 . . . . 2.1699999999999999 110.427 -178.133 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -171.77 171.4 44.08 Favored Glycine 0 N--CA 1.496 2.642 0 N-CA-C 109.189 -1.564 . . . . 0.25 109.189 -176.101 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . 0.423 HG13 ' O ' ' A' ' 8' ' ' GLY . 47.2 t -94.67 119.9 43.32 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.958 0 O-C-N 121.593 -0.945 . . . . 0.23999999999999999 109.375 -176.963 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 25' ' ' ILE . . . . . 0.425 ' HA ' HD23 ' A' ' 37' ' ' LEU . 90.7 mt -64.21 144.16 14.98 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.139 0 O-C-N 121.658 -0.652 . . . . 0.47999999999999998 110.531 -171.482 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 26' ' ' THR . . . . . 0.778 HG21 ' HG3' ' A' ' 38' ' ' ARG . 19.1 p -121.28 -27.28 4.89 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.823 -0.548 . . . . 0.59999999999999998 111.152 178.128 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 27' ' ' ASN . . . . . 0.497 ' O ' HD12 ' A' ' 35' ' ' LEU . 2.1 t-20 -161.37 160.79 29.98 Favored 'General case' 0 N--CA 1.5 2.029 0 C-N-CA 118.97 -1.092 . . . . 1.0900000000000001 111.823 -178.921 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 28' ' ' PHE . . . . . 0.493 ' CE1' HG21 ' A' ' 49' ' ' THR . 84.1 t80 -150.11 126.97 11.07 Favored 'General case' 0 N--CA 1.498 1.954 0 N-CA-C 109.138 -0.689 . . . . 0.65000000000000002 109.138 170.234 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 17.9 t70 -99.7 129.16 45.8 Favored 'General case' 0 N--CA 1.491 1.619 0 N-CA-C 109.121 -0.696 . . . . 1.1499999999999999 109.121 -178.263 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 22.8 m -67.41 -47.67 69.58 Favored 'General case' 0 N--CA 1.498 1.949 0 O-C-N 121.647 -0.658 . . . . 1.3200000000000001 110.714 -175.609 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 22.1 m -59.47 -45.23 92.23 Favored 'General case' 0 N--CA 1.503 2.206 0 O-C-N 121.596 -0.69 . . . . 1.1799999999999999 110.892 -173.878 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 91.3 m-20 -104.69 -7.09 19.83 Favored 'General case' 0 N--CA 1.497 1.891 0 O-C-N 121.645 -0.659 . . . . 1.3400000000000001 111.608 -178.386 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 16.7 m 49.64 67.23 0.93 Allowed 'General case' 0 N--CA 1.507 2.422 0 O-C-N 121.058 -1.026 . . . . 1.1899999999999999 110.857 -174.378 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 34' ' ' ILE . . . . . 1.039 HD12 HG22 ' A' ' 48' ' ' VAL . 45.5 mm -121.4 125.98 74.34 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.993 0 O-C-N 121.545 -0.722 . . . . 0.31 109.333 -175.224 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.497 HD12 ' O ' ' A' ' 27' ' ' ASN . 11.5 tp -115.87 120.76 40.27 Favored 'General case' 0 N--CA 1.494 1.748 0 O-C-N 121.735 -0.603 . . . . 0.26000000000000001 110.559 -168.865 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 98.8 mt-30 -91.03 132.8 35.79 Favored 'General case' 0 N--CA 1.49 1.563 0 N-CA-C 109.494 -0.558 . . . . 1.02 109.494 173.87 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . 0.425 HD23 ' HA ' ' A' ' 25' ' ' ILE . 16.3 mt -117.86 123.82 46.82 Favored 'General case' 0 N--CA 1.495 1.819 0 O-C-N 121.824 -0.547 . . . . 0.54000000000000004 109.992 176.408 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 38' ' ' ARG . . . . . 0.778 ' HG3' HG21 ' A' ' 26' ' ' THR . 26.4 mtp85 -96.79 107.09 19.51 Favored 'General case' 0 N--CA 1.496 1.87 0 O-C-N 121.651 -0.656 . . . . 2.79 109.935 175.545 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . 0.519 HD13 ' O ' ' A' ' 22' ' ' ARG . 17.2 tp -84.53 152.08 24.15 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.684 -0.635 . . . . 0.81000000000000005 110.911 -174.618 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -66.37 -5.83 12.18 Favored 'General case' 0 N--CA 1.502 2.143 0 O-C-N 121.946 -0.471 . . . . 0.47999999999999998 112.006 -172.251 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 91.1 m-20 -86.61 27.91 0.92 Allowed 'General case' 0 N--CA 1.498 1.946 0 O-C-N 121.107 -0.995 . . . . 2.3599999999999999 110.925 174.504 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 8.0 t70 62.96 29.46 16.47 Favored 'General case' 0 N--CA 1.504 2.251 0 O-C-N 121.099 -1.0 . . . . 2.02 110.524 175.687 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 49.9 m -124.51 137.91 54.38 Favored 'General case' 0 N--CA 1.495 1.808 0 O-C-N 121.316 -0.865 . . . . 0.81000000000000005 110.554 -179.597 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 8.6 t -97.97 151.0 20.75 Favored 'General case' 0 N--CA 1.497 1.876 0 O-C-N 121.75 -0.593 . . . . 0.66000000000000003 110.116 175.265 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 37.9 ttmt -150.49 119.13 6.52 Favored 'General case' 0 N--CA 1.495 1.791 0 O-C-N 121.521 -0.737 . . . . 1.97 110.393 179.023 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 88.8 p -95.12 122.87 38.24 Favored 'General case' 0 N--CA 1.496 1.834 0 O-C-N 121.687 -0.633 . . . . 0.28999999999999998 110.27 179.356 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 82.0 mt -129.36 136.36 59.58 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.866 0 O-C-N 121.654 -0.654 . . . . 0.31 109.301 179.427 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 48' ' ' VAL . . . . . 1.039 HG22 HD12 ' A' ' 34' ' ' ILE . 66.9 t -81.88 127.63 39.43 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.914 0 O-C-N 121.565 -0.709 . . . . 0.34999999999999998 109.165 179.068 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 49' ' ' THR . . . . . 0.493 HG21 ' CE1' ' A' ' 28' ' ' PHE . 34.6 p -59.53 -24.86 64.04 Favored 'General case' 0 N--CA 1.504 2.266 0 O-C-N 121.56 -0.713 . . . . 0.33000000000000002 111.998 -170.606 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 77.1 tttt -56.55 -25.49 52.29 Favored 'General case' 0 N--CA 1.502 2.173 0 O-C-N 121.45 -0.781 . . . . 3.2799999999999998 110.943 -176.558 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 7.3 p30 -84.09 4.63 29.34 Favored 'General case' 0 N--CA 1.499 2.007 0 C-N-CA 119.714 -0.794 . . . . 0.54000000000000004 111.364 176.517 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 98.2 mt -75.8 126.46 36.56 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.137 0 O-C-N 121.07 -1.019 . . . . 0.48999999999999999 109.872 175.933 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 47.3 tptt -91.44 -29.95 16.76 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.833 -0.542 . . . . 1.8899999999999999 109.903 170.579 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 5.3 m-20 -164.29 157.01 17.24 Favored 'General case' 0 N--CA 1.5 2.06 0 O-C-N 121.795 -0.566 . . . . 0.85999999999999999 110.026 -178.136 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . 0.671 ' CD2' HG22 ' A' ' 13' ' ' VAL . 84.1 mt -132.97 150.74 52.14 Favored 'General case' 0 N--CA 1.497 1.92 0 O-C-N 121.756 -0.59 . . . . 0.58999999999999997 110.581 -178.65 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 9.2 ptp85 -152.79 142.33 21.78 Favored 'General case' 0 N--CA 1.497 1.884 0 O-C-N 121.729 -0.607 . . . . 1.9299999999999999 109.973 175.349 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 57' ' ' ILE . . . . . 0.528 ' HA ' HG12 ' A' ' 11' ' ' VAL . 68.8 mt -86.42 133.25 30.24 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.928 0 O-C-N 121.501 -0.75 . . . . 0.32000000000000001 110.094 175.14 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . 0.482 HD11 ' HB2' ' A' ' 22' ' ' ARG . 59.6 mt . . . . . 0 N--CA 1.499 1.981 0 O-C-N 121.634 -0.666 . . . . 0.47999999999999998 110.029 -179.557 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 257' ' ' SER . . . . . . . . . . . . . 49.0 m . . . . . 0 N--CA 1.503 2.207 0 CA-C-O 121.219 0.533 . . . . 1.2 110.459 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' B' B ' 258' ' ' SER . . . . . . . . . . . . . 25.4 m -69.07 -32.27 71.6 Favored 'General case' 0 N--CA 1.498 1.968 0 C-N-CA 120.502 -0.479 . . . . 1.3 110.3 -179.883 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 259' ' ' GLN . . . . . . . . . . . . . 98.5 mt-30 -63.42 -36.88 85.2 Favored 'General case' 0 N--CA 1.501 2.086 0 O-C-N 121.557 -0.714 . . . . 2.2400000000000002 110.46 -179.038 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 260' ' ' LEU . . . . . 0.423 HD21 ' CE1' ' A' ' 6' ' ' PHE . 83.3 mt -68.18 -43.9 77.1 Favored 'General case' 0 N--CA 1.5 2.051 0 O-C-N 121.691 -0.631 . . . . 0.48999999999999999 110.206 179.349 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 261' ' ' LEU . . . . . . . . . . . . . 21.7 tp -68.88 -35.06 76.43 Favored 'General case' 0 N--CA 1.498 1.932 0 O-C-N 121.703 -0.623 . . . . 0.39000000000000001 109.756 176.039 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 262' ' ' SER . . . . . . . . . . . . . 23.1 t -62.74 -37.98 88.74 Favored 'General case' 0 N--CA 1.5 2.028 0 O-C-N 121.714 -0.616 . . . . 1.21 110.599 178.127 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 263' ' ' LEU . . . . . . . . . . . . . 33.8 mt . . . . . 0 N--CA 1.501 2.117 0 O-C-N 121.663 -0.648 . . . . 0.64000000000000001 110.09 -179.212 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 70.7 m . . . . . 0 N--CA 1.495 1.794 0 CA-C-O 120.994 0.426 . . . . 0.0 110.085 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 3' ' ' VAL . . . . . 0.416 HG12 ' CE1' ' A' ' 7' ' ' TYR . 73.2 t -66.18 -27.82 41.85 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.061 0 O-C-N 121.703 -0.623 . . . . 0.0 110.278 -179.153 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -55.06 -31.07 60.87 Favored 'General case' 0 N--CA 1.505 2.295 0 O-C-N 121.454 -0.779 . . . . 0.0 110.405 -178.907 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 74.4 m-20 -68.91 -30.62 69.13 Favored 'General case' 0 N--CA 1.499 1.991 0 O-C-N 121.845 -0.534 . . . . 0.0 110.279 174.886 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 96.1 m-85 -95.63 10.13 37.85 Favored 'General case' 0 N--CA 1.497 1.909 0 O-C-N 121.652 -0.655 . . . . 0.0 111.507 -178.025 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 7' ' ' TYR . . . . . 0.416 ' CE1' HG12 ' A' ' 3' ' ' VAL . 3.1 m-30 -67.28 133.18 49.2 Favored 'General case' 0 N--CA 1.502 2.141 0 O-C-N 121.17 -0.956 . . . . 0.0 110.018 173.986 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 8' ' ' GLY . . . . . 0.417 ' O ' HG13 ' A' ' 24' ' ' VAL . . . 83.66 -2.15 87.75 Favored Glycine 0 N--CA 1.497 2.753 0 N-CA-C 110.695 -0.962 . . . . 0.0 110.695 -176.086 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 30.4 t -77.27 138.91 39.67 Favored 'General case' 0 N--CA 1.497 1.918 0 O-C-N 121.11 -1.23 . . . . 0.0 110.461 177.948 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 14.8 t-20 -83.7 121.99 28.03 Favored 'General case' 0 N--CA 1.497 1.924 0 O-C-N 121.69 -0.631 . . . . 0.0 109.659 173.652 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . 0.457 HG12 ' HA ' ' A' ' 57' ' ' ILE . 35.8 m -143.24 159.75 17.46 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.775 0 O-C-N 121.79 -0.568 . . . . 0.0 109.598 -179.22 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 12' ' ' GLU . . . . . 0.565 ' HB2' HD11 ' A' ' 58' ' ' LEU . 46.5 tt0 -109.45 123.74 49.87 Favored 'General case' 0 N--CA 1.493 1.71 0 C-N-CA 119.901 -0.72 . . . . 0.0 109.984 177.009 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 13' ' ' VAL . . . . . 0.594 HG22 ' CD2' ' A' ' 55' ' ' LEU . 60.3 t -106.77 123.4 61.74 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.822 0 O-C-N 121.592 -0.693 . . . . 0.0 109.964 -177.128 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 27.0 tp -96.03 127.53 42.13 Favored 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.69 -0.631 . . . . 0.0 109.622 175.537 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 84.6 mt -97.83 169.87 9.36 Favored 'General case' 0 N--CA 1.495 1.813 0 O-C-N 121.623 -0.673 . . . . 0.0 110.977 -171.945 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 25.0 p30 -58.07 -21.18 44.71 Favored 'General case' 0 N--CA 1.505 2.314 0 O-C-N 121.782 -0.574 . . . . 0.0 111.594 -178.427 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 52.9 p-10 -90.27 21.01 4.02 Favored 'General case' 0 N--CA 1.499 1.978 0 O-C-N 121.548 -0.72 . . . . 0.0 111.121 -177.372 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 74.4 m-20 58.84 27.39 16.05 Favored 'General case' 0 N--CA 1.505 2.298 0 O-C-N 121.36 -0.838 . . . . 0.0 110.734 175.046 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 49.1 m -109.76 133.85 52.67 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.486 -0.759 . . . . 0.0 109.613 172.159 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 22.2 ttpt -109.78 143.12 40.06 Favored 'General case' 0 N--CA 1.494 1.748 0 O-C-N 121.618 -0.677 . . . . 0.0 110.738 -176.377 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -153.08 159.72 42.84 Favored 'General case' 0 N--CA 1.495 1.805 0 O-C-N 121.756 -0.59 . . . . 0.0 109.838 178.264 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . 0.519 ' O ' HD13 ' A' ' 39' ' ' LEU . 33.9 ptt-85 -141.27 148.64 40.15 Favored 'General case' 0 N--CA 1.497 1.895 0 O-C-N 121.625 -0.672 . . . . 0.0 110.831 -178.779 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -171.7 171.41 44.06 Favored Glycine 0 N--CA 1.495 2.631 0 N-CA-C 108.805 -1.718 . . . . 0.0 108.805 -176.589 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . 0.417 HG13 ' O ' ' A' ' 8' ' ' GLY . 46.4 t -94.57 122.5 46.08 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.944 0 O-C-N 121.428 -1.042 . . . . 0.0 109.348 -175.371 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 25' ' ' ILE . . . . . 0.642 ' HA ' HD23 ' A' ' 37' ' ' LEU . 93.6 mt -64.85 142.73 16.54 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.152 0 O-C-N 121.665 -0.647 . . . . 0.0 110.496 -172.066 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 26' ' ' THR . . . . . 0.627 HG21 ' HB2' ' A' ' 38' ' ' ARG . 6.7 p -121.22 -26.46 5.07 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.758 -0.589 . . . . 0.0 111.363 179.09 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 27' ' ' ASN . . . . . 0.523 ' O ' HD12 ' A' ' 35' ' ' LEU . 6.9 t-20 -162.07 160.49 27.49 Favored 'General case' 0 N--CA 1.499 2.009 0 C-N-CA 118.93 -1.108 . . . . 0.0 111.912 -179.109 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 28' ' ' PHE . . . . . 0.498 ' HE1' HG21 ' A' ' 49' ' ' THR . 86.8 t80 -150.03 127.49 11.49 Favored 'General case' 0 N--CA 1.498 1.935 0 N-CA-C 109.136 -0.69 . . . . 0.0 109.136 169.18 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 17.9 t70 -99.43 130.41 45.7 Favored 'General case' 0 N--CA 1.492 1.654 0 N-CA-C 109.002 -0.74 . . . . 0.0 109.002 -177.726 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 23.1 t -68.8 -50.31 51.23 Favored 'General case' 0 N--CA 1.498 1.956 0 C-N-CA 120.097 -0.641 . . . . 0.0 110.538 -176.268 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 21.8 t -59.57 -43.0 93.72 Favored 'General case' 0 N--CA 1.502 2.147 0 O-C-N 121.614 -0.679 . . . . 0.0 110.907 -174.415 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 91.6 m-20 -103.47 -10.02 18.87 Favored 'General case' 0 N--CA 1.498 1.929 0 O-C-N 121.628 -0.67 . . . . 0.0 111.615 -178.079 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 1.9 m 49.94 67.34 0.92 Allowed 'General case' 0 N--CA 1.508 2.443 0 O-C-N 121.072 -1.018 . . . . 0.0 110.938 -174.284 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 34' ' ' ILE . . . . . 1.123 HD12 HG22 ' A' ' 48' ' ' VAL . 46.9 mm -124.31 126.51 72.17 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.09 0 O-C-N 121.615 -0.678 . . . . 0.0 109.472 -175.753 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.523 HD12 ' O ' ' A' ' 27' ' ' ASN . 11.7 tp -115.8 121.17 41.64 Favored 'General case' 0 N--CA 1.494 1.75 0 O-C-N 121.692 -0.63 . . . . 0.0 110.517 -169.243 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 78.9 mt-30 -91.27 134.33 34.66 Favored 'General case' 0 N--CA 1.491 1.577 0 N-CA-C 109.436 -0.579 . . . . 0.0 109.436 173.684 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . 0.642 HD23 ' HA ' ' A' ' 25' ' ' ILE . 89.3 mt -117.78 123.85 46.98 Favored 'General case' 0 N--CA 1.497 1.891 0 O-C-N 121.729 -0.607 . . . . 0.0 109.862 173.635 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 38' ' ' ARG . . . . . 0.627 ' HB2' HG21 ' A' ' 26' ' ' THR . 64.8 ttt180 -97.12 108.4 21.12 Favored 'General case' 0 N--CA 1.497 1.918 0 O-C-N 121.678 -0.639 . . . . 0.0 109.813 176.371 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . 0.519 HD13 ' O ' ' A' ' 22' ' ' ARG . 19.1 tp -84.81 151.85 24.05 Favored 'General case' 0 N--CA 1.494 1.77 0 O-C-N 121.758 -0.589 . . . . 0.0 110.925 -174.522 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -65.88 -6.69 13.05 Favored 'General case' 0 N--CA 1.503 2.176 0 O-C-N 121.97 -0.456 . . . . 0.0 111.951 -172.481 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 91.6 m-20 -86.58 27.81 0.93 Allowed 'General case' 0 N--CA 1.498 1.974 0 O-C-N 121.103 -0.998 . . . . 0.0 110.909 174.73 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 7.9 t70 62.99 29.45 16.43 Favored 'General case' 0 N--CA 1.505 2.275 0 O-C-N 121.078 -1.014 . . . . 0.0 110.52 175.591 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 51.0 m -123.19 137.85 54.79 Favored 'General case' 0 N--CA 1.496 1.872 0 O-C-N 121.36 -0.837 . . . . 0.0 110.411 -179.651 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 8.9 t -98.89 151.02 21.31 Favored 'General case' 0 N--CA 1.497 1.902 0 O-C-N 121.754 -0.591 . . . . 0.0 110.278 176.08 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 85.4 tttt -149.81 119.12 6.83 Favored 'General case' 0 N--CA 1.494 1.767 0 O-C-N 121.579 -0.7 . . . . 0.0 110.301 178.183 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 91.2 p -96.12 122.87 39.42 Favored 'General case' 0 N--CA 1.496 1.827 0 O-C-N 121.647 -0.658 . . . . 0.0 110.175 178.653 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 82.3 mt -129.32 136.2 60.0 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.871 0 O-C-N 121.698 -0.626 . . . . 0.0 109.377 179.682 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 48' ' ' VAL . . . . . 1.123 HG22 HD12 ' A' ' 34' ' ' ILE . 59.3 t -82.37 127.6 39.5 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.91 0 O-C-N 121.6 -0.687 . . . . 0.0 109.196 178.762 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 49' ' ' THR . . . . . 0.498 HG21 ' HE1' ' A' ' 28' ' ' PHE . 37.5 p -59.92 -24.88 64.7 Favored 'General case' 0 N--CA 1.505 2.302 0 O-C-N 121.563 -0.711 . . . . 0.0 112.021 -170.265 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 91.4 mttt -56.84 -23.65 45.62 Favored 'General case' 0 N--CA 1.503 2.204 0 O-C-N 121.461 -0.774 . . . . 0.0 111.006 -176.616 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 45.7 p30 -84.34 2.75 38.96 Favored 'General case' 0 N--CA 1.498 1.957 0 C-N-CA 119.718 -0.793 . . . . 0.0 111.402 176.407 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 98.9 mt -75.12 126.15 35.55 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.119 0 O-C-N 121.204 -0.935 . . . . 0.0 109.997 178.17 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 40.9 tttp -92.79 -28.87 16.3 Favored 'General case' 0 N--CA 1.493 1.722 0 O-C-N 121.848 -0.532 . . . . 0.0 109.954 171.111 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 5.3 m-20 -163.98 155.27 16.14 Favored 'General case' 0 N--CA 1.501 2.086 0 O-C-N 121.806 -0.559 . . . . 0.0 110.005 -178.033 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . 0.594 ' CD2' HG22 ' A' ' 13' ' ' VAL . 85.2 mt -132.95 149.03 52.27 Favored 'General case' 0 N--CA 1.496 1.833 0 O-C-N 121.708 -0.62 . . . . 0.0 110.563 -178.973 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 6.6 ptm180 -151.52 136.05 16.99 Favored 'General case' 0 N--CA 1.497 1.88 0 O-C-N 121.784 -0.573 . . . . 0.0 109.893 175.262 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 57' ' ' ILE . . . . . 0.457 ' HA ' HG12 ' A' ' 11' ' ' VAL . 68.7 mt -84.42 133.18 29.84 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.893 0 O-C-N 121.424 -0.798 . . . . 0.0 109.876 175.841 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . 0.565 HD11 ' HB2' ' A' ' 12' ' ' GLU . 32.3 mt . . . . . 0 N--CA 1.497 1.909 0 O-C-N 121.581 -0.7 . . . . 0.0 110.01 179.619 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 257' ' ' SER . . . . . . . . . . . . . 24.3 m . . . . . 0 N--CA 1.503 2.213 0 CA-C-O 121.348 0.594 . . . . 0.0 110.389 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' B' B ' 258' ' ' SER . . . . . . . . . . . . . 24.0 m -69.56 -32.75 71.72 Favored 'General case' 0 N--CA 1.498 1.934 0 C-N-CA 120.501 -0.48 . . . . 0.0 110.252 179.189 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 259' ' ' GLN . . . . . . . . . . . . . 48.4 tt0 -63.05 -37.85 88.82 Favored 'General case' 0 N--CA 1.501 2.085 0 O-C-N 121.66 -0.65 . . . . 0.0 110.494 -179.248 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 260' ' ' LEU . . . . . . . . . . . . . 84.5 mt -67.47 -42.68 82.61 Favored 'General case' 0 N--CA 1.499 2.01 0 O-C-N 121.611 -0.681 . . . . 0.0 110.154 179.69 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 261' ' ' LEU . . . . . . . . . . . . . 23.1 tp -69.65 -35.87 75.57 Favored 'General case' 0 N--CA 1.497 1.913 0 O-C-N 121.665 -0.647 . . . . 0.0 109.743 175.802 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 262' ' ' SER . . . . . . . . . . . . . 22.8 t -62.72 -38.29 89.89 Favored 'General case' 0 N--CA 1.5 2.074 0 O-C-N 121.743 -0.598 . . . . 0.0 110.634 178.013 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 263' ' ' LEU . . . . . . . . . . . . . 34.9 mt . . . . . 0 N--CA 1.501 2.123 0 O-C-N 121.673 -0.642 . . . . 0.0 110.221 -179.306 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 70.8 m . . . . . 0 N--CA 1.494 1.755 0 CA-C-O 120.982 0.42 . . . . 0.0 110.057 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 3' ' ' VAL . . . . . 0.45 HG12 ' CE1' ' A' ' 7' ' ' TYR . 67.1 t -66.69 -27.92 41.56 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.084 0 O-C-N 121.652 -0.655 . . . . 0.0 110.086 179.474 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -55.02 -30.46 59.56 Favored 'General case' 0 N--CA 1.505 2.289 0 O-C-N 121.451 -0.781 . . . . 0.0 110.395 -179.523 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 74.4 m-20 -68.46 -31.15 70.25 Favored 'General case' 0 N--CA 1.499 1.99 0 O-C-N 121.802 -0.561 . . . . 0.0 110.186 174.676 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 96.1 m-85 -96.02 10.07 38.67 Favored 'General case' 0 N--CA 1.498 1.948 0 O-C-N 121.712 -0.618 . . . . 0.0 111.469 -178.755 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 7' ' ' TYR . . . . . 0.45 ' CE1' HG12 ' A' ' 3' ' ' VAL . 3.6 m-30 -67.19 140.28 57.46 Favored 'General case' 0 N--CA 1.503 2.178 0 O-C-N 121.153 -0.967 . . . . 0.0 110.102 174.647 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 8' ' ' GLY . . . . . 0.424 ' O ' HG13 ' A' ' 24' ' ' VAL . . . 82.33 0.05 89.43 Favored Glycine 0 N--CA 1.497 2.727 0 N-CA-C 110.574 -1.01 . . . . 0.0 110.574 -175.982 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 30.2 t -77.41 134.91 38.3 Favored 'General case' 0 N--CA 1.497 1.912 0 O-C-N 121.129 -1.218 . . . . 0.0 110.492 179.208 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 11.8 t-20 -83.23 118.73 23.83 Favored 'General case' 0 N--CA 1.497 1.889 0 O-C-N 121.625 -0.672 . . . . 0.0 109.596 173.063 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . 0.538 HG12 ' HA ' ' A' ' 57' ' ' ILE . 35.6 m -142.45 161.68 19.04 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.678 0 O-C-N 121.674 -0.641 . . . . 0.0 109.741 -177.381 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 12' ' ' GLU . . . . . 0.525 ' HB2' HD11 ' A' ' 58' ' ' LEU . 46.7 tt0 -109.32 147.41 32.74 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.684 -0.635 . . . . 0.0 109.632 177.103 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 13' ' ' VAL . . . . . 0.594 ' CG1' HG23 ' A' ' 52' ' ' ILE . 60.9 t -137.14 126.41 36.43 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.743 0 O-C-N 121.621 -0.674 . . . . 0.0 109.709 -175.36 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . 0.442 HD13 ' HG2' ' A' ' 20' ' ' LYS . 23.7 tp -95.89 129.79 43.04 Favored 'General case' 0 N--CA 1.492 1.646 0 N-CA-C 109.432 -0.581 . . . . 0.0 109.432 176.525 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 0.503 HD23 ' HA ' ' A' ' 52' ' ' ILE . 82.3 mt -90.6 170.14 10.42 Favored 'General case' 0 N--CA 1.496 1.857 0 O-C-N 121.657 -0.652 . . . . 0.0 110.565 -175.53 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 23.9 p30 -56.8 -22.95 39.98 Favored 'General case' 0 N--CA 1.506 2.351 0 O-C-N 121.751 -0.593 . . . . 0.0 111.51 -177.799 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 53.6 p-10 -94.2 24.15 4.58 Favored 'General case' 0 N--CA 1.497 1.89 0 O-C-N 121.535 -0.728 . . . . 0.0 110.733 -177.714 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 10.4 m-20 59.41 28.43 17.8 Favored 'General case' 0 N--CA 1.506 2.346 0 O-C-N 121.446 -0.783 . . . . 0.0 110.607 175.721 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 50.3 m -103.87 144.83 30.98 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.437 -0.789 . . . . 0.0 109.659 172.359 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . 0.442 ' HG2' HD13 ' A' ' 14' ' ' LEU . 97.2 mttt -109.57 145.07 36.99 Favored 'General case' 0 N--CA 1.495 1.791 0 O-C-N 121.543 -0.723 . . . . 0.0 110.665 -176.166 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -153.05 133.4 13.58 Favored 'General case' 0 N--CA 1.496 1.86 0 O-C-N 121.713 -0.617 . . . . 0.0 110.229 176.359 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . 0.488 ' O ' HD13 ' A' ' 39' ' ' LEU . 35.1 ptt180 -128.48 144.78 51.2 Favored 'General case' 0 N--CA 1.498 1.957 0 O-C-N 121.685 -0.634 . . . . 0.0 110.39 -178.009 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -171.78 171.43 44.1 Favored Glycine 0 N--CA 1.496 2.635 0 N-CA-C 109.229 -1.548 . . . . 0.0 109.229 -175.36 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . 0.424 HG13 ' O ' ' A' ' 8' ' ' GLY . 47.4 t -94.59 119.11 42.11 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.986 0 O-C-N 121.609 -0.936 . . . . 0.0 109.355 -176.968 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 25' ' ' ILE . . . . . 0.423 ' HA ' HD23 ' A' ' 37' ' ' LEU . 89.7 mt -64.29 143.57 15.57 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.163 0 O-C-N 121.704 -0.623 . . . . 0.0 110.56 -171.381 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 26' ' ' THR . . . . . 0.584 HG21 ' HB2' ' A' ' 38' ' ' ARG . 10.1 p -121.24 -25.89 5.17 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.773 -0.58 . . . . 0.0 111.237 178.246 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 2.0 t-20 -162.28 158.07 23.76 Favored 'General case' 0 N--CA 1.501 2.121 0 O-C-N 121.0 -1.063 . . . . 0.0 111.774 -179.08 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 28' ' ' PHE . . . . . 0.568 ' HE1' HG21 ' A' ' 49' ' ' THR . 91.2 t80 -150.16 124.29 9.43 Favored 'General case' 0 N--CA 1.5 2.056 0 N-CA-C 109.361 -0.607 . . . . 0.0 109.361 171.428 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . 0.402 ' O ' ' N ' ' A' ' 33' ' ' SER . 21.7 t70 -98.12 126.27 43.49 Favored 'General case' 0 N--CA 1.492 1.658 0 N-CA-C 109.091 -0.707 . . . . 0.0 109.091 -179.296 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 87.0 p -65.16 -43.03 93.1 Favored 'General case' 0 N--CA 1.5 2.07 0 O-C-N 121.65 -0.656 . . . . 0.0 110.778 -174.143 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 19.6 m -60.21 -48.05 83.37 Favored 'General case' 0 N--CA 1.503 2.196 0 O-C-N 121.522 -0.736 . . . . 0.0 110.884 -173.573 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 91.7 m-20 -107.07 -0.05 23.18 Favored 'General case' 0 N--CA 1.498 1.961 0 O-C-N 121.621 -0.675 . . . . 0.0 111.697 -179.258 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 33' ' ' SER . . . . . 0.402 ' N ' ' O ' ' A' ' 29' ' ' ASP . 38.8 p 45.71 67.08 0.79 Allowed 'General case' 0 N--CA 1.508 2.45 0 O-C-N 121.423 -0.798 . . . . 0.0 111.142 -174.754 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 34' ' ' ILE . . . . . 1.074 HD12 HG22 ' A' ' 48' ' ' VAL . 44.8 mm -114.5 125.79 71.89 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.981 0 O-C-N 121.553 -0.717 . . . . 0.0 109.222 -175.917 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 11.3 tp -115.84 120.52 39.53 Favored 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.633 -0.667 . . . . 0.0 110.53 -168.605 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 67.3 mt-30 -91.04 132.11 36.21 Favored 'General case' 0 N--CA 1.489 1.51 0 N-CA-C 109.201 -0.666 . . . . 0.0 109.201 171.952 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . 0.423 HD23 ' HA ' ' A' ' 25' ' ' ILE . 16.7 mt -117.77 123.76 46.77 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.812 -0.555 . . . . 0.0 110.07 175.837 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 38' ' ' ARG . . . . . 0.584 ' HB2' HG21 ' A' ' 26' ' ' THR . 72.8 ttt180 -96.29 104.95 16.95 Favored 'General case' 0 N--CA 1.496 1.868 0 O-C-N 121.721 -0.612 . . . . 0.0 109.79 176.001 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . 0.488 HD13 ' O ' ' A' ' 22' ' ' ARG . 18.4 tp -84.56 153.63 23.13 Favored 'General case' 0 N--CA 1.495 1.803 0 O-C-N 121.699 -0.626 . . . . 0.0 110.949 -173.602 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -67.46 -4.59 11.77 Favored 'General case' 0 N--CA 1.503 2.201 0 O-C-N 121.895 -0.503 . . . . 0.0 111.986 -171.753 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 30.1 m120 -87.1 27.62 1.01 Allowed 'General case' 0 N--CA 1.498 1.925 0 O-C-N 121.063 -1.023 . . . . 0.0 110.871 174.063 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 15.3 t0 63.13 29.28 16.16 Favored 'General case' 0 N--CA 1.505 2.286 0 O-C-N 121.079 -1.013 . . . . 0.0 110.521 175.848 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 48.7 m -125.65 137.85 53.89 Favored 'General case' 0 N--CA 1.495 1.818 0 O-C-N 121.357 -0.839 . . . . 0.0 110.528 -179.33 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 9.7 t -97.94 151.03 20.7 Favored 'General case' 0 N--CA 1.497 1.917 0 O-C-N 121.764 -0.585 . . . . 0.0 110.122 174.986 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . 0.426 ' CE ' HD11 ' A' ' 47' ' ' ILE . 42.1 tttp -148.96 119.09 7.21 Favored 'General case' 0 N--CA 1.496 1.84 0 O-C-N 121.562 -0.711 . . . . 0.0 110.384 179.049 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 90.3 p -96.46 120.34 36.6 Favored 'General case' 0 N--CA 1.495 1.805 0 O-C-N 121.712 -0.617 . . . . 0.0 110.286 179.271 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 47' ' ' ILE . . . . . 0.426 HD11 ' CE ' ' A' ' 45' ' ' LYS . 82.5 mt -129.42 138.89 53.16 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.908 0 O-C-N 121.712 -0.618 . . . . 0.0 109.343 179.251 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 48' ' ' VAL . . . . . 1.074 HG22 HD12 ' A' ' 34' ' ' ILE . 63.2 t -82.12 127.69 39.39 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.955 0 C-N-CA 120.001 -0.679 . . . . 0.0 109.207 178.54 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 49' ' ' THR . . . . . 0.568 HG21 ' HE1' ' A' ' 28' ' ' PHE . 41.9 p -59.34 -25.08 63.9 Favored 'General case' 0 N--CA 1.504 2.235 0 O-C-N 121.624 -0.672 . . . . 0.0 112.059 -169.449 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 60.0 tttt -57.58 -23.15 49.2 Favored 'General case' 0 N--CA 1.502 2.149 0 O-C-N 121.546 -0.721 . . . . 0.0 111.261 -175.524 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 10.3 p30 -81.17 -3.46 52.26 Favored 'General case' 0 N--CA 1.499 2.01 0 C-N-CA 119.702 -0.799 . . . . 0.0 111.058 176.078 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 52' ' ' ILE . . . . . 0.761 HG21 HD11 ' A' ' 55' ' ' LEU . 95.8 mt -79.79 135.28 25.84 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.021 0 O-C-N 121.265 -0.897 . . . . 0.0 110.219 177.926 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 83.6 tttt -92.08 -28.47 17.11 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.9 -0.5 . . . . 0.0 109.785 170.294 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 54' ' ' ASP . . . . . 0.402 ' HA ' HD13 ' B' ' 261' ' ' LEU . 1.6 m-20 -164.83 158.46 17.42 Favored 'General case' 0 N--CA 1.503 2.204 0 O-C-N 121.735 -0.603 . . . . 0.0 110.287 -177.012 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . 0.761 HD11 HG21 ' A' ' 52' ' ' ILE . 4.2 mp -132.93 153.64 51.21 Favored 'General case' 0 N--CA 1.497 1.893 0 O-C-N 121.74 -0.6 . . . . 0.0 110.411 178.227 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 20.1 ptp180 -151.87 146.39 25.63 Favored 'General case' 0 N--CA 1.496 1.863 0 O-C-N 121.719 -0.613 . . . . 0.0 109.964 175.549 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 57' ' ' ILE . . . . . 0.538 ' HA ' HG12 ' A' ' 11' ' ' VAL . 62.4 mt -85.54 133.32 29.78 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.956 0 O-C-N 121.559 -0.713 . . . . 0.0 109.87 173.732 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . 0.525 HD11 ' HB2' ' A' ' 12' ' ' GLU . 61.3 mt . . . . . 0 N--CA 1.498 1.946 0 O-C-N 121.559 -0.713 . . . . 0.0 110.073 -177.971 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 257' ' ' SER . . . . . . . . . . . . . 27.1 m . . . . . 0 N--CA 1.503 2.195 0 CA-C-O 121.091 0.472 . . . . 0.0 110.643 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' B' B ' 258' ' ' SER . . . . . . . . . . . . . 60.2 p -69.32 -30.87 69.02 Favored 'General case' 0 N--CA 1.5 2.029 0 C-N-CA 120.366 -0.534 . . . . 0.0 110.4 -177.604 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 259' ' ' GLN . . . . . . . . . . . . . 47.4 tt0 -64.96 -40.1 94.48 Favored 'General case' 0 N--CA 1.5 2.051 0 O-C-N 121.623 -0.673 . . . . 0.0 110.395 -179.721 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 260' ' ' LEU . . . . . 0.461 ' HA ' HD12 ' B' ' 263' ' ' LEU . 83.7 mt -68.84 -38.98 80.19 Favored 'General case' 0 N--CA 1.499 1.993 0 O-C-N 121.686 -0.634 . . . . 0.0 110.243 179.882 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 261' ' ' LEU . . . . . 0.612 HD13 HD12 ' A' ' 55' ' ' LEU . 29.6 tp -67.91 -36.98 81.13 Favored 'General case' 0 N--CA 1.498 1.965 0 O-C-N 121.638 -0.664 . . . . 0.0 110.018 179.064 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 262' ' ' SER . . . . . . . . . . . . . 23.0 t -62.48 -38.54 90.25 Favored 'General case' 0 N--CA 1.501 2.101 0 O-C-N 121.754 -0.591 . . . . 0.0 110.465 177.587 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 263' ' ' LEU . . . . . 0.461 HD12 ' HA ' ' B' ' 260' ' ' LEU . 45.7 mt . . . . . 0 N--CA 1.501 2.076 0 O-C-N 121.663 -0.648 . . . . 0.0 110.363 179.208 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 68.6 m . . . . . 0 N--CA 1.496 1.858 0 CA-C-O 120.933 0.397 . . . . 0.0 110.047 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 3' ' ' VAL . . . . . 0.422 HG12 ' CE1' ' A' ' 7' ' ' TYR . 78.5 t -66.64 -27.75 41.09 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.06 0 O-C-N 121.699 -0.626 . . . . 0.0 110.303 -178.543 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -55.33 -31.53 61.77 Favored 'General case' 0 N--CA 1.504 2.272 0 O-C-N 121.375 -0.828 . . . . 0.0 110.399 -178.828 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 74.4 m-20 -69.04 -30.64 69.04 Favored 'General case' 0 N--CA 1.499 2.0 0 O-C-N 121.85 -0.531 . . . . 0.0 110.283 174.845 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 91.0 m-85 -95.4 10.02 37.86 Favored 'General case' 0 N--CA 1.497 1.917 0 O-C-N 121.59 -0.694 . . . . 0.0 111.536 -178.08 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 7' ' ' TYR . . . . . 0.422 ' CE1' HG12 ' A' ' 3' ' ' VAL . 2.9 m-30 -67.2 134.57 51.95 Favored 'General case' 0 N--CA 1.502 2.163 0 O-C-N 121.072 -1.017 . . . . 0.0 109.941 173.953 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 8' ' ' GLY . . . . . 0.435 ' O ' HG13 ' A' ' 24' ' ' VAL . . . 83.49 -1.05 89.3 Favored Glycine 0 N--CA 1.496 2.676 0 N-CA-C 110.84 -0.904 . . . . 0.0 110.84 -178.046 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . 0.634 ' OG ' HD12 ' A' ' 25' ' ' ILE . 83.1 p -77.82 137.59 38.5 Favored 'General case' 0 N--CA 1.499 2.01 0 O-C-N 121.064 -1.257 . . . . 0.0 110.516 176.855 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 27.0 t-20 -85.17 119.28 25.38 Favored 'General case' 0 N--CA 1.498 1.952 0 O-C-N 121.592 -0.692 . . . . 0.0 109.925 174.102 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . 0.517 HG12 ' HA ' ' A' ' 57' ' ' ILE . 35.2 m -142.5 163.02 18.37 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.729 0 N-CA-C 109.448 -0.575 . . . . 0.0 109.448 -179.837 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 12' ' ' GLU . . . . . 0.527 ' HB2' HD11 ' A' ' 58' ' ' LEU . 41.8 tt0 -109.34 127.4 54.3 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.489 -0.757 . . . . 0.0 110.072 178.236 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 13' ' ' VAL . . . . . 0.61 HG22 ' CD2' ' A' ' 55' ' ' LEU . 55.5 t -106.83 124.78 62.7 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.744 0 O-C-N 121.619 -0.675 . . . . 0.0 109.913 -177.848 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 22.2 tp -96.02 126.73 41.46 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.687 -0.633 . . . . 0.0 109.456 174.31 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 86.3 mt -97.46 166.37 11.56 Favored 'General case' 0 N--CA 1.495 1.819 0 O-C-N 121.588 -0.695 . . . . 0.0 111.167 -171.38 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 16.7 p30 -58.09 -22.62 51.33 Favored 'General case' 0 N--CA 1.506 2.333 0 O-C-N 121.746 -0.596 . . . . 0.0 111.535 -177.277 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 40.3 p-10 -93.0 23.56 4.18 Favored 'General case' 0 N--CA 1.497 1.918 0 O-C-N 121.571 -0.705 . . . . 0.0 110.847 -176.551 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 74.3 m-20 59.1 27.7 16.75 Favored 'General case' 0 N--CA 1.505 2.292 0 O-C-N 121.398 -0.814 . . . . 0.0 110.671 175.838 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 50.5 m -104.62 133.98 48.55 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.502 -0.749 . . . . 0.0 109.63 172.339 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 30.2 ttmt -109.66 138.76 45.56 Favored 'General case' 0 N--CA 1.495 1.793 0 O-C-N 121.715 -0.616 . . . . 0.0 110.413 -176.008 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -153.02 160.54 43.0 Favored 'General case' 0 N--CA 1.496 1.845 0 O-C-N 121.718 -0.614 . . . . 0.0 110.278 179.438 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 6.8 ptp85 -140.69 154.44 46.37 Favored 'General case' 0 N--CA 1.496 1.831 0 O-C-N 121.665 -0.647 . . . . 0.0 110.355 -179.914 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . 0.515 ' HA2' HD13 ' A' ' 39' ' ' LEU . . . -171.85 171.13 43.95 Favored Glycine 0 N--CA 1.494 2.527 0 N-CA-C 109.059 -1.616 . . . . 0.0 109.059 179.429 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . 0.435 HG13 ' O ' ' A' ' 8' ' ' GLY . 40.9 t -94.7 123.05 46.67 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.983 0 O-C-N 121.66 -0.906 . . . . 0.0 109.259 176.3 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 25' ' ' ILE . . . . . 0.634 HD12 ' OG ' ' A' ' 9' ' ' SER . 96.0 mt -63.18 141.43 18.14 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.182 0 O-C-N 121.62 -0.675 . . . . 0.0 110.499 -171.953 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 26' ' ' THR . . . . . 0.641 HG21 ' HB2' ' A' ' 38' ' ' ARG . 12.2 p -121.15 -25.41 5.3 Favored 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.818 -0.551 . . . . 0.0 111.229 -179.545 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 27' ' ' ASN . . . . . 0.488 ' O ' HD12 ' A' ' 35' ' ' LEU . 2.0 t-20 -163.38 161.42 24.44 Favored 'General case' 0 N--CA 1.5 2.075 0 O-C-N 120.901 -1.124 . . . . 0.0 111.849 178.864 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 28' ' ' PHE . . . . . 0.453 ' HE1' HG21 ' A' ' 49' ' ' THR . 84.5 t80 -150.03 129.0 12.59 Favored 'General case' 0 N--CA 1.498 1.963 0 N-CA-C 109.23 -0.655 . . . . 0.0 109.23 169.032 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 21.2 t70 -98.77 131.23 45.06 Favored 'General case' 0 N--CA 1.492 1.625 0 N-CA-C 109.031 -0.729 . . . . 0.0 109.031 -178.359 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 87.4 p -69.81 -50.64 41.01 Favored 'General case' 0 N--CA 1.498 1.953 0 C-N-CA 120.032 -0.667 . . . . 0.0 110.616 -175.35 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 5.2 t -59.63 -42.61 93.1 Favored 'General case' 0 N--CA 1.502 2.131 0 O-C-N 121.567 -0.708 . . . . 0.0 110.782 -174.632 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 28.6 m120 -103.79 -10.06 18.56 Favored 'General case' 0 N--CA 1.496 1.875 0 O-C-N 121.663 -0.648 . . . . 0.0 111.518 -177.266 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 2.1 m 49.94 67.31 0.92 Allowed 'General case' 0 N--CA 1.508 2.452 0 O-C-N 121.027 -1.046 . . . . 0.0 110.876 -174.153 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 34' ' ' ILE . . . . . 1.125 HD12 HG22 ' A' ' 48' ' ' VAL . 45.8 mm -123.51 125.86 72.18 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.043 0 O-C-N 121.519 -0.738 . . . . 0.0 109.333 -175.698 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.488 HD12 ' O ' ' A' ' 27' ' ' ASN . 9.5 tp -115.7 122.73 46.42 Favored 'General case' 0 N--CA 1.495 1.792 0 O-C-N 121.701 -0.624 . . . . 0.0 110.628 -168.639 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 78.4 mt-30 -91.03 133.22 35.49 Favored 'General case' 0 N--CA 1.49 1.562 0 N-CA-C 109.445 -0.576 . . . . 0.0 109.445 172.318 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 13.7 mt -117.83 123.54 46.16 Favored 'General case' 0 N--CA 1.494 1.772 0 C-N-CA 120.224 -0.59 . . . . 0.0 110.036 174.676 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 38' ' ' ARG . . . . . 0.641 ' HB2' HG21 ' A' ' 26' ' ' THR . 63.3 ttt180 -104.5 105.01 14.96 Favored 'General case' 0 N--CA 1.495 1.811 0 O-C-N 121.761 -0.587 . . . . 0.0 110.132 174.62 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . 0.515 HD13 ' HA2' ' A' ' 23' ' ' GLY . 62.9 tp -83.65 155.45 23.18 Favored 'General case' 0 N--CA 1.499 1.977 0 O-C-N 121.535 -0.728 . . . . 0.0 110.679 -176.086 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -67.19 -3.1 6.8 Favored 'General case' 0 N--CA 1.503 2.22 0 O-C-N 121.806 -0.559 . . . . 0.0 112.154 -170.497 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 35.4 p-10 -85.75 28.99 0.73 Allowed 'General case' 0 N--CA 1.499 1.993 0 O-C-N 121.044 -1.035 . . . . 0.0 110.937 173.166 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 74.1 m-20 59.05 29.28 18.8 Favored 'General case' 0 N--CA 1.505 2.298 0 O-C-N 121.26 -0.9 . . . . 0.0 110.357 177.138 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 68.9 m -121.5 141.93 50.55 Favored 'General case' 0 N--CA 1.494 1.758 0 O-C-N 121.502 -0.748 . . . . 0.0 109.99 177.112 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 9.0 t -128.16 147.37 50.55 Favored 'General case' 0 N--CA 1.495 1.816 0 O-C-N 121.621 -0.674 . . . . 0.0 109.966 179.903 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 77.1 tttt -150.76 134.11 16.26 Favored 'General case' 0 N--CA 1.495 1.798 0 C-N-CA 120.157 -0.617 . . . . 0.0 110.595 -177.325 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 88.4 p -94.72 123.04 37.94 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.817 -0.552 . . . . 0.0 110.105 177.93 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 82.2 mt -129.25 137.92 55.76 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.857 0 N-CA-C 109.252 -0.648 . . . . 0.0 109.252 179.683 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 48' ' ' VAL . . . . . 1.125 HG22 HD12 ' A' ' 34' ' ' ILE . 58.7 t -82.41 127.61 39.48 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.874 0 O-C-N 121.598 -0.689 . . . . 0.0 109.297 179.638 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 49' ' ' THR . . . . . 0.453 HG21 ' HE1' ' A' ' 28' ' ' PHE . 34.2 p -59.88 -24.89 64.64 Favored 'General case' 0 N--CA 1.504 2.269 0 O-C-N 121.552 -0.717 . . . . 0.0 112.052 -170.727 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 51.4 mttm -57.14 -25.23 58.55 Favored 'General case' 0 N--CA 1.503 2.224 0 O-C-N 121.474 -0.766 . . . . 0.0 110.96 -176.289 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 6.4 p30 -84.35 4.85 29.39 Favored 'General case' 0 N--CA 1.499 1.998 0 C-N-CA 119.659 -0.817 . . . . 0.0 111.381 176.295 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 98.9 mt -75.59 127.72 37.1 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.13 0 O-C-N 121.119 -0.988 . . . . 0.0 109.831 175.953 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 85.3 tttt -92.9 -29.62 15.82 Favored 'General case' 0 N--CA 1.493 1.697 0 O-C-N 121.853 -0.53 . . . . 0.0 109.738 170.844 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 5.3 m-20 -164.09 155.18 15.77 Favored 'General case' 0 N--CA 1.5 2.048 0 O-C-N 121.821 -0.549 . . . . 0.0 110.091 -177.715 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . 0.61 ' CD2' HG22 ' A' ' 13' ' ' VAL . 80.0 mt -132.95 148.97 52.28 Favored 'General case' 0 N--CA 1.496 1.861 0 O-C-N 121.675 -0.641 . . . . 0.0 110.4 -179.346 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 19.7 ptp180 -150.8 146.46 26.39 Favored 'General case' 0 N--CA 1.496 1.874 0 O-C-N 121.75 -0.594 . . . . 0.0 109.933 174.937 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 57' ' ' ILE . . . . . 0.517 ' HA ' HG12 ' A' ' 11' ' ' VAL . 59.2 mt -86.98 133.24 30.45 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.866 0 O-C-N 121.497 -0.752 . . . . 0.0 109.97 173.455 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . 0.527 HD11 ' HB2' ' A' ' 12' ' ' GLU . 73.0 mt . . . . . 0 N--CA 1.498 1.955 0 O-C-N 121.628 -0.67 . . . . 0.0 110.153 -179.205 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 257' ' ' SER . . . . . . . . . . . . . 23.6 m . . . . . 0 N--CA 1.502 2.139 0 CA-C-O 121.231 0.539 . . . . 0.0 110.546 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' B' B ' 258' ' ' SER . . . . . . . . . . . . . 62.4 p -70.3 -31.79 69.27 Favored 'General case' 0 N--CA 1.498 1.973 0 C-N-CA 120.306 -0.558 . . . . 0.0 110.373 -179.265 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 259' ' ' GLN . . . . . . . . . . . . . 77.7 mt-30 -65.39 -34.87 79.32 Favored 'General case' 0 N--CA 1.501 2.085 0 O-C-N 121.597 -0.69 . . . . 0.0 110.361 -179.986 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 260' ' ' LEU . . . . . 0.419 ' HA ' HD12 ' B' ' 263' ' ' LEU . 82.7 mt -68.48 -40.93 80.75 Favored 'General case' 0 N--CA 1.499 2.018 0 O-C-N 121.661 -0.649 . . . . 0.0 110.19 179.878 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 261' ' ' LEU . . . . . . . . . . . . . 24.6 tp -69.81 -40.77 75.75 Favored 'General case' 0 N--CA 1.498 1.967 0 O-C-N 121.671 -0.643 . . . . 0.0 109.972 177.678 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 262' ' ' SER . . . . . . . . . . . . . 83.5 p -63.07 -33.85 76.34 Favored 'General case' 0 N--CA 1.501 2.081 0 O-C-N 121.678 -0.639 . . . . 0.0 110.462 177.64 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 263' ' ' LEU . . . . . 0.419 HD12 ' HA ' ' B' ' 260' ' ' LEU . 25.3 mt . . . . . 0 N--CA 1.501 2.118 0 O-C-N 121.606 -0.684 . . . . 0.0 110.204 178.682 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 73.9 m . . . . . 0 N--CA 1.496 1.87 0 CA-C-O 121.1 0.476 . . . . 0.0 110.435 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 3' ' ' VAL . . . . . 0.453 HG21 ' CE1' ' A' ' 28' ' ' PHE . 55.9 t -64.97 -27.95 43.63 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.165 0 O-C-N 121.707 -0.621 . . . . 0.0 110.408 -179.298 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -55.45 -31.39 61.91 Favored 'General case' 0 N--CA 1.504 2.234 0 O-C-N 121.418 -0.801 . . . . 0.0 110.515 -178.664 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 74.4 m-20 -68.5 -34.24 75.54 Favored 'General case' 0 N--CA 1.499 1.984 0 O-C-N 121.793 -0.567 . . . . 0.0 109.973 174.787 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 6' ' ' PHE . . . . . 0.411 ' CD1' HD21 ' B' ' 260' ' ' LEU . 96.6 m-85 -97.5 10.12 40.64 Favored 'General case' 0 N--CA 1.496 1.867 0 O-C-N 121.732 -0.605 . . . . 0.0 111.246 178.931 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -67.41 127.95 34.61 Favored 'General case' 0 N--CA 1.501 2.09 0 O-C-N 121.223 -0.923 . . . . 0.0 110.162 -178.661 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 8' ' ' GLY . . . . . 0.456 ' O ' HG13 ' A' ' 24' ' ' VAL . . . 83.24 -2.11 87.58 Favored Glycine 0 N--CA 1.498 2.77 0 N-CA-C 110.851 -0.899 . . . . 0.0 110.851 -177.51 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 57.0 p -76.85 145.05 38.61 Favored 'General case' 0 N--CA 1.498 1.949 0 O-C-N 120.969 -1.312 . . . . 0.0 110.168 177.499 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 10' ' ' ASN . . . . . 0.78 ' CG ' HG22 ' A' ' 24' ' ' VAL . 2.3 m-20 -85.21 119.27 25.41 Favored 'General case' 0 N--CA 1.496 1.87 0 O-C-N 121.644 -0.66 . . . . 0.0 109.598 174.785 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . 0.479 HG12 ' HA ' ' A' ' 57' ' ' ILE . 32.9 m -142.44 159.84 19.42 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.846 0 O-C-N 121.69 -0.631 . . . . 0.0 109.754 179.885 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 12' ' ' GLU . . . . . 0.577 ' HB2' HD11 ' A' ' 58' ' ' LEU . 46.5 tt0 -109.4 128.94 55.52 Favored 'General case' 0 N--CA 1.494 1.731 0 C-N-CA 119.912 -0.715 . . . . 0.0 110.169 179.023 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 13' ' ' VAL . . . . . 0.562 HG22 ' CD2' ' A' ' 55' ' ' LEU . 60.4 t -106.78 127.69 62.1 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.766 0 O-C-N 121.728 -0.608 . . . . 0.0 109.957 -179.289 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . 0.533 HD13 ' HG2' ' A' ' 20' ' ' LYS . 29.0 tp -95.74 127.73 42.02 Favored 'General case' 0 N--CA 1.494 1.733 0 N-CA-C 109.125 -0.695 . . . . 0.0 109.125 173.776 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 83.8 mt -96.05 168.27 10.72 Favored 'General case' 0 N--CA 1.495 1.821 0 O-C-N 121.653 -0.654 . . . . 0.0 111.097 -172.846 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 24.2 p30 -57.89 -22.06 46.48 Favored 'General case' 0 N--CA 1.506 2.333 0 O-C-N 121.815 -0.553 . . . . 0.0 111.484 -178.537 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 25.1 p30 -91.29 22.36 3.91 Favored 'General case' 0 N--CA 1.499 1.996 0 O-C-N 121.586 -0.696 . . . . 0.0 111.078 -177.364 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 74.4 m-20 59.79 28.53 18.01 Favored 'General case' 0 N--CA 1.506 2.361 0 O-C-N 121.393 -0.817 . . . . 0.0 110.813 172.805 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 17.9 m -111.49 147.32 35.58 Favored 'General case' 0 N--CA 1.494 1.743 0 O-C-N 121.474 -0.766 . . . . 0.0 109.573 171.229 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . 0.533 ' HG2' HD13 ' A' ' 14' ' ' LEU . 97.1 mttt -109.59 150.29 28.43 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.616 -0.677 . . . . 0.0 110.608 -177.248 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -153.01 154.15 34.35 Favored 'General case' 0 N--CA 1.496 1.867 0 O-C-N 121.824 -0.548 . . . . 0.0 109.999 176.188 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . 0.405 ' O ' HD22 ' A' ' 39' ' ' LEU . 7.7 ptp85 -138.22 150.41 46.71 Favored 'General case' 0 N--CA 1.494 1.765 0 O-C-N 121.569 -0.707 . . . . 0.0 110.494 179.75 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . 0.425 ' HA2' HD13 ' A' ' 39' ' ' LEU . . . -171.83 171.16 43.96 Favored Glycine 0 N--CA 1.492 2.383 0 N-CA-C 109.069 -1.613 . . . . 0.0 109.069 -178.958 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . 0.78 HG22 ' CG ' ' A' ' 10' ' ' ASN . 40.6 t -94.48 125.39 47.1 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.912 0 O-C-N 121.676 -0.896 . . . . 0.0 109.082 176.156 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 25' ' ' ILE . . . . . 0.498 ' HA ' HD23 ' A' ' 37' ' ' LEU . 45.7 mt -61.23 137.03 24.13 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.259 0 O-C-N 121.568 -0.707 . . . . 0.0 110.824 -171.554 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 26' ' ' THR . . . . . 0.709 HG21 ' HB2' ' A' ' 38' ' ' ARG . 10.0 p -121.15 -19.81 6.99 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.921 -0.487 . . . . 0.0 111.581 -178.25 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 11.2 t30 -165.74 158.14 14.97 Favored 'General case' 0 N--CA 1.504 2.268 0 O-C-N 120.886 -1.134 . . . . 0.0 111.937 176.517 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 28' ' ' PHE . . . . . 0.453 ' CE1' HG21 ' A' ' 3' ' ' VAL . 77.2 t80 -150.34 119.99 7.0 Favored 'General case' 0 N--CA 1.496 1.853 0 N-CA-C 109.101 -0.703 . . . . 0.0 109.101 172.618 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 21.2 t70 -98.21 128.28 44.59 Favored 'General case' 0 N--CA 1.492 1.641 0 N-CA-C 109.248 -0.649 . . . . 0.0 109.248 -176.949 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 22.7 m -67.48 -47.97 68.51 Favored 'General case' 0 N--CA 1.498 1.956 0 O-C-N 121.578 -0.701 . . . . 0.0 110.661 -175.856 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 22.2 m -59.32 -45.49 91.2 Favored 'General case' 0 N--CA 1.502 2.164 0 O-C-N 121.591 -0.693 . . . . 0.0 110.897 -174.058 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 91.4 m-20 -105.53 -5.63 20.05 Favored 'General case' 0 N--CA 1.496 1.861 0 O-C-N 121.63 -0.669 . . . . 0.0 111.743 -177.973 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 58.7 m 49.42 67.18 0.93 Allowed 'General case' 0 N--CA 1.508 2.461 0 O-C-N 121.023 -1.048 . . . . 0.0 110.925 -174.277 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 34' ' ' ILE . . . . . 1.09 HD12 HG22 ' A' ' 48' ' ' VAL . 44.5 mm -117.7 125.9 74.4 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.974 0 O-C-N 121.537 -0.727 . . . . 0.0 109.236 -175.407 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 11.0 tp -115.93 118.97 34.44 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.687 -0.633 . . . . 0.0 110.477 -170.539 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 78.2 mt-30 -91.51 133.34 35.59 Favored 'General case' 0 N--CA 1.49 1.537 0 N-CA-C 109.333 -0.617 . . . . 0.0 109.333 171.872 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . 0.498 HD23 ' HA ' ' A' ' 25' ' ' ILE . 52.0 mt -117.84 123.55 46.17 Favored 'General case' 0 N--CA 1.493 1.684 0 C-N-CA 120.222 -0.591 . . . . 0.0 110.009 174.535 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 38' ' ' ARG . . . . . 0.709 ' HB2' HG21 ' A' ' 26' ' ' THR . 40.7 ttp180 -105.65 104.97 14.8 Favored 'General case' 0 N--CA 1.496 1.826 0 O-C-N 121.758 -0.589 . . . . 0.0 110.126 174.137 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . 0.425 HD13 ' HA2' ' A' ' 23' ' ' GLY . 64.5 tp -83.59 156.53 22.7 Favored 'General case' 0 N--CA 1.499 1.982 0 O-C-N 121.64 -0.663 . . . . 0.0 110.616 -175.977 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -68.05 -3.03 8.88 Favored 'General case' 0 N--CA 1.502 2.166 0 O-C-N 121.898 -0.501 . . . . 0.0 112.208 -170.582 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 30.1 m120 -86.75 29.13 0.82 Allowed 'General case' 0 N--CA 1.499 1.986 0 O-C-N 121.104 -0.997 . . . . 0.0 110.782 173.734 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 73.1 m-20 60.76 31.54 20.1 Favored 'General case' 0 N--CA 1.506 2.332 0 O-C-N 121.213 -0.929 . . . . 0.0 110.278 175.728 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 67.0 m -125.76 138.62 53.86 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.447 -0.783 . . . . 0.0 109.981 177.33 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 9.1 t -128.21 147.26 50.57 Favored 'General case' 0 N--CA 1.496 1.85 0 O-C-N 121.652 -0.655 . . . . 0.0 109.988 179.511 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 7.6 tmtm? -150.63 135.93 17.84 Favored 'General case' 0 N--CA 1.495 1.794 0 O-C-N 121.666 -0.646 . . . . 0.0 110.439 -177.959 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 88.5 p -94.67 124.51 38.75 Favored 'General case' 0 N--CA 1.495 1.813 0 O-C-N 121.745 -0.597 . . . . 0.0 110.208 178.372 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 82.8 mt -129.32 133.92 64.69 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.894 0 O-C-N 121.687 -0.633 . . . . 0.0 109.356 179.238 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 48' ' ' VAL . . . . . 1.09 HG22 HD12 ' A' ' 34' ' ' ILE . 63.6 t -81.88 127.74 39.33 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.925 0 C-N-CA 119.999 -0.68 . . . . 0.0 109.182 179.214 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 49' ' ' THR . . . . . 0.405 ' HB ' HD12 ' A' ' 52' ' ' ILE . 80.8 p -57.37 -25.06 58.87 Favored 'General case' 0 N--CA 1.506 2.37 0 O-C-N 121.474 -0.766 . . . . 0.0 111.927 -168.197 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 16.0 ttpp -56.8 -26.36 57.7 Favored 'General case' 0 N--CA 1.501 2.116 0 O-C-N 121.464 -0.773 . . . . 0.0 111.022 -177.126 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 5.0 p30 -84.83 6.13 25.88 Favored 'General case' 0 N--CA 1.498 1.946 0 C-N-CA 119.729 -0.788 . . . . 0.0 111.389 176.709 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 52' ' ' ILE . . . . . 0.405 HD12 ' HB ' ' A' ' 49' ' ' THR . 97.7 mt -75.67 126.73 36.74 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.144 0 O-C-N 121.151 -0.968 . . . . 0.0 109.909 176.095 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 76.3 tttt -93.13 -29.17 15.9 Favored 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.802 -0.561 . . . . 0.0 109.929 170.727 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 5.0 m-20 -163.71 154.86 16.32 Favored 'General case' 0 N--CA 1.501 2.075 0 O-C-N 121.723 -0.611 . . . . 0.0 110.112 -177.836 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . 0.562 ' CD2' HG22 ' A' ' 13' ' ' VAL . 86.7 mt -132.99 148.22 52.27 Favored 'General case' 0 N--CA 1.497 1.886 0 O-C-N 121.667 -0.645 . . . . 0.0 110.507 -179.248 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 4.7 ptm180 -152.19 142.33 22.3 Favored 'General case' 0 N--CA 1.495 1.793 0 O-C-N 121.757 -0.589 . . . . 0.0 109.959 175.934 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 57' ' ' ILE . . . . . 0.479 ' HA ' HG12 ' A' ' 11' ' ' VAL . 69.9 mt -85.07 133.14 30.04 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.86 0 O-C-N 121.495 -0.753 . . . . 0.0 109.678 172.575 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . 0.577 HD11 ' HB2' ' A' ' 12' ' ' GLU . 40.6 mt . . . . . 0 N--CA 1.497 1.905 0 O-C-N 121.496 -0.752 . . . . 0.0 110.204 -177.975 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 257' ' ' SER . . . . . . . . . . . . . 36.8 m . . . . . 0 N--CA 1.503 2.195 0 CA-C-O 121.165 0.507 . . . . 0.0 110.659 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' B' B ' 258' ' ' SER . . . . . . . . . . . . . 59.8 p -69.85 -29.63 66.92 Favored 'General case' 0 N--CA 1.5 2.039 0 C-N-CA 120.268 -0.573 . . . . 0.0 110.468 -178.225 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 259' ' ' GLN . . . . . . . . . . . . . 98.8 mt-30 -64.0 -38.77 92.28 Favored 'General case' 0 N--CA 1.502 2.126 0 O-C-N 121.547 -0.721 . . . . 0.0 110.487 -179.698 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 260' ' ' LEU . . . . . 0.485 ' HA ' HD12 ' B' ' 263' ' ' LEU . 81.3 mt -67.77 -44.29 77.8 Favored 'General case' 0 N--CA 1.501 2.076 0 O-C-N 121.608 -0.682 . . . . 0.0 110.246 179.713 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 261' ' ' LEU . . . . . . . . . . . . . 22.8 tp -68.61 -35.94 78.0 Favored 'General case' 0 N--CA 1.497 1.899 0 O-C-N 121.652 -0.655 . . . . 0.0 109.799 176.778 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 262' ' ' SER . . . . . . . . . . . . . 23.0 t -62.3 -36.72 83.02 Favored 'General case' 0 N--CA 1.5 2.064 0 O-C-N 121.753 -0.592 . . . . 0.0 110.457 177.521 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 263' ' ' LEU . . . . . 0.485 HD12 ' HA ' ' B' ' 260' ' ' LEU . 23.2 mt . . . . . 0 N--CA 1.501 2.109 0 O-C-N 121.703 -0.623 . . . . 0.0 110.099 179.582 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 69.8 m . . . . . 0 N--CA 1.495 1.81 0 CA-C-O 120.928 0.394 . . . . 0.0 110.167 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 3' ' ' VAL . . . . . 0.449 HG12 ' CE1' ' A' ' 7' ' ' TYR . 65.7 t -66.45 -27.8 41.46 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.054 0 O-C-N 121.761 -0.587 . . . . 0.0 110.274 -179.368 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -55.3 -31.11 61.37 Favored 'General case' 0 N--CA 1.504 2.231 0 O-C-N 121.376 -0.828 . . . . 0.0 110.388 -179.033 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 9.7 m-20 -68.66 -31.13 70.04 Favored 'General case' 0 N--CA 1.499 1.985 0 O-C-N 121.821 -0.549 . . . . 0.0 110.222 174.647 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 96.4 m-85 -95.67 10.07 38.1 Favored 'General case' 0 N--CA 1.497 1.908 0 O-C-N 121.585 -0.697 . . . . 0.0 111.531 -178.955 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 7' ' ' TYR . . . . . 0.449 ' CE1' HG12 ' A' ' 3' ' ' VAL . 3.3 m-30 -67.24 139.05 57.33 Favored 'General case' 0 N--CA 1.502 2.17 0 O-C-N 121.196 -0.94 . . . . 0.0 109.961 174.783 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 82.84 -0.32 89.68 Favored Glycine 0 N--CA 1.497 2.762 0 N-CA-C 110.602 -0.999 . . . . 0.0 110.602 -175.541 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 29.0 t -76.57 137.66 39.68 Favored 'General case' 0 N--CA 1.498 1.935 0 O-C-N 121.154 -1.204 . . . . 0.0 110.509 -179.991 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 10' ' ' ASN . . . . . 0.667 ' CG ' HG22 ' A' ' 24' ' ' VAL . 2.4 m120 -84.14 115.59 22.48 Favored 'General case' 0 N--CA 1.498 1.97 0 O-C-N 121.684 -0.635 . . . . 0.0 109.418 174.143 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . 0.646 HG21 HD11 ' A' ' 25' ' ' ILE . 35.7 m -141.89 162.45 20.11 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.725 0 O-C-N 121.699 -0.626 . . . . 0.0 109.769 -178.443 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 12' ' ' GLU . . . . . 0.569 ' HB2' HD11 ' A' ' 58' ' ' LEU . 47.0 tt0 -109.48 129.11 55.58 Favored 'General case' 0 N--CA 1.492 1.675 0 C-N-CA 119.914 -0.714 . . . . 0.0 110.012 177.933 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 13' ' ' VAL . . . . . 0.56 HG22 ' CD2' ' A' ' 55' ' ' LEU . 61.7 t -106.66 126.53 62.5 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.655 0 O-C-N 121.614 -0.679 . . . . 0.0 109.838 -179.439 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . 0.413 HD13 ' HG2' ' A' ' 20' ' ' LYS . 28.5 tp -95.86 126.63 41.25 Favored 'General case' 0 N--CA 1.493 1.703 0 N-CA-C 109.155 -0.683 . . . . 0.0 109.155 175.14 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 86.8 mt -96.39 167.11 11.37 Favored 'General case' 0 N--CA 1.496 1.836 0 O-C-N 121.587 -0.696 . . . . 0.0 111.076 -172.822 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 24.3 p30 -58.54 -21.81 53.6 Favored 'General case' 0 N--CA 1.504 2.263 0 O-C-N 121.82 -0.55 . . . . 0.0 111.685 -176.96 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 41.8 p-10 -92.76 23.51 4.09 Favored 'General case' 0 N--CA 1.497 1.924 0 O-C-N 121.531 -0.731 . . . . 0.0 110.899 -176.191 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 74.3 m-20 58.73 27.57 16.13 Favored 'General case' 0 N--CA 1.505 2.307 0 O-C-N 121.472 -0.767 . . . . 0.0 110.606 176.06 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 50.6 m -106.37 144.57 32.87 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.527 -0.733 . . . . 0.0 109.485 172.741 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . 0.413 ' HG2' HD13 ' A' ' 14' ' ' LEU . 74.4 mttt -109.64 148.83 30.64 Favored 'General case' 0 N--CA 1.496 1.836 0 O-C-N 121.582 -0.699 . . . . 0.0 110.557 -176.305 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -153.05 153.56 33.1 Favored 'General case' 0 N--CA 1.496 1.869 0 O-C-N 121.717 -0.614 . . . . 0.0 110.248 176.123 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . 0.503 ' O ' HD13 ' A' ' 39' ' ' LEU . 31.1 ptt180 -144.0 143.25 31.12 Favored 'General case' 0 N--CA 1.498 1.951 0 O-C-N 121.663 -0.648 . . . . 0.0 110.533 178.265 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -171.78 171.45 44.11 Favored Glycine 0 N--CA 1.494 2.51 0 N-CA-C 108.878 -1.689 . . . . 0.0 108.878 -174.986 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . 0.667 HG22 ' CG ' ' A' ' 10' ' ' ASN . 39.5 t -94.54 118.37 40.42 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.916 0 O-C-N 121.468 -1.019 . . . . 0.0 109.382 -176.461 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 25' ' ' ILE . . . . . 0.646 HD11 HG21 ' A' ' 11' ' ' VAL . 76.5 mt -63.72 143.27 15.81 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.122 0 O-C-N 121.657 -0.652 . . . . 0.0 110.442 -172.064 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 26' ' ' THR . . . . . 0.623 HG21 ' HB2' ' A' ' 38' ' ' ARG . 7.0 p -121.2 -27.76 4.83 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.733 -0.604 . . . . 0.0 111.283 -179.664 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 7.3 t-20 -161.94 158.25 24.98 Favored 'General case' 0 N--CA 1.499 2.012 0 C-N-CA 119.004 -1.078 . . . . 0.0 111.594 -177.622 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 28' ' ' PHE . . . . . 0.512 ' CE1' HG21 ' A' ' 49' ' ' THR . 77.1 t80 -150.1 126.71 10.92 Favored 'General case' 0 N--CA 1.498 1.936 0 N-CA-C 109.235 -0.654 . . . . 0.0 109.235 170.17 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 17.8 t70 -100.31 130.98 46.49 Favored 'General case' 0 N--CA 1.491 1.594 0 N-CA-C 109.095 -0.705 . . . . 0.0 109.095 -177.711 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 19.5 m -68.55 -48.69 63.62 Favored 'General case' 0 N--CA 1.498 1.975 0 C-N-CA 120.031 -0.668 . . . . 0.0 110.629 -175.703 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 25.2 m -59.49 -44.16 93.15 Favored 'General case' 0 N--CA 1.503 2.206 0 O-C-N 121.57 -0.706 . . . . 0.0 110.859 -174.078 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 29.6 m120 -103.88 -8.84 19.4 Favored 'General case' 0 N--CA 1.497 1.882 0 O-C-N 121.622 -0.674 . . . . 0.0 111.52 -178.164 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 16.1 m 49.46 67.22 0.92 Allowed 'General case' 0 N--CA 1.507 2.387 0 O-C-N 121.141 -0.974 . . . . 0.0 110.928 -174.381 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 34' ' ' ILE . . . . . 1.076 HD12 HG22 ' A' ' 48' ' ' VAL . 45.8 mm -121.96 125.91 73.78 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.071 0 O-C-N 121.629 -0.669 . . . . 0.0 109.407 -175.679 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 7.3 tp -115.81 119.69 36.83 Favored 'General case' 0 N--CA 1.494 1.767 0 O-C-N 121.648 -0.658 . . . . 0.0 110.429 -168.847 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 98.9 mt-30 -90.98 134.25 34.63 Favored 'General case' 0 N--CA 1.49 1.544 0 C-N-CA 120.315 -0.554 . . . . 0.0 109.576 174.72 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . 0.421 HD23 ' HA ' ' A' ' 25' ' ' ILE . 15.8 mt -117.79 123.83 46.91 Favored 'General case' 0 N--CA 1.495 1.787 0 O-C-N 121.939 -0.476 . . . . 0.0 109.966 174.72 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 38' ' ' ARG . . . . . 0.623 ' HB2' HG21 ' A' ' 26' ' ' THR . 74.4 ttt-85 -97.27 106.2 18.48 Favored 'General case' 0 N--CA 1.497 1.897 0 O-C-N 121.741 -0.6 . . . . 0.0 109.779 175.746 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . 0.503 HD13 ' O ' ' A' ' 22' ' ' ARG . 18.8 tp -84.72 152.06 23.98 Favored 'General case' 0 N--CA 1.495 1.777 0 O-C-N 121.678 -0.639 . . . . 0.0 110.877 -174.227 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -68.14 -3.55 10.84 Favored 'General case' 0 N--CA 1.502 2.146 0 O-C-N 121.928 -0.482 . . . . 0.0 111.982 -172.455 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 23.2 m120 -87.05 27.56 1.01 Allowed 'General case' 0 N--CA 1.498 1.941 0 O-C-N 121.07 -1.019 . . . . 0.0 110.923 173.545 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 14.8 t0 63.11 29.31 16.2 Favored 'General case' 0 N--CA 1.505 2.279 0 O-C-N 121.042 -1.036 . . . . 0.0 110.523 176.088 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 50.7 m -125.08 137.8 54.19 Favored 'General case' 0 N--CA 1.495 1.81 0 O-C-N 121.313 -0.867 . . . . 0.0 110.568 -179.267 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 9.8 t -98.11 151.04 20.8 Favored 'General case' 0 N--CA 1.496 1.845 0 O-C-N 121.817 -0.552 . . . . 0.0 110.208 175.362 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 33.6 ttmt -150.2 119.17 6.68 Favored 'General case' 0 N--CA 1.495 1.817 0 O-C-N 121.525 -0.734 . . . . 0.0 110.362 178.577 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 89.7 p -96.2 123.81 39.96 Favored 'General case' 0 N--CA 1.495 1.797 0 O-C-N 121.675 -0.64 . . . . 0.0 110.249 179.079 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 82.5 mt -129.4 135.89 60.62 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.887 0 N-CA-C 109.309 -0.626 . . . . 0.0 109.309 179.203 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 48' ' ' VAL . . . . . 1.076 HG22 HD12 ' A' ' 34' ' ' ILE . 64.0 t -81.87 127.6 39.46 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.895 0 C-N-CA 120.032 -0.667 . . . . 0.0 109.265 179.358 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 49' ' ' THR . . . . . 0.512 HG21 ' CE1' ' A' ' 28' ' ' PHE . 39.0 p -59.17 -24.85 63.42 Favored 'General case' 0 N--CA 1.504 2.239 0 O-C-N 121.668 -0.645 . . . . 0.0 112.071 -169.744 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 63.4 tttt -56.46 -24.1 43.33 Favored 'General case' 0 N--CA 1.504 2.227 0 O-C-N 121.46 -0.775 . . . . 0.0 110.981 -176.824 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 46.5 p30 -83.91 2.52 38.22 Favored 'General case' 0 N--CA 1.499 1.987 0 O-C-N 121.468 -0.77 . . . . 0.0 111.281 176.598 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 98.8 mt -75.47 127.34 36.95 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.113 0 O-C-N 121.195 -0.941 . . . . 0.0 109.987 177.978 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 50.4 tttm -92.45 -29.79 16.07 Favored 'General case' 0 N--CA 1.494 1.739 0 O-C-N 121.871 -0.518 . . . . 0.0 109.652 170.506 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 54' ' ' ASP . . . . . 0.411 ' HA ' HD22 ' B' ' 261' ' ' LEU . 5.3 m-20 -163.95 156.89 17.94 Favored 'General case' 0 N--CA 1.499 2.022 0 O-C-N 121.795 -0.566 . . . . 0.0 110.053 -178.141 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . 0.56 ' CD2' HG22 ' A' ' 13' ' ' VAL . 84.3 mt -133.01 148.54 52.25 Favored 'General case' 0 N--CA 1.496 1.858 0 O-C-N 121.675 -0.641 . . . . 0.0 110.513 -179.376 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 6.5 ptm180 -151.94 143.04 23.2 Favored 'General case' 0 N--CA 1.495 1.812 0 O-C-N 121.673 -0.642 . . . . 0.0 110.046 176.006 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 57' ' ' ILE . . . . . 0.504 ' HA ' HG12 ' A' ' 11' ' ' VAL . 68.7 mt -85.33 133.2 29.98 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.843 0 O-C-N 121.443 -0.786 . . . . 0.0 109.718 173.218 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . 0.569 HD11 ' HB2' ' A' ' 12' ' ' GLU . 59.2 mt . . . . . 0 N--CA 1.497 1.915 0 O-C-N 121.583 -0.698 . . . . 0.0 110.164 -179.021 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 257' ' ' SER . . . . . . . . . . . . . 40.5 m . . . . . 0 N--CA 1.504 2.248 0 CA-C-O 121.24 0.543 . . . . 0.0 110.373 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' B' B ' 258' ' ' SER . . . . . . . . . . . . . 25.3 m -69.29 -33.23 72.87 Favored 'General case' 0 N--CA 1.499 1.983 0 C-N-CA 120.423 -0.511 . . . . 0.0 110.272 179.855 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 259' ' ' GLN . . . . . . . . . . . . . 78.2 mt-30 -63.79 -36.99 85.7 Favored 'General case' 0 N--CA 1.501 2.084 0 O-C-N 121.628 -0.67 . . . . 0.0 110.43 -179.433 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 260' ' ' LEU . . . . . 0.458 ' HA ' HD12 ' B' ' 263' ' ' LEU . 82.7 mt -66.59 -42.66 86.63 Favored 'General case' 0 N--CA 1.5 2.072 0 O-C-N 121.639 -0.663 . . . . 0.0 110.231 179.556 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 261' ' ' LEU . . . . . 0.411 HD22 ' HA ' ' A' ' 54' ' ' ASP . 22.5 tp -70.43 -37.49 74.39 Favored 'General case' 0 N--CA 1.498 1.928 0 O-C-N 121.719 -0.613 . . . . 0.0 109.749 176.511 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 262' ' ' SER . . . . . . . . . . . . . 22.8 t -62.53 -36.92 84.14 Favored 'General case' 0 N--CA 1.5 2.051 0 O-C-N 121.771 -0.581 . . . . 0.0 110.443 176.896 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 263' ' ' LEU . . . . . 0.458 HD12 ' HA ' ' B' ' 260' ' ' LEU . 24.1 mt . . . . . 0 N--CA 1.5 2.074 0 O-C-N 121.681 -0.637 . . . . 0.0 110.28 179.691 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 69.5 m . . . . . 0 N--CA 1.495 1.791 0 CA-C-O 121.016 0.436 . . . . 0.0 110.263 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 57.3 t -65.2 -27.99 43.48 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.164 0 O-C-N 121.702 -0.624 . . . . 0.0 110.194 179.192 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -55.19 -31.76 61.67 Favored 'General case' 0 N--CA 1.505 2.283 0 O-C-N 121.518 -0.739 . . . . 0.0 110.349 179.902 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 74.5 m-20 -68.64 -35.9 77.9 Favored 'General case' 0 N--CA 1.499 1.994 0 O-C-N 121.818 -0.551 . . . . 0.0 109.942 175.444 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 97.7 m-85 -97.67 10.0 41.12 Favored 'General case' 0 N--CA 1.497 1.892 0 O-C-N 121.708 -0.62 . . . . 0.0 111.217 178.877 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -67.41 128.63 37.15 Favored 'General case' 0 N--CA 1.501 2.082 0 O-C-N 121.257 -0.902 . . . . 0.0 110.061 179.048 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 8' ' ' GLY . . . . . 0.469 ' O ' HG13 ' A' ' 24' ' ' VAL . . . 82.24 -0.73 88.56 Favored Glycine 0 N--CA 1.497 2.716 0 N-CA-C 110.693 -0.963 . . . . 0.0 110.693 -175.794 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 30.4 t -76.61 136.67 39.21 Favored 'General case' 0 N--CA 1.497 1.883 0 O-C-N 120.989 -1.301 . . . . 0.0 110.4 177.794 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 14.3 t-20 -83.36 120.09 25.44 Favored 'General case' 0 N--CA 1.497 1.896 0 O-C-N 121.608 -0.683 . . . . 0.0 109.669 174.722 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . 0.529 HG12 ' HA ' ' A' ' 57' ' ' ILE . 35.0 m -142.83 164.52 16.66 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.733 0 O-C-N 121.794 -0.567 . . . . 0.0 109.505 -178.824 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 12' ' ' GLU . . . . . 0.44 ' HB2' HD11 ' A' ' 58' ' ' LEU . 36.8 tt0 -109.36 128.85 55.43 Favored 'General case' 0 N--CA 1.493 1.697 0 C-N-CA 119.87 -0.732 . . . . 0.0 109.894 176.412 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 60.4 t -106.83 126.6 62.76 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.741 0 O-C-N 121.659 -0.65 . . . . 0.0 109.857 -179.285 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . 0.405 HD13 ' HG2' ' A' ' 20' ' ' LYS . 24.1 tp -95.84 127.92 42.29 Favored 'General case' 0 N--CA 1.494 1.74 0 N-CA-C 109.263 -0.643 . . . . 0.0 109.263 175.483 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 83.6 mt -96.1 161.87 13.78 Favored 'General case' 0 N--CA 1.496 1.864 0 O-C-N 121.609 -0.682 . . . . 0.0 110.923 -173.466 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 24.2 p30 -57.81 -21.76 43.79 Favored 'General case' 0 N--CA 1.506 2.327 0 O-C-N 121.855 -0.528 . . . . 0.0 111.418 179.886 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 24.8 p30 -90.91 22.49 3.61 Favored 'General case' 0 N--CA 1.5 2.073 0 O-C-N 121.618 -0.676 . . . . 0.0 111.067 -177.717 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 74.3 m-20 60.26 29.01 18.65 Favored 'General case' 0 N--CA 1.506 2.346 0 O-C-N 121.356 -0.84 . . . . 0.0 110.807 172.561 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 23.8 m -110.79 143.8 40.76 Favored 'General case' 0 N--CA 1.495 1.798 0 O-C-N 121.472 -0.767 . . . . 0.0 109.551 170.838 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . 0.405 ' HG2' HD13 ' A' ' 14' ' ' LEU . 34.2 mtpt -109.67 144.89 37.4 Favored 'General case' 0 N--CA 1.494 1.743 0 O-C-N 121.574 -0.704 . . . . 0.0 110.467 -176.69 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -153.09 157.93 41.14 Favored 'General case' 0 N--CA 1.497 1.905 0 O-C-N 121.8 -0.562 . . . . 0.0 110.145 177.081 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 30.7 ptt180 -143.97 152.61 41.28 Favored 'General case' 0 N--CA 1.496 1.846 0 O-C-N 121.578 -0.701 . . . . 0.0 110.441 178.081 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . 0.435 ' HA2' HD13 ' A' ' 39' ' ' LEU . . . -171.81 171.26 44.01 Favored Glycine 0 N--CA 1.494 2.503 0 N-CA-C 109.128 -1.589 . . . . 0.0 109.128 -179.075 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . 0.469 HG13 ' O ' ' A' ' 8' ' ' GLY . 43.9 t -94.64 126.06 47.14 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.918 0 O-C-N 121.59 -0.947 . . . . 0.0 109.288 176.619 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 25' ' ' ILE . . . . . 0.493 ' HA ' HD23 ' A' ' 37' ' ' LEU . 50.9 mt -61.66 137.99 22.91 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.253 0 O-C-N 121.64 -0.663 . . . . 0.0 110.896 -170.805 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 26' ' ' THR . . . . . 0.666 HG21 ' HB2' ' A' ' 38' ' ' ARG . 13.7 p -121.19 -19.06 7.23 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.922 -0.486 . . . . 0.0 111.465 -179.82 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 9.9 t30 -166.15 158.8 14.65 Favored 'General case' 0 N--CA 1.503 2.222 0 O-C-N 120.917 -1.115 . . . . 0.0 111.751 176.046 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 65.0 t80 -150.32 124.96 9.69 Favored 'General case' 0 N--CA 1.495 1.818 0 N-CA-C 109.244 -0.651 . . . . 0.0 109.244 173.314 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 20.2 t70 -98.18 130.86 44.92 Favored 'General case' 0 N--CA 1.492 1.64 0 N-CA-C 109.004 -0.739 . . . . 0.0 109.004 -179.741 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 23.1 t -71.56 -53.76 12.71 Favored 'General case' 0 N--CA 1.498 1.956 0 C-N-CA 120.007 -0.677 . . . . 0.0 110.633 -175.845 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 22.9 m -61.93 -37.9 86.41 Favored 'General case' 0 N--CA 1.5 2.061 0 O-C-N 121.591 -0.693 . . . . 0.0 110.699 -175.819 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 91.5 m-20 -103.77 -9.85 18.74 Favored 'General case' 0 N--CA 1.498 1.942 0 O-C-N 121.746 -0.596 . . . . 0.0 111.66 -176.909 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 27.8 p 47.11 67.05 0.86 Allowed 'General case' 0 N--CA 1.508 2.434 0 O-C-N 121.408 -0.807 . . . . 0.0 111.202 -175.13 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 34' ' ' ILE . . . . . 1.055 HD12 HG22 ' A' ' 48' ' ' VAL . 46.8 mm -121.36 125.8 74.15 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.964 0 O-C-N 121.642 -0.661 . . . . 0.0 109.236 -176.433 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 11.0 tp -116.57 120.47 38.81 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.746 -0.596 . . . . 0.0 110.468 -170.3 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 57.6 mt-30 -91.02 131.94 36.31 Favored 'General case' 0 N--CA 1.49 1.551 0 N-CA-C 109.061 -0.718 . . . . 0.0 109.061 170.659 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . 0.493 HD23 ' HA ' ' A' ' 25' ' ' ILE . 50.6 mt -117.82 123.56 46.23 Favored 'General case' 0 N--CA 1.494 1.761 0 C-N-CA 120.121 -0.632 . . . . 0.0 110.007 175.723 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 38' ' ' ARG . . . . . 0.666 ' HB2' HG21 ' A' ' 26' ' ' THR . 70.3 ttt180 -105.63 105.08 14.95 Favored 'General case' 0 N--CA 1.495 1.788 0 O-C-N 121.821 -0.549 . . . . 0.0 110.144 173.928 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . 0.435 HD13 ' HA2' ' A' ' 23' ' ' GLY . 65.2 tp -83.19 157.36 22.76 Favored 'General case' 0 N--CA 1.499 1.979 0 O-C-N 121.623 -0.673 . . . . 0.0 110.518 -176.657 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -67.57 -2.97 7.5 Favored 'General case' 0 N--CA 1.503 2.179 0 O-C-N 121.857 -0.527 . . . . 0.0 112.156 -170.822 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 30.1 m120 -86.25 29.06 0.78 Allowed 'General case' 0 N--CA 1.499 1.983 0 O-C-N 120.987 -1.07 . . . . 0.0 110.822 173.503 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 73.9 m-20 60.39 31.47 20.37 Favored 'General case' 0 N--CA 1.505 2.277 0 O-C-N 121.225 -0.922 . . . . 0.0 110.326 175.468 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 69.9 m -125.91 140.77 52.36 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.483 -0.761 . . . . 0.0 110.05 177.736 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 9.8 t -128.27 147.79 50.61 Favored 'General case' 0 N--CA 1.495 1.809 0 O-C-N 121.681 -0.637 . . . . 0.0 110.018 179.785 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 81.3 tttt -150.19 135.18 17.77 Favored 'General case' 0 N--CA 1.495 1.797 0 O-C-N 121.709 -0.619 . . . . 0.0 110.545 -178.106 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 89.5 p -94.78 121.03 35.95 Favored 'General case' 0 N--CA 1.495 1.806 0 O-C-N 121.798 -0.563 . . . . 0.0 110.142 177.85 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 81.3 mt -129.25 137.29 57.4 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.868 0 O-C-N 121.671 -0.643 . . . . 0.0 109.325 -179.956 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 48' ' ' VAL . . . . . 1.055 HG22 HD12 ' A' ' 34' ' ' ILE . 60.5 t -81.53 127.78 39.28 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.846 0 O-C-N 121.566 -0.709 . . . . 0.0 109.219 179.117 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 49' ' ' THR . . . . . 0.405 ' HA ' ' CD1' ' A' ' 52' ' ' ILE . 44.3 p -58.33 -29.7 66.14 Favored 'General case' 0 N--CA 1.503 2.2 0 O-C-N 121.459 -0.776 . . . . 0.0 111.672 -170.504 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -58.56 -27.23 64.37 Favored 'General case' 0 N--CA 1.5 2.045 0 O-C-N 121.562 -0.711 . . . . 0.0 111.315 -173.261 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 4.6 p30 -82.41 0.86 40.1 Favored 'General case' 0 N--CA 1.497 1.884 0 C-N-CA 119.502 -0.879 . . . . 0.0 111.113 176.932 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 52' ' ' ILE . . . . . 0.564 HG21 HD11 ' A' ' 55' ' ' LEU . 76.1 mt -79.45 132.18 32.6 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.096 0 O-C-N 121.167 -0.958 . . . . 0.0 109.923 175.649 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 23.5 ttmt -92.42 -24.32 18.89 Favored 'General case' 0 N--CA 1.494 1.746 0 C-N-CA 120.427 -0.509 . . . . 0.0 110.22 173.278 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 54' ' ' ASP . . . . . 0.503 ' HA ' HD13 ' B' ' 261' ' ' LEU . 1.6 m-20 -164.08 152.43 13.06 Favored 'General case' 0 N--CA 1.501 2.125 0 O-C-N 121.502 -0.749 . . . . 0.0 110.489 -175.949 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . 0.564 HD11 HG21 ' A' ' 52' ' ' ILE . 4.7 mp -132.92 152.35 51.91 Favored 'General case' 0 N--CA 1.495 1.818 0 O-C-N 121.725 -0.609 . . . . 0.0 110.364 178.494 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 19.8 ptp180 -151.84 146.15 25.47 Favored 'General case' 0 N--CA 1.496 1.842 0 O-C-N 121.636 -0.665 . . . . 0.0 109.926 175.081 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 57' ' ' ILE . . . . . 0.529 ' HA ' HG12 ' A' ' 11' ' ' VAL . 57.5 mt -87.09 133.23 30.54 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.871 0 O-C-N 121.483 -0.761 . . . . 0.0 110.0 174.092 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . 0.44 HD11 ' HB2' ' A' ' 12' ' ' GLU . 78.1 mt . . . . . 0 N--CA 1.497 1.886 0 O-C-N 121.537 -0.727 . . . . 0.0 110.018 -179.785 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 257' ' ' SER . . . . . . . . . . . . . 33.7 m . . . . . 0 N--CA 1.502 2.17 0 CA-C-O 121.257 0.551 . . . . 0.0 110.487 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' B' B ' 258' ' ' SER . . . . . . . . . . . . . 22.6 t -69.67 -32.82 71.69 Favored 'General case' 0 N--CA 1.498 1.932 0 O-C-N 121.862 -0.524 . . . . 0.0 110.419 -179.401 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 259' ' ' GLN . . . . . . . . . . . . . 99.5 mt-30 -63.22 -37.96 89.29 Favored 'General case' 0 N--CA 1.501 2.082 0 O-C-N 121.57 -0.706 . . . . 0.0 110.634 -178.442 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 260' ' ' LEU . . . . . . . . . . . . . 84.1 mt -69.43 -41.72 75.94 Favored 'General case' 0 N--CA 1.499 1.981 0 O-C-N 121.535 -0.728 . . . . 0.0 110.296 179.915 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 261' ' ' LEU . . . . . 0.503 HD13 ' HA ' ' A' ' 54' ' ' ASP . 32.8 tp -70.26 -40.21 74.53 Favored 'General case' 0 N--CA 1.496 1.872 0 O-C-N 121.572 -0.705 . . . . 0.0 109.915 177.83 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 262' ' ' SER . . . . . . . . . . . . . 86.8 p -63.18 -35.9 81.85 Favored 'General case' 0 N--CA 1.5 2.06 0 O-C-N 121.675 -0.64 . . . . 0.0 110.484 177.374 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 263' ' ' LEU . . . . . . . . . . . . . 25.2 mt . . . . . 0 N--CA 1.499 2.005 0 O-C-N 121.631 -0.668 . . . . 0.0 110.456 179.214 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 74.3 m . . . . . 0 N--CA 1.494 1.768 0 CA-C-O 121.116 0.484 . . . . 0.0 110.533 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 56.7 t -64.67 -27.97 43.76 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.24 0 O-C-N 121.699 -0.626 . . . . 0.0 110.279 179.716 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -55.06 -30.96 60.72 Favored 'General case' 0 N--CA 1.504 2.235 0 O-C-N 121.452 -0.78 . . . . 0.0 110.393 -179.669 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 74.5 m-20 -68.73 -35.26 76.89 Favored 'General case' 0 N--CA 1.498 1.95 0 C-N-CA 120.413 -0.515 . . . . 0.0 109.968 174.658 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 6' ' ' PHE . . . . . 0.509 ' CE1' HD21 ' B' ' 260' ' ' LEU . 95.0 m-85 -98.05 9.86 41.81 Favored 'General case' 0 N--CA 1.498 1.931 0 O-C-N 121.782 -0.574 . . . . 0.0 111.263 179.072 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -67.48 128.48 36.6 Favored 'General case' 0 N--CA 1.5 2.071 0 O-C-N 121.198 -0.939 . . . . 0.0 110.046 179.533 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 8' ' ' GLY . . . . . 0.471 ' O ' HG13 ' A' ' 24' ' ' VAL . . . 81.98 -0.59 88.35 Favored Glycine 0 N--CA 1.495 2.623 0 N-CA-C 110.757 -0.937 . . . . 0.0 110.757 -175.594 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 49.1 m -76.3 137.34 39.82 Favored 'General case' 0 N--CA 1.497 1.904 0 O-C-N 120.958 -1.319 . . . . 0.0 110.469 178.042 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 14.0 t-20 -84.51 119.12 24.8 Favored 'General case' 0 N--CA 1.497 1.886 0 O-C-N 121.683 -0.636 . . . . 0.0 109.774 174.567 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . 0.503 HG12 ' HA ' ' A' ' 57' ' ' ILE . 35.8 m -142.12 162.46 19.53 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.808 0 O-C-N 121.847 -0.533 . . . . 0.0 109.636 -179.872 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 12' ' ' GLU . . . . . 0.454 ' HB2' HD11 ' A' ' 58' ' ' LEU . 48.4 tt0 -109.42 128.45 55.14 Favored 'General case' 0 N--CA 1.494 1.765 0 C-N-CA 119.914 -0.714 . . . . 0.0 110.01 178.05 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 13' ' ' VAL . . . . . 0.582 HG22 ' CD2' ' A' ' 55' ' ' LEU . 60.8 t -106.74 127.71 62.04 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.765 0 O-C-N 121.642 -0.661 . . . . 0.0 109.893 -178.882 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . 0.422 HD13 ' HG2' ' A' ' 20' ' ' LYS . 27.0 tp -95.83 125.87 40.7 Favored 'General case' 0 N--CA 1.493 1.7 0 N-CA-C 109.14 -0.689 . . . . 0.0 109.14 174.327 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 86.6 mt -95.08 167.33 11.45 Favored 'General case' 0 N--CA 1.496 1.828 0 O-C-N 121.6 -0.687 . . . . 0.0 111.102 -172.561 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 24.2 p30 -58.54 -21.9 53.91 Favored 'General case' 0 N--CA 1.507 2.4 0 O-C-N 121.933 -0.479 . . . . 0.0 111.575 -176.786 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 39.2 p-10 -93.06 23.76 4.12 Favored 'General case' 0 N--CA 1.498 1.936 0 O-C-N 121.6 -0.688 . . . . 0.0 110.878 -176.354 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 10.4 m-20 59.09 27.66 16.7 Favored 'General case' 0 N--CA 1.506 2.367 0 O-C-N 121.483 -0.76 . . . . 0.0 110.611 175.579 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 50.9 m -106.52 142.57 35.96 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.492 -0.755 . . . . 0.0 109.61 172.975 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . 0.422 ' HG2' HD13 ' A' ' 14' ' ' LEU . 95.0 mttt -109.66 143.68 39.07 Favored 'General case' 0 N--CA 1.494 1.748 0 O-C-N 121.594 -0.691 . . . . 0.0 110.731 -176.668 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -153.1 156.06 37.96 Favored 'General case' 0 N--CA 1.497 1.907 0 O-C-N 121.752 -0.593 . . . . 0.0 110.018 175.96 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . 0.436 ' NH1' HD11 ' A' ' 39' ' ' LEU . 40.5 ptt85 -142.64 153.51 43.51 Favored 'General case' 0 N--CA 1.496 1.862 0 O-C-N 121.515 -0.74 . . . . 0.0 110.482 178.545 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . 0.438 ' HA2' HD13 ' A' ' 39' ' ' LEU . . . -171.81 171.17 43.96 Favored Glycine 0 N--CA 1.494 2.517 0 N-CA-C 109.051 -1.62 . . . . 0.0 109.051 -178.965 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . 0.471 HG13 ' O ' ' A' ' 8' ' ' GLY . 44.6 t -94.65 127.12 46.88 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.898 0 O-C-N 121.604 -0.939 . . . . 0.0 109.305 176.943 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 25' ' ' ILE . . . . . 0.485 ' HA ' HD23 ' A' ' 37' ' ' LEU . 49.2 mt -61.5 138.31 22.32 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.227 0 O-C-N 121.632 -0.668 . . . . 0.0 110.864 -171.01 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 26' ' ' THR . . . . . 0.673 HG21 ' HB2' ' A' ' 38' ' ' ARG . 12.5 p -121.16 -20.53 6.73 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.875 -0.515 . . . . 0.0 111.485 -179.699 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 30.9 t30 -165.77 158.58 15.32 Favored 'General case' 0 N--CA 1.504 2.262 0 O-C-N 120.902 -1.124 . . . . 0.0 111.798 176.764 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 66.8 t80 -150.27 123.08 8.68 Favored 'General case' 0 N--CA 1.494 1.761 0 N-CA-C 109.177 -0.675 . . . . 0.0 109.177 173.217 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 17.9 t70 -98.05 130.16 44.87 Favored 'General case' 0 N--CA 1.493 1.689 0 N-CA-C 109.106 -0.702 . . . . 0.0 109.106 -177.849 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 23.2 t -69.63 -51.82 31.5 Favored 'General case' 0 N--CA 1.498 1.963 0 C-N-CA 119.981 -0.688 . . . . 0.0 110.648 -175.985 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 22.1 t -59.94 -41.58 92.13 Favored 'General case' 0 N--CA 1.501 2.099 0 O-C-N 121.624 -0.672 . . . . 0.0 110.938 -174.652 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 91.6 m-20 -104.17 -9.88 18.35 Favored 'General case' 0 N--CA 1.497 1.894 0 O-C-N 121.668 -0.645 . . . . 0.0 111.663 -177.453 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 3.7 m 50.13 67.35 0.93 Allowed 'General case' 0 N--CA 1.508 2.431 0 O-C-N 120.971 -1.08 . . . . 0.0 110.85 -174.43 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 34' ' ' ILE . . . . . 1.103 HD12 HG22 ' A' ' 48' ' ' VAL . 44.6 mm -120.67 125.8 74.5 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.024 0 O-C-N 121.598 -0.688 . . . . 0.0 109.332 -175.827 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 10.8 tp -115.9 119.47 36.05 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.691 -0.631 . . . . 0.0 110.548 -169.699 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 56.9 mt-30 -91.0 132.51 35.94 Favored 'General case' 0 N--CA 1.489 1.504 0 N-CA-C 109.304 -0.628 . . . . 0.0 109.304 171.441 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . 0.485 HD23 ' HA ' ' A' ' 25' ' ' ILE . 51.4 mt -117.79 123.54 46.21 Favored 'General case' 0 N--CA 1.495 1.789 0 C-N-CA 120.129 -0.628 . . . . 0.0 110.001 175.81 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 38' ' ' ARG . . . . . 0.673 ' HB2' HG21 ' A' ' 26' ' ' THR . 57.1 ttt85 -105.86 106.18 16.57 Favored 'General case' 0 N--CA 1.496 1.85 0 O-C-N 121.753 -0.592 . . . . 0.0 110.191 173.885 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . 0.438 HD13 ' HA2' ' A' ' 23' ' ' GLY . 65.4 tp -83.78 156.76 22.36 Favored 'General case' 0 N--CA 1.499 1.978 0 O-C-N 121.678 -0.639 . . . . 0.0 110.587 -177.138 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -68.19 -3.02 9.23 Favored 'General case' 0 N--CA 1.504 2.226 0 O-C-N 121.903 -0.498 . . . . 0.0 112.178 -170.804 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 91.7 m-20 -86.96 29.1 0.84 Allowed 'General case' 0 N--CA 1.498 1.963 0 O-C-N 121.04 -1.038 . . . . 0.0 110.682 173.84 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 73.1 m-20 60.74 31.67 20.14 Favored 'General case' 0 N--CA 1.505 2.316 0 O-C-N 121.242 -0.911 . . . . 0.0 110.271 175.82 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 73.5 m -125.78 138.33 53.84 Favored 'General case' 0 N--CA 1.494 1.739 0 O-C-N 121.457 -0.777 . . . . 0.0 110.006 177.212 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 9.3 t -128.18 148.88 50.63 Favored 'General case' 0 N--CA 1.497 1.881 0 O-C-N 121.659 -0.651 . . . . 0.0 110.042 179.955 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . 0.445 ' HD3' HD11 ' A' ' 47' ' ' ILE . 79.2 tttt -150.37 136.09 18.28 Favored 'General case' 0 N--CA 1.495 1.822 0 O-C-N 121.718 -0.614 . . . . 0.0 110.584 -178.32 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 89.8 p -94.39 121.49 35.98 Favored 'General case' 0 N--CA 1.494 1.769 0 O-C-N 121.718 -0.614 . . . . 0.0 110.073 176.935 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 47' ' ' ILE . . . . . 0.445 HD11 ' HD3' ' A' ' 45' ' ' LYS . 79.7 mt -129.2 135.09 62.71 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.837 0 O-C-N 121.602 -0.686 . . . . 0.0 109.44 -179.424 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 48' ' ' VAL . . . . . 1.103 HG22 HD12 ' A' ' 34' ' ' ILE . 62.1 t -82.31 127.63 39.46 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.929 0 N-CA-C 109.265 -0.643 . . . . 0.0 109.265 179.032 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 57.7 p -58.36 -25.0 61.51 Favored 'General case' 0 N--CA 1.507 2.382 0 O-C-N 121.533 -0.729 . . . . 0.0 111.814 -169.148 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 49.0 tptt -56.87 -26.1 57.98 Favored 'General case' 0 N--CA 1.5 2.061 0 O-C-N 121.414 -0.804 . . . . 0.0 111.069 -177.049 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 5.3 p30 -84.64 5.88 26.27 Favored 'General case' 0 N--CA 1.499 2.009 0 C-N-CA 119.676 -0.809 . . . . 0.0 111.33 176.501 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 98.7 mt -75.32 126.46 36.11 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.107 0 O-C-N 121.184 -0.948 . . . . 0.0 109.988 175.726 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 77.0 tttt -92.91 -29.35 15.96 Favored 'General case' 0 N--CA 1.494 1.768 0 O-C-N 121.803 -0.561 . . . . 0.0 109.887 170.708 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 54' ' ' ASP . . . . . 0.408 ' HA ' HD22 ' B' ' 261' ' ' LEU . 5.4 m-20 -163.63 154.6 16.24 Favored 'General case' 0 N--CA 1.5 2.075 0 O-C-N 121.76 -0.587 . . . . 0.0 110.168 -177.926 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . 0.582 ' CD2' HG22 ' A' ' 13' ' ' VAL . 83.9 mt -132.98 150.5 52.16 Favored 'General case' 0 N--CA 1.497 1.899 0 O-C-N 121.71 -0.619 . . . . 0.0 110.424 -179.163 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 4.5 ptm180 -152.66 141.91 21.48 Favored 'General case' 0 N--CA 1.495 1.791 0 O-C-N 121.757 -0.589 . . . . 0.0 109.869 174.83 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 57' ' ' ILE . . . . . 0.503 ' HA ' HG12 ' A' ' 11' ' ' VAL . 69.4 mt -85.19 133.34 29.61 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.883 0 O-C-N 121.453 -0.779 . . . . 0.0 109.864 174.472 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . 0.454 HD11 ' HB2' ' A' ' 12' ' ' GLU . 63.9 mt . . . . . 0 N--CA 1.497 1.923 0 O-C-N 121.591 -0.693 . . . . 0.0 110.113 -179.031 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 257' ' ' SER . . . . . . . . . . . . . 69.2 m . . . . . 0 N--CA 1.503 2.186 0 CA-C-O 121.321 0.581 . . . . 0.0 110.48 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' B' B ' 258' ' ' SER . . . . . . . . . . . . . 27.6 m -68.27 -31.43 70.88 Favored 'General case' 0 N--CA 1.499 2.009 0 C-N-CA 120.438 -0.505 . . . . 0.0 110.296 179.186 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 259' ' ' GLN . . . . . . . . . . . . . 58.4 tp60 -63.59 -37.31 86.85 Favored 'General case' 0 N--CA 1.501 2.075 0 O-C-N 121.638 -0.664 . . . . 0.0 110.64 -179.472 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 260' ' ' LEU . . . . . 0.509 HD21 ' CE1' ' A' ' 6' ' ' PHE . 83.2 mt -70.89 -43.86 67.48 Favored 'General case' 0 N--CA 1.499 1.983 0 O-C-N 121.524 -0.735 . . . . 0.0 110.214 179.946 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 261' ' ' LEU . . . . . 0.408 HD22 ' HA ' ' A' ' 54' ' ' ASP . 24.2 tp -69.1 -39.04 79.24 Favored 'General case' 0 N--CA 1.498 1.963 0 O-C-N 121.737 -0.602 . . . . 0.0 109.844 178.023 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 262' ' ' SER . . . . . . . . . . . . . 84.9 p -62.99 -34.78 78.28 Favored 'General case' 0 N--CA 1.499 2.019 0 O-C-N 121.687 -0.633 . . . . 0.0 110.611 177.539 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 263' ' ' LEU . . . . . . . . . . . . . 23.5 mt . . . . . 0 N--CA 1.501 2.105 0 O-C-N 121.58 -0.7 . . . . 0.0 110.357 179.409 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 69.8 m . . . . . 0 N--CA 1.493 1.705 0 CA-C-O 120.978 0.418 . . . . 0.0 110.021 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 3' ' ' VAL . . . . . 0.43 HG12 ' CE1' ' A' ' 7' ' ' TYR . 79.8 t -66.67 -27.81 41.23 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.036 0 O-C-N 121.58 -0.7 . . . . 0.0 110.263 -179.684 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -55.15 -30.83 60.61 Favored 'General case' 0 N--CA 1.505 2.315 0 O-C-N 121.461 -0.774 . . . . 0.0 110.389 -178.925 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 74.6 m-20 -68.76 -30.52 69.14 Favored 'General case' 0 N--CA 1.499 2.025 0 O-C-N 121.813 -0.555 . . . . 0.0 110.223 174.821 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 96.2 m-85 -95.4 10.07 37.69 Favored 'General case' 0 N--CA 1.498 1.953 0 O-C-N 121.645 -0.659 . . . . 0.0 111.512 -178.367 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 7' ' ' TYR . . . . . 0.43 ' CE1' HG12 ' A' ' 3' ' ' VAL . 3.7 m-30 -67.18 137.82 56.53 Favored 'General case' 0 N--CA 1.502 2.16 0 O-C-N 121.131 -0.98 . . . . 0.0 110.106 173.979 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 8' ' ' GLY . . . . . 0.433 ' O ' HG13 ' A' ' 24' ' ' VAL . . . 83.07 -1.08 89.3 Favored Glycine 0 N--CA 1.496 2.694 0 N-CA-C 110.718 -0.953 . . . . 0.0 110.718 -177.352 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 68.9 m -77.2 136.82 38.58 Favored 'General case' 0 N--CA 1.499 1.979 0 O-C-N 121.031 -1.276 . . . . 0.0 110.417 177.747 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 16.1 t-20 -84.16 117.11 23.27 Favored 'General case' 0 N--CA 1.498 1.944 0 O-C-N 121.633 -0.667 . . . . 0.0 109.628 173.4 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . 0.522 HG12 ' HA ' ' A' ' 57' ' ' ILE . 35.7 m -142.71 162.7 17.99 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.705 0 N-CA-C 109.387 -0.597 . . . . 0.0 109.387 -178.206 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 12' ' ' GLU . . . . . 0.464 ' HB2' HD11 ' A' ' 58' ' ' LEU . 45.3 tt0 -109.34 130.3 55.5 Favored 'General case' 0 N--CA 1.492 1.661 0 C-N-CA 119.838 -0.745 . . . . 0.0 109.863 176.918 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 60.0 t -106.69 126.67 62.54 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.679 0 O-C-N 121.623 -0.673 . . . . 0.0 109.841 -179.597 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 27.1 tp -95.93 130.22 42.96 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.697 -0.627 . . . . 0.0 109.358 176.512 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 86.3 mt -97.38 160.12 14.51 Favored 'General case' 0 N--CA 1.496 1.875 0 O-C-N 121.59 -0.694 . . . . 0.0 111.067 -174.25 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 24.4 p30 -58.24 -21.87 49.95 Favored 'General case' 0 N--CA 1.506 2.345 0 O-C-N 121.756 -0.59 . . . . 0.0 111.503 -178.477 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 38.3 p-10 -93.14 23.93 4.07 Favored 'General case' 0 N--CA 1.498 1.927 0 O-C-N 121.5 -0.75 . . . . 0.0 110.778 -177.154 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 74.3 m-20 59.42 28.08 17.35 Favored 'General case' 0 N--CA 1.505 2.322 0 O-C-N 121.493 -0.754 . . . . 0.0 110.644 175.8 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 51.0 m -104.04 141.43 36.22 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.57 -0.706 . . . . 0.0 109.516 171.964 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 52.8 mttp -109.69 143.43 39.47 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.593 -0.692 . . . . 0.0 110.553 -176.013 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -153.1 154.6 35.16 Favored 'General case' 0 N--CA 1.497 1.889 0 O-C-N 121.722 -0.612 . . . . 0.0 110.3 176.477 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 31.0 ptt180 -144.07 154.98 43.78 Favored 'General case' 0 N--CA 1.498 1.947 0 O-C-N 121.705 -0.622 . . . . 0.0 110.463 177.573 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . 0.469 ' HA2' HD13 ' A' ' 39' ' ' LEU . . . -171.93 171.18 44.0 Favored Glycine 0 N--CA 1.494 2.522 0 N-CA-C 109.237 -1.545 . . . . 0.0 109.237 -178.967 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . 0.433 HG13 ' O ' ' A' ' 8' ' ' GLY . 41.0 t -94.5 119.51 42.58 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.926 0 O-C-N 121.596 -0.944 . . . . 0.0 109.02 174.252 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 25' ' ' ILE . . . . . 0.409 HD11 HG21 ' A' ' 11' ' ' VAL . 76.0 mt -63.52 143.75 15.31 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.23 0 CA-C-O 121.304 0.573 . . . . 0.0 110.66 -167.749 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 26' ' ' THR . . . . . 0.711 HG21 ' HG3' ' A' ' 38' ' ' ARG . 2.3 p -121.15 -25.87 5.21 Favored 'General case' 0 N--CA 1.494 1.768 0 O-C-N 121.831 -0.543 . . . . 0.0 111.379 179.934 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 27' ' ' ASN . . . . . 0.555 ' O ' HD12 ' A' ' 35' ' ' LEU . 7.3 t30 -163.94 160.0 21.5 Favored 'General case' 0 N--CA 1.501 2.091 0 O-C-N 120.952 -1.092 . . . . 0.0 111.774 -179.844 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 28' ' ' PHE . . . . . 0.569 ' HE1' HG21 ' A' ' 49' ' ' THR . 91.5 t80 -150.1 128.78 12.37 Favored 'General case' 0 N--CA 1.5 2.028 0 N-CA-C 109.223 -0.658 . . . . 0.0 109.223 170.279 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 20.2 t0 -98.86 130.84 45.29 Favored 'General case' 0 N--CA 1.49 1.559 0 N-CA-C 108.941 -0.763 . . . . 0.0 108.941 179.994 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 88.6 p -70.84 -51.48 26.31 Favored 'General case' 0 N--CA 1.497 1.922 0 C-N-CA 119.98 -0.688 . . . . 0.0 110.686 -175.175 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 6.3 t -61.25 -40.47 94.18 Favored 'General case' 0 N--CA 1.501 2.124 0 O-C-N 121.517 -0.74 . . . . 0.0 110.718 -175.737 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 28.8 m120 -103.27 -9.07 19.83 Favored 'General case' 0 N--CA 1.498 1.941 0 O-C-N 121.738 -0.601 . . . . 0.0 111.615 -176.877 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 28.6 p 46.79 67.13 0.83 Allowed 'General case' 0 N--CA 1.509 2.477 0 O-C-N 121.385 -0.822 . . . . 0.0 111.266 -175.009 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 34' ' ' ILE . . . . . 1.07 HD12 HG22 ' A' ' 48' ' ' VAL . 46.0 mm -122.53 125.83 73.2 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.059 0 N-CA-C 109.138 -0.69 . . . . 0.0 109.138 -176.881 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.555 HD12 ' O ' ' A' ' 27' ' ' ASN . 12.5 tp -115.98 122.25 44.69 Favored 'General case' 0 N--CA 1.495 1.776 0 O-C-N 121.677 -0.639 . . . . 0.0 110.7 -169.888 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 77.9 mt-30 -90.93 142.1 28.13 Favored 'General case' 0 N--CA 1.489 1.524 0 N-CA-C 109.358 -0.608 . . . . 0.0 109.358 171.097 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 6.4 mt -133.53 123.57 25.41 Favored 'General case' 0 N--CA 1.495 1.803 0 O-C-N 121.76 -0.588 . . . . 0.0 109.783 178.846 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 38' ' ' ARG . . . . . 0.711 ' HG3' HG21 ' A' ' 26' ' ' THR . 23.2 mtm180 -102.25 104.83 15.41 Favored 'General case' 0 N--CA 1.496 1.863 0 O-C-N 121.738 -0.601 . . . . 0.0 110.38 173.392 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . 0.469 HD13 ' HA2' ' A' ' 23' ' ' GLY . 62.8 tp -84.19 157.33 21.68 Favored 'General case' 0 N--CA 1.497 1.901 0 O-C-N 121.509 -0.744 . . . . 0.0 110.49 -177.946 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -66.43 -2.91 5.09 Favored 'General case' 0 N--CA 1.504 2.227 0 O-C-N 121.911 -0.493 . . . . 0.0 112.126 -171.154 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 91.4 m-20 -84.87 28.98 0.65 Allowed 'General case' 0 N--CA 1.499 1.993 0 O-C-N 121.112 -0.993 . . . . 0.0 110.856 172.267 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 74.4 m-20 59.43 31.17 20.87 Favored 'General case' 0 N--CA 1.504 2.272 0 O-C-N 121.108 -0.995 . . . . 0.0 110.433 174.148 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 50.8 m -126.26 137.76 53.55 Favored 'General case' 0 N--CA 1.496 1.847 0 O-C-N 121.498 -0.751 . . . . 0.0 110.517 178.99 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 10.0 t -102.36 151.11 22.65 Favored 'General case' 0 N--CA 1.497 1.882 0 O-C-N 121.864 -0.523 . . . . 0.0 110.105 174.629 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 69.5 mttt -149.04 123.79 9.87 Favored 'General case' 0 N--CA 1.496 1.87 0 O-C-N 121.574 -0.704 . . . . 0.0 110.741 178.939 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 92.6 p -97.45 118.52 34.11 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.792 -0.568 . . . . 0.0 110.122 177.551 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 82.6 mt -129.34 140.1 50.03 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.842 0 O-C-N 121.675 -0.641 . . . . 0.0 109.369 179.665 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 48' ' ' VAL . . . . . 1.07 HG22 HD12 ' A' ' 34' ' ' ILE . 58.1 t -81.85 127.65 39.42 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.863 0 C-N-CA 119.981 -0.688 . . . . 0.0 109.164 178.694 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 49' ' ' THR . . . . . 0.569 HG21 ' HE1' ' A' ' 28' ' ' PHE . 38.7 p -60.42 -27.18 67.27 Favored 'General case' 0 N--CA 1.502 2.128 0 O-C-N 121.62 -0.675 . . . . 0.0 111.926 -171.005 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 50.3 mmtt -58.58 -25.03 62.13 Favored 'General case' 0 N--CA 1.501 2.122 0 O-C-N 121.531 -0.731 . . . . 0.0 111.363 -173.776 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 6.4 p30 -82.44 -1.16 49.3 Favored 'General case' 0 N--CA 1.498 1.967 0 C-N-CA 119.635 -0.826 . . . . 0.0 111.084 176.41 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 52' ' ' ILE . . . . . 0.624 HG21 HD11 ' A' ' 55' ' ' LEU . 75.3 mt -79.66 133.92 28.74 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.102 0 O-C-N 121.185 -0.947 . . . . 0.0 110.131 177.317 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 47.2 tptt -92.38 -27.51 17.48 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.854 -0.529 . . . . 0.0 109.928 171.412 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 54' ' ' ASP . . . . . 0.489 ' HA ' HD13 ' B' ' 261' ' ' LEU . 1.5 m-20 -164.34 155.5 15.53 Favored 'General case' 0 N--CA 1.502 2.17 0 O-C-N 121.684 -0.635 . . . . 0.0 110.47 -176.211 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . 0.624 HD11 HG21 ' A' ' 52' ' ' ILE . 4.7 mp -132.91 155.36 49.2 Favored 'General case' 0 N--CA 1.497 1.88 0 O-C-N 121.877 -0.514 . . . . 0.0 110.175 178.191 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 19.6 ptp180 -151.6 148.93 28.57 Favored 'General case' 0 N--CA 1.497 1.891 0 O-C-N 121.693 -0.629 . . . . 0.0 109.976 175.801 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 57' ' ' ILE . . . . . 0.522 ' HA ' HG12 ' A' ' 11' ' ' VAL . 67.5 mt -86.01 133.33 29.91 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.871 0 C-N-CA 119.944 -0.702 . . . . 0.0 109.868 172.808 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . 0.464 HD11 ' HB2' ' A' ' 12' ' ' GLU . 72.7 mt . . . . . 0 N--CA 1.498 1.928 0 O-C-N 121.613 -0.68 . . . . 0.0 110.045 -178.299 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 257' ' ' SER . . . . . . . . . . . . . 22.0 m . . . . . 0 N--CA 1.503 2.185 0 CA-C-O 121.207 0.527 . . . . 0.0 110.361 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' B' B ' 258' ' ' SER . . . . . . . . . . . . . 23.8 m -69.33 -34.28 74.41 Favored 'General case' 0 N--CA 1.498 1.95 0 C-N-CA 120.402 -0.519 . . . . 0.0 110.176 179.303 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 259' ' ' GLN . . . . . . . . . . . . . 78.2 mt-30 -64.66 -34.47 78.36 Favored 'General case' 0 N--CA 1.5 2.058 0 O-C-N 121.606 -0.684 . . . . 0.0 110.407 -179.931 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 260' ' ' LEU . . . . . 0.492 ' HA ' HD12 ' B' ' 263' ' ' LEU . 77.9 mt -66.57 -41.57 88.39 Favored 'General case' 0 N--CA 1.5 2.028 0 O-C-N 121.716 -0.615 . . . . 0.0 110.223 179.371 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 261' ' ' LEU . . . . . 0.571 HD13 HD12 ' A' ' 55' ' ' LEU . 33.5 tp -70.03 -35.67 74.49 Favored 'General case' 0 N--CA 1.498 1.973 0 C-N-CA 120.132 -0.627 . . . . 0.0 109.798 176.997 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 262' ' ' SER . . . . . . . . . . . . . 23.2 m -62.47 -37.68 86.89 Favored 'General case' 0 N--CA 1.5 2.067 0 O-C-N 121.683 -0.636 . . . . 0.0 110.468 177.241 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 263' ' ' LEU . . . . . 0.492 HD12 ' HA ' ' B' ' 260' ' ' LEU . 21.6 mt . . . . . 0 N--CA 1.5 2.067 0 O-C-N 121.718 -0.613 . . . . 0.0 110.292 179.195 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 63.5 m . . . . . 0 N--CA 1.495 1.79 0 CA-C-O 121.02 0.438 . . . . 0.0 110.076 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 3' ' ' VAL . . . . . 0.429 HG12 ' CE1' ' A' ' 7' ' ' TYR . 74.6 t -66.77 -27.71 40.79 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.014 0 O-C-N 121.65 -0.656 . . . . 0.0 110.099 179.798 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -55.12 -30.94 60.79 Favored 'General case' 0 N--CA 1.504 2.228 0 O-C-N 121.434 -0.791 . . . . 0.0 110.369 -179.854 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -68.76 -30.88 69.57 Favored 'General case' 0 N--CA 1.499 1.991 0 O-C-N 121.783 -0.573 . . . . 0.0 110.24 174.676 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 91.1 m-85 -95.81 10.11 38.21 Favored 'General case' 0 N--CA 1.497 1.895 0 O-C-N 121.584 -0.697 . . . . 0.0 111.637 -178.0 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 7' ' ' TYR . . . . . 0.429 ' CE1' HG12 ' A' ' 3' ' ' VAL . 3.1 m-30 -67.35 133.36 49.48 Favored 'General case' 0 N--CA 1.502 2.174 0 O-C-N 121.088 -1.007 . . . . 0.0 110.043 173.801 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 82.38 1.88 90.51 Favored Glycine 0 N--CA 1.496 2.644 0 N-CA-C 110.625 -0.99 . . . . 0.0 110.625 -176.854 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 52.8 m -77.42 137.13 38.52 Favored 'General case' 0 N--CA 1.498 1.955 0 O-C-N 121.111 -1.229 . . . . 0.0 110.476 176.365 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 10' ' ' ASN . . . . . 0.754 ' CG ' HG22 ' A' ' 24' ' ' VAL . 2.6 m-20 -85.24 121.85 28.57 Favored 'General case' 0 N--CA 1.499 1.981 0 O-C-N 121.606 -0.684 . . . . 0.0 109.506 173.739 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . 0.483 HG12 ' HA ' ' A' ' 57' ' ' ILE . 30.9 m -144.0 161.08 15.77 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.774 0 C-N-CA 120.151 -0.62 . . . . 0.0 109.885 -179.403 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 12' ' ' GLU . . . . . 0.417 ' HB2' HD11 ' A' ' 58' ' ' LEU . 48.1 tt0 -109.33 147.23 33.03 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.737 -0.602 . . . . 0.0 109.6 177.124 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 13' ' ' VAL . . . . . 0.697 HG22 ' CD2' ' A' ' 55' ' ' LEU . 60.1 t -135.74 126.96 44.37 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.825 0 O-C-N 121.559 -0.713 . . . . 0.0 109.924 -173.758 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . 0.447 HD13 ' HG2' ' A' ' 20' ' ' LYS . 26.3 tp -95.91 125.6 40.58 Favored 'General case' 0 N--CA 1.492 1.665 0 N-CA-C 109.192 -0.67 . . . . 0.0 109.192 173.955 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 87.5 mt -93.12 170.51 9.59 Favored 'General case' 0 N--CA 1.497 1.889 0 O-C-N 121.67 -0.644 . . . . 0.0 110.951 -174.372 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 24.7 p30 -57.19 -21.55 34.15 Favored 'General case' 0 N--CA 1.505 2.309 0 O-C-N 121.738 -0.601 . . . . 0.0 111.575 -178.213 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 53.1 p-10 -91.6 22.04 4.31 Favored 'General case' 0 N--CA 1.499 1.975 0 O-C-N 121.571 -0.706 . . . . 0.0 110.933 -177.989 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 74.4 m-20 58.9 27.92 16.85 Favored 'General case' 0 N--CA 1.506 2.331 0 O-C-N 121.433 -0.792 . . . . 0.0 110.714 175.399 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 50.7 m -108.98 145.84 34.85 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.494 -0.754 . . . . 0.0 109.674 173.128 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . 0.447 ' HG2' HD13 ' A' ' 14' ' ' LEU . 80.3 mttt -109.68 140.03 44.02 Favored 'General case' 0 N--CA 1.495 1.777 0 O-C-N 121.57 -0.706 . . . . 0.0 110.481 -177.342 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -153.14 137.83 16.95 Favored 'General case' 0 N--CA 1.497 1.878 0 O-C-N 121.785 -0.572 . . . . 0.0 110.178 177.008 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 9.7 ptp180 -124.37 158.59 32.32 Favored 'General case' 0 N--CA 1.497 1.899 0 O-C-N 121.575 -0.703 . . . . 0.0 110.197 -179.219 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . 0.526 ' HA2' HD13 ' A' ' 39' ' ' LEU . . . -171.82 171.24 44.01 Favored Glycine 0 N--CA 1.493 2.447 0 N-CA-C 109.087 -1.605 . . . . 0.0 109.087 -178.337 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . 0.754 HG22 ' CG ' ' A' ' 10' ' ' ASN . 20.0 t -94.69 122.15 45.9 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.878 0 O-C-N 121.626 -0.926 . . . . 0.0 109.162 175.803 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 25' ' ' ILE . . . . . 0.432 ' HA ' HD23 ' A' ' 37' ' ' LEU . 87.9 mt -63.05 141.39 18.18 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.272 0 O-C-N 121.508 -0.745 . . . . 0.0 110.351 -171.988 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 26' ' ' THR . . . . . 0.606 HG21 ' HB2' ' A' ' 38' ' ' ARG . 13.7 p -121.11 -26.04 5.19 Favored 'General case' 0 N--CA 1.495 1.785 0 O-C-N 121.728 -0.607 . . . . 0.0 111.304 -179.906 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 26.9 t30 -162.87 160.24 24.78 Favored 'General case' 0 N--CA 1.5 2.062 0 O-C-N 120.965 -1.084 . . . . 0.0 111.789 179.936 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 28' ' ' PHE . . . . . 0.486 ' HE1' HG21 ' A' ' 49' ' ' THR . 87.8 t80 -150.09 127.1 11.18 Favored 'General case' 0 N--CA 1.498 1.96 0 N-CA-C 109.468 -0.568 . . . . 0.0 109.468 169.804 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 21.7 t70 -97.89 127.73 44.03 Favored 'General case' 0 N--CA 1.493 1.681 0 N-CA-C 109.111 -0.7 . . . . 0.0 109.111 -178.675 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 88.3 p -65.82 -44.62 85.03 Favored 'General case' 0 N--CA 1.499 1.985 0 O-C-N 121.607 -0.683 . . . . 0.0 110.755 -174.745 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 22.4 t -58.86 -48.1 82.57 Favored 'General case' 0 N--CA 1.502 2.158 0 O-C-N 121.446 -0.784 . . . . 0.0 111.002 -173.372 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 91.4 m-20 -107.03 -2.66 20.87 Favored 'General case' 0 N--CA 1.498 1.963 0 O-C-N 121.616 -0.678 . . . . 0.0 111.62 -178.932 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 3.4 m 49.2 67.24 0.91 Allowed 'General case' 0 N--CA 1.507 2.416 0 O-C-N 121.058 -1.026 . . . . 0.0 110.903 -174.027 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 34' ' ' ILE . . . . . 1.064 HD12 HG22 ' A' ' 48' ' ' VAL . 44.8 mm -116.22 125.83 73.45 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.025 0 O-C-N 121.512 -0.743 . . . . 0.0 109.162 -175.656 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 8.1 tp -115.83 121.53 42.69 Favored 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.636 -0.665 . . . . 0.0 110.569 -167.805 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 98.5 mt-30 -91.0 133.16 35.52 Favored 'General case' 0 N--CA 1.489 1.515 0 N-CA-C 109.351 -0.611 . . . . 0.0 109.351 172.392 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . 0.432 HD23 ' HA ' ' A' ' 25' ' ' ILE . 19.2 mt -117.84 123.58 46.25 Favored 'General case' 0 N--CA 1.495 1.793 0 C-N-CA 120.294 -0.562 . . . . 0.0 110.086 175.579 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 38' ' ' ARG . . . . . 0.606 ' HB2' HG21 ' A' ' 26' ' ' THR . 56.3 ttt85 -103.86 104.93 14.99 Favored 'General case' 0 N--CA 1.496 1.843 0 O-C-N 121.803 -0.561 . . . . 0.0 110.125 173.632 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . 0.526 HD13 ' HA2' ' A' ' 23' ' ' GLY . 61.1 tp -84.38 155.66 22.2 Favored 'General case' 0 N--CA 1.498 1.938 0 O-C-N 121.577 -0.702 . . . . 0.0 110.639 -176.647 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -68.3 -2.93 9.32 Favored 'General case' 0 N--CA 1.502 2.141 0 O-C-N 121.865 -0.522 . . . . 0.0 112.213 -170.548 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 7.0 m120 -86.7 28.16 0.91 Allowed 'General case' 0 N--CA 1.497 1.925 0 O-C-N 121.039 -1.038 . . . . 0.0 110.954 174.551 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 13.4 t0 64.9 28.77 12.64 Favored 'General case' 0 N--CA 1.505 2.298 0 O-C-N 121.205 -0.934 . . . . 0.0 110.388 175.528 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 66.5 m -125.92 138.03 53.75 Favored 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.437 -0.79 . . . . 0.0 110.113 178.633 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 9.8 t -128.29 146.78 50.65 Favored 'General case' 0 N--CA 1.495 1.813 0 O-C-N 121.702 -0.624 . . . . 0.0 109.928 178.197 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 46.3 mtmt -150.18 141.84 23.6 Favored 'General case' 0 N--CA 1.497 1.894 0 C-N-CA 120.129 -0.628 . . . . 0.0 110.655 -177.812 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 89.8 p -95.84 121.95 38.11 Favored 'General case' 0 N--CA 1.495 1.799 0 O-C-N 121.839 -0.538 . . . . 0.0 110.089 176.771 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 83.1 mt -129.32 135.8 60.92 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.789 0 O-C-N 121.616 -0.677 . . . . 0.0 109.349 -179.76 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 48' ' ' VAL . . . . . 1.064 HG22 HD12 ' A' ' 34' ' ' ILE . 65.4 t -81.84 127.69 39.38 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.861 0 O-C-N 121.577 -0.702 . . . . 0.0 109.224 179.755 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 49' ' ' THR . . . . . 0.486 HG21 ' HE1' ' A' ' 28' ' ' PHE . 37.5 p -58.7 -24.87 62.21 Favored 'General case' 0 N--CA 1.505 2.298 0 O-C-N 121.547 -0.721 . . . . 0.0 111.915 -169.959 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 33.5 tttp -56.46 -23.14 36.98 Favored 'General case' 0 N--CA 1.503 2.214 0 O-C-N 121.485 -0.759 . . . . 0.0 111.09 -177.141 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 51.7 p30 -83.05 0.73 43.55 Favored 'General case' 0 N--CA 1.5 2.029 0 C-N-CA 119.762 -0.775 . . . . 0.0 111.24 176.199 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 98.8 mt -75.81 126.79 36.92 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.038 0 O-C-N 121.193 -0.942 . . . . 0.0 109.955 177.829 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 79.6 tttt -91.28 -29.5 17.13 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.829 -0.545 . . . . 0.0 109.849 171.165 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 5.4 m-20 -164.15 157.3 17.9 Favored 'General case' 0 N--CA 1.5 2.063 0 O-C-N 121.768 -0.582 . . . . 0.0 110.093 -178.585 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . 0.697 ' CD2' HG22 ' A' ' 13' ' ' VAL . 84.6 mt -133.01 151.24 52.09 Favored 'General case' 0 N--CA 1.497 1.894 0 O-C-N 121.674 -0.641 . . . . 0.0 110.576 -179.525 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 6.2 ptm180 -152.63 136.87 16.56 Favored 'General case' 0 N--CA 1.495 1.798 0 O-C-N 121.833 -0.542 . . . . 0.0 109.732 174.818 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 57' ' ' ILE . . . . . 0.483 ' HA ' HG12 ' A' ' 11' ' ' VAL . 64.6 mt -83.51 133.17 29.74 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.846 0 O-C-N 121.522 -0.736 . . . . 0.0 109.81 176.212 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . 0.417 HD11 ' HB2' ' A' ' 12' ' ' GLU . 22.6 mt . . . . . 0 N--CA 1.497 1.915 0 O-C-N 121.633 -0.667 . . . . 0.0 109.964 -179.301 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 257' ' ' SER . . . . . . . . . . . . . 54.6 p . . . . . 0 N--CA 1.503 2.199 0 CA-C-O 121.285 0.564 . . . . 0.0 110.462 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' B' B ' 258' ' ' SER . . . . . . . . . . . . . 23.8 m -70.21 -31.95 69.62 Favored 'General case' 0 N--CA 1.498 1.955 0 C-N-CA 120.383 -0.527 . . . . 0.0 110.47 -179.335 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 259' ' ' GLN . . . . . . . . . . . . . 98.6 mt-30 -63.66 -40.84 97.85 Favored 'General case' 0 N--CA 1.501 2.109 0 O-C-N 121.511 -0.743 . . . . 0.0 110.542 -178.536 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 260' ' ' LEU . . . . . . . . . . . . . 84.2 mt -72.96 -41.63 64.21 Favored 'General case' 0 N--CA 1.498 1.955 0 O-C-N 121.635 -0.666 . . . . 0.0 110.295 -179.587 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 261' ' ' LEU . . . . . . . . . . . . . 20.7 tp -69.75 -38.46 76.82 Favored 'General case' 0 N--CA 1.497 1.909 0 O-C-N 121.655 -0.653 . . . . 0.0 109.884 178.857 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 262' ' ' SER . . . . . . . . . . . . . 88.8 p -63.32 -35.5 80.58 Favored 'General case' 0 N--CA 1.499 1.987 0 O-C-N 121.71 -0.619 . . . . 0.0 110.674 177.263 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 263' ' ' LEU . . . . . . . . . . . . . 26.7 mt . . . . . 0 N--CA 1.501 2.098 0 O-C-N 121.564 -0.71 . . . . 0.0 110.366 -179.734 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 70.0 m . . . . . 0 N--CA 1.496 1.833 0 CA-C-O 121.035 0.445 . . . . 0.0 110.245 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 3' ' ' VAL . . . . . 0.416 HG21 ' CZ ' ' A' ' 28' ' ' PHE . 49.9 t -65.74 -27.92 42.68 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.198 0 O-C-N 121.654 -0.654 . . . . 0.0 110.138 179.595 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -55.58 -31.99 62.68 Favored 'General case' 0 N--CA 1.501 2.123 0 O-C-N 121.394 -0.816 . . . . 0.0 110.334 -179.838 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 74.2 m-20 -68.65 -35.38 77.18 Favored 'General case' 0 N--CA 1.498 1.937 0 O-C-N 121.809 -0.557 . . . . 0.0 109.956 175.387 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 6' ' ' PHE . . . . . 0.411 ' CE1' HD21 ' B' ' 260' ' ' LEU . 97.6 m-85 -97.9 10.06 41.18 Favored 'General case' 0 N--CA 1.498 1.965 0 O-C-N 121.746 -0.596 . . . . 0.0 111.226 178.812 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -67.49 126.95 30.91 Favored 'General case' 0 N--CA 1.501 2.095 0 O-C-N 121.241 -0.912 . . . . 0.0 110.052 178.752 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 81.95 2.11 90.47 Favored Glycine 0 N--CA 1.497 2.716 0 N-CA-C 110.695 -0.962 . . . . 0.0 110.695 -176.938 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 59.6 p -77.86 142.66 38.37 Favored 'General case' 0 N--CA 1.497 1.924 0 O-C-N 121.061 -1.258 . . . . 0.0 110.065 175.31 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 10' ' ' ASN . . . . . 0.774 ' ND2' HG22 ' A' ' 24' ' ' VAL . 1.9 m120 -85.27 117.53 24.26 Favored 'General case' 0 N--CA 1.5 2.028 0 N-CA-C 109.064 -0.717 . . . . 0.0 109.064 176.303 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . 0.443 HG12 ' HA ' ' A' ' 57' ' ' ILE . 29.8 m -142.21 158.88 20.08 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.89 0 C-N-CA 120.164 -0.614 . . . . 0.0 109.983 -179.152 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 12' ' ' GLU . . . . . 0.583 ' HB2' HD11 ' A' ' 58' ' ' LEU . 46.4 tt0 -109.4 129.53 55.54 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.619 -0.676 . . . . 0.0 110.107 178.772 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 13' ' ' VAL . . . . . 0.545 HG22 ' CD2' ' A' ' 55' ' ' LEU . 58.9 t -106.68 127.59 62.04 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.733 0 O-C-N 121.589 -0.695 . . . . 0.0 109.961 -178.917 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . 0.506 HD13 ' HG2' ' A' ' 20' ' ' LYS . 28.3 tp -95.84 127.67 42.06 Favored 'General case' 0 N--CA 1.493 1.689 0 N-CA-C 109.096 -0.705 . . . . 0.0 109.096 173.947 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 87.9 mt -96.47 169.26 10.03 Favored 'General case' 0 N--CA 1.495 1.814 0 O-C-N 121.567 -0.708 . . . . 0.0 111.168 -172.793 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 24.2 p30 -57.59 -22.14 43.21 Favored 'General case' 0 N--CA 1.507 2.398 0 O-C-N 121.94 -0.475 . . . . 0.0 111.636 -177.123 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 44.6 p-10 -92.53 22.83 4.36 Favored 'General case' 0 N--CA 1.498 1.943 0 O-C-N 121.522 -0.736 . . . . 0.0 110.905 -176.995 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 74.5 m-20 58.56 27.5 15.77 Favored 'General case' 0 N--CA 1.505 2.312 0 O-C-N 121.465 -0.772 . . . . 0.0 110.637 176.078 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 48.0 m -106.29 143.6 34.18 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.519 -0.738 . . . . 0.0 109.597 172.859 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . 0.506 ' HG2' HD13 ' A' ' 14' ' ' LEU . 66.5 mttt -109.73 148.86 30.66 Favored 'General case' 0 N--CA 1.494 1.749 0 O-C-N 121.579 -0.701 . . . . 0.0 110.556 -176.229 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -153.07 154.21 34.41 Favored 'General case' 0 N--CA 1.496 1.834 0 O-C-N 121.729 -0.607 . . . . 0.0 110.105 176.066 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . 0.402 ' O ' HD22 ' A' ' 39' ' ' LEU . 30.8 ptt180 -138.69 151.17 46.94 Favored 'General case' 0 N--CA 1.497 1.913 0 O-C-N 121.597 -0.689 . . . . 0.0 110.466 179.341 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . 0.433 ' HA2' HD13 ' A' ' 39' ' ' LEU . . . -171.9 171.27 44.04 Favored Glycine 0 N--CA 1.492 2.394 0 N-CA-C 108.956 -1.658 . . . . 0.0 108.956 -178.71 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . 0.774 HG22 ' ND2' ' A' ' 10' ' ' ASN . 30.3 t -94.56 124.85 47.21 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.815 0 O-C-N 121.571 -0.958 . . . . 0.0 109.125 175.498 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 25' ' ' ILE . . . . . 0.492 ' HA ' HD23 ' A' ' 37' ' ' LEU . 51.0 mt -61.87 134.77 27.07 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.171 0 O-C-N 121.428 -0.795 . . . . 0.0 110.834 -171.839 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 26' ' ' THR . . . . . 0.737 HG21 ' HB2' ' A' ' 38' ' ' ARG . 11.0 p -121.21 -16.94 7.84 Favored 'General case' 0 N--CA 1.494 1.765 0 O-C-N 121.916 -0.49 . . . . 0.0 111.61 -177.844 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 27' ' ' ASN . . . . . 0.424 ' O ' HD12 ' A' ' 35' ' ' LEU . 13.5 t30 -166.09 157.38 13.49 Favored 'General case' 0 N--CA 1.504 2.251 0 O-C-N 120.927 -1.108 . . . . 0.0 111.75 175.61 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 28' ' ' PHE . . . . . 0.416 ' CZ ' HG21 ' A' ' 3' ' ' VAL . 72.0 t80 -150.28 122.15 8.15 Favored 'General case' 0 N--CA 1.496 1.855 0 N-CA-C 109.225 -0.657 . . . . 0.0 109.225 173.459 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 26.6 t0 -99.12 130.45 45.44 Favored 'General case' 0 N--CA 1.491 1.614 0 N-CA-C 109.139 -0.689 . . . . 0.0 109.139 -178.022 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 19.3 m -70.55 -51.88 25.53 Favored 'General case' 0 N--CA 1.497 1.916 0 C-N-CA 120.0 -0.68 . . . . 0.0 110.54 -176.081 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 31.5 m -60.71 -40.79 93.6 Favored 'General case' 0 N--CA 1.501 2.116 0 O-C-N 121.617 -0.677 . . . . 0.0 110.847 -174.813 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 91.6 m-20 -103.85 -9.97 18.57 Favored 'General case' 0 N--CA 1.497 1.914 0 O-C-N 121.678 -0.639 . . . . 0.0 111.616 -177.579 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 15.0 m 49.83 67.26 0.93 Allowed 'General case' 0 N--CA 1.508 2.468 0 O-C-N 121.142 -0.974 . . . . 0.0 110.899 -174.665 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 34' ' ' ILE . . . . . 1.042 HD12 HG22 ' A' ' 48' ' ' VAL . 43.9 mm -120.8 125.93 74.64 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.997 0 O-C-N 121.623 -0.673 . . . . 0.0 109.26 -175.645 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.424 HD12 ' O ' ' A' ' 27' ' ' ASN . 14.8 tp -115.93 118.89 34.22 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.691 -0.63 . . . . 0.0 110.451 -170.659 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 78.4 mt-30 -90.96 132.75 35.77 Favored 'General case' 0 N--CA 1.489 1.517 0 N-CA-C 109.21 -0.663 . . . . 0.0 109.21 171.863 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . 0.492 HD23 ' HA ' ' A' ' 25' ' ' ILE . 56.7 mt -117.77 123.57 46.32 Favored 'General case' 0 N--CA 1.493 1.693 0 C-N-CA 120.214 -0.594 . . . . 0.0 109.946 175.435 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 38' ' ' ARG . . . . . 0.737 ' HB2' HG21 ' A' ' 26' ' ' THR . 74.2 ttt-85 -104.27 104.87 14.84 Favored 'General case' 0 N--CA 1.496 1.835 0 O-C-N 121.716 -0.615 . . . . 0.0 109.97 173.643 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . 0.433 HD13 ' HA2' ' A' ' 23' ' ' GLY . 63.7 tp -85.01 156.76 20.98 Favored 'General case' 0 N--CA 1.498 1.926 0 O-C-N 121.622 -0.674 . . . . 0.0 110.607 -176.339 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -66.82 -3.0 5.79 Favored 'General case' 0 N--CA 1.502 2.168 0 O-C-N 121.927 -0.483 . . . . 0.0 112.203 -170.954 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 91.6 m-20 -86.01 28.94 0.76 Allowed 'General case' 0 N--CA 1.498 1.946 0 O-C-N 120.97 -1.081 . . . . 0.0 110.765 172.364 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 10.2 m-20 59.34 31.4 21.1 Favored 'General case' 0 N--CA 1.504 2.243 0 O-C-N 121.244 -0.91 . . . . 0.0 110.419 174.372 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 66.2 m -124.64 137.83 54.35 Favored 'General case' 0 N--CA 1.496 1.865 0 O-C-N 121.486 -0.759 . . . . 0.0 110.439 178.877 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 8.5 t -103.93 151.13 23.53 Favored 'General case' 0 N--CA 1.498 1.933 0 O-C-N 121.816 -0.553 . . . . 0.0 110.262 176.32 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 39.0 ttmt -149.81 119.15 6.85 Favored 'General case' 0 N--CA 1.495 1.819 0 O-C-N 121.616 -0.677 . . . . 0.0 110.365 178.224 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 88.6 p -94.93 121.4 36.49 Favored 'General case' 0 N--CA 1.495 1.811 0 O-C-N 121.781 -0.575 . . . . 0.0 110.264 179.936 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 81.7 mt -129.28 135.14 62.5 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.853 0 O-C-N 121.686 -0.634 . . . . 0.0 109.342 179.572 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 48' ' ' VAL . . . . . 1.042 HG22 HD12 ' A' ' 34' ' ' ILE . 67.6 t -81.61 127.63 39.42 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.862 0 N-CA-C 109.069 -0.715 . . . . 0.0 109.069 177.35 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 59.6 p -58.28 -24.85 60.82 Favored 'General case' 0 N--CA 1.503 2.2 0 O-C-N 121.492 -0.755 . . . . 0.0 111.855 -168.337 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 19.0 tptm -56.89 -26.65 59.4 Favored 'General case' 0 N--CA 1.501 2.118 0 O-C-N 121.531 -0.731 . . . . 0.0 111.024 -177.12 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 4.9 p30 -85.1 6.85 23.81 Favored 'General case' 0 N--CA 1.498 1.958 0 C-N-CA 119.748 -0.781 . . . . 0.0 111.42 176.562 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 98.4 mt -75.34 124.25 32.86 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.115 0 O-C-N 121.171 -0.956 . . . . 0.0 109.849 175.704 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 23.2 tptp -92.06 -29.11 16.74 Favored 'General case' 0 N--CA 1.494 1.774 0 O-C-N 121.801 -0.562 . . . . 0.0 109.879 171.081 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 5.2 m-20 -163.62 155.08 16.76 Favored 'General case' 0 N--CA 1.5 2.052 0 O-C-N 121.813 -0.554 . . . . 0.0 110.11 -178.145 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . 0.545 ' CD2' HG22 ' A' ' 13' ' ' VAL . 85.1 mt -132.99 149.65 52.22 Favored 'General case' 0 N--CA 1.497 1.903 0 O-C-N 121.736 -0.603 . . . . 0.0 110.432 -179.04 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 7.7 ptm180 -151.74 141.59 21.98 Favored 'General case' 0 N--CA 1.494 1.757 0 O-C-N 121.706 -0.621 . . . . 0.0 109.925 175.861 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 57' ' ' ILE . . . . . 0.443 ' HA ' HG12 ' A' ' 11' ' ' VAL . 69.5 mt -85.65 133.13 30.27 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.881 0 O-C-N 121.482 -0.762 . . . . 0.0 109.776 173.78 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . 0.583 HD11 ' HB2' ' A' ' 12' ' ' GLU . 79.2 mt . . . . . 0 N--CA 1.496 1.869 0 O-C-N 121.616 -0.677 . . . . 0.0 110.07 178.611 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 257' ' ' SER . . . . . . . . . . . . . 32.2 t . . . . . 0 N--CA 1.505 2.28 0 CA-C-O 121.255 0.55 . . . . 0.0 110.327 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' B' B ' 258' ' ' SER . . . . . . . . . . . . . 24.1 m -68.01 -31.39 71.05 Favored 'General case' 0 N--CA 1.497 1.919 0 C-N-CA 120.513 -0.475 . . . . 0.0 110.225 178.87 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 259' ' ' GLN . . . . . . . . . . . . . 48.7 tt0 -63.26 -37.12 86.01 Favored 'General case' 0 N--CA 1.5 2.027 0 O-C-N 121.647 -0.658 . . . . 0.0 110.37 178.714 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 260' ' ' LEU . . . . . 0.493 ' HA ' HD12 ' B' ' 263' ' ' LEU . 82.1 mt -64.18 -43.75 94.14 Favored 'General case' 0 N--CA 1.501 2.079 0 O-C-N 121.628 -0.67 . . . . 0.0 110.248 179.184 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 261' ' ' LEU . . . . . . . . . . . . . 17.5 tp -70.69 -38.36 73.68 Favored 'General case' 0 N--CA 1.497 1.915 0 O-C-N 121.662 -0.649 . . . . 0.0 109.733 175.919 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 262' ' ' SER . . . . . . . . . . . . . 23.1 t -62.38 -35.56 79.56 Favored 'General case' 0 N--CA 1.501 2.093 0 O-C-N 121.681 -0.637 . . . . 0.0 110.52 176.639 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 263' ' ' LEU . . . . . 0.493 HD12 ' HA ' ' B' ' 260' ' ' LEU . 18.3 mt . . . . . 0 N--CA 1.501 2.101 0 O-C-N 121.689 -0.632 . . . . 0.0 110.254 179.679 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 69.7 m . . . . . 0 N--CA 1.494 1.725 0 CA-C-O 120.969 0.414 . . . . 0.0 110.146 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 3' ' ' VAL . . . . . 0.428 HG12 ' CE1' ' A' ' 7' ' ' TYR . 61.3 t -65.92 -27.86 42.3 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.111 0 O-C-N 121.707 -0.621 . . . . 0.0 110.241 -178.798 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -55.19 -30.84 60.73 Favored 'General case' 0 N--CA 1.504 2.255 0 O-C-N 121.4 -0.813 . . . . 0.0 110.44 -178.64 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 74.4 m-20 -68.77 -30.98 69.69 Favored 'General case' 0 N--CA 1.5 2.032 0 C-N-CA 120.33 -0.548 . . . . 0.0 110.252 174.854 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 6' ' ' PHE . . . . . 0.404 ' CE1' HD21 ' B' ' 260' ' ' LEU . 96.7 m-85 -96.09 10.04 38.89 Favored 'General case' 0 N--CA 1.497 1.889 0 O-C-N 121.653 -0.655 . . . . 0.0 111.512 -178.168 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 7' ' ' TYR . . . . . 0.428 ' CE1' HG12 ' A' ' 3' ' ' VAL . 3.3 m-30 -67.24 137.53 56.23 Favored 'General case' 0 N--CA 1.501 2.105 0 O-C-N 121.093 -1.004 . . . . 0.0 110.014 174.189 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 8' ' ' GLY . . . . . 0.416 ' O ' HG13 ' A' ' 24' ' ' VAL . . . 82.72 -0.64 89.3 Favored Glycine 0 N--CA 1.498 2.796 0 N-CA-C 110.704 -0.959 . . . . 0.0 110.704 -176.294 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 31.8 t -77.02 133.96 38.96 Favored 'General case' 0 N--CA 1.498 1.937 0 O-C-N 121.113 -1.228 . . . . 0.0 110.488 178.928 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 13.6 t-20 -83.13 120.53 25.89 Favored 'General case' 0 N--CA 1.497 1.887 0 O-C-N 121.694 -0.628 . . . . 0.0 109.526 173.399 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . 0.538 HG12 ' HA ' ' A' ' 57' ' ' ILE . 35.2 m -143.15 165.42 15.45 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.734 0 N-CA-C 109.527 -0.546 . . . . 0.0 109.527 -178.329 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 12' ' ' GLU . . . . . 0.446 ' HB2' HD11 ' A' ' 58' ' ' LEU . 47.0 tt0 -109.35 126.38 53.34 Favored 'General case' 0 N--CA 1.494 1.729 0 C-N-CA 119.897 -0.721 . . . . 0.0 109.752 176.54 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 13' ' ' VAL . . . . . 0.608 HG22 ' CD2' ' A' ' 55' ' ' LEU . 54.1 t -106.79 125.1 62.77 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.745 0 O-C-N 121.614 -0.679 . . . . 0.0 109.891 -178.098 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 25.0 tp -95.94 128.59 42.97 Favored 'General case' 0 N--CA 1.494 1.734 0 N-CA-C 109.326 -0.62 . . . . 0.0 109.326 174.838 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 87.6 mt -96.68 169.5 9.83 Favored 'General case' 0 N--CA 1.496 1.837 0 O-C-N 121.677 -0.64 . . . . 0.0 111.004 -173.846 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 24.3 p30 -57.71 -22.2 44.94 Favored 'General case' 0 N--CA 1.505 2.307 0 O-C-N 121.701 -0.625 . . . . 0.0 111.615 -176.984 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 43.7 p-10 -93.05 23.16 4.44 Favored 'General case' 0 N--CA 1.497 1.902 0 O-C-N 121.523 -0.736 . . . . 0.0 110.867 -177.001 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 74.4 m-20 58.72 27.54 16.06 Favored 'General case' 0 N--CA 1.506 2.344 0 O-C-N 121.435 -0.79 . . . . 0.0 110.594 176.155 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 51.0 m -106.86 146.06 31.42 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.502 -0.749 . . . . 0.0 109.563 173.109 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 48.6 mttm -109.6 143.74 38.89 Favored 'General case' 0 N--CA 1.495 1.776 0 O-C-N 121.599 -0.688 . . . . 0.0 110.63 -176.599 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -153.07 123.64 7.23 Favored 'General case' 0 N--CA 1.497 1.876 0 O-C-N 121.778 -0.576 . . . . 0.0 110.048 176.575 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . 0.532 ' O ' HD13 ' A' ' 39' ' ' LEU . 8.9 ptp85 -118.32 147.61 43.31 Favored 'General case' 0 N--CA 1.498 1.96 0 O-C-N 121.615 -0.678 . . . . 0.0 110.375 -176.483 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -171.79 171.44 44.1 Favored Glycine 0 N--CA 1.495 2.63 0 N-CA-C 108.975 -1.65 . . . . 0.0 108.975 -176.148 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . 0.416 HG13 ' O ' ' A' ' 8' ' ' GLY . 47.2 t -94.58 119.41 42.53 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.925 0 O-C-N 121.433 -1.039 . . . . 0.0 109.355 -177.462 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 25' ' ' ILE . . . . . 0.413 ' HA ' HD23 ' A' ' 37' ' ' LEU . 74.9 mt -64.25 143.58 15.55 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.155 0 O-C-N 121.7 -0.625 . . . . 0.0 110.449 -171.975 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 26' ' ' THR . . . . . 0.794 HG21 ' HG3' ' A' ' 38' ' ' ARG . 20.7 p -121.3 -27.31 4.88 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.785 -0.572 . . . . 0.0 111.233 179.176 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 27' ' ' ASN . . . . . 0.538 ' O ' HD12 ' A' ' 35' ' ' LEU . 26.9 t30 -161.39 160.91 30.06 Favored 'General case' 0 N--CA 1.501 2.078 0 C-N-CA 118.95 -1.1 . . . . 0.0 111.814 -178.854 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 28' ' ' PHE . . . . . 0.444 ' CE1' HG21 ' A' ' 49' ' ' THR . 69.5 t80 -150.02 128.37 12.14 Favored 'General case' 0 N--CA 1.496 1.86 0 N-CA-C 109.301 -0.629 . . . . 0.0 109.301 169.107 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 17.9 t70 -100.2 130.56 46.34 Favored 'General case' 0 N--CA 1.492 1.659 0 N-CA-C 109.04 -0.726 . . . . 0.0 109.04 -178.351 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 87.1 p -68.87 -48.59 63.03 Favored 'General case' 0 N--CA 1.498 1.963 0 C-N-CA 120.016 -0.674 . . . . 0.0 110.649 -175.925 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 23.0 m -59.76 -43.77 94.15 Favored 'General case' 0 N--CA 1.502 2.16 0 O-C-N 121.636 -0.665 . . . . 0.0 110.907 -174.221 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 91.5 m-20 -104.24 -8.66 19.18 Favored 'General case' 0 N--CA 1.497 1.919 0 O-C-N 121.687 -0.633 . . . . 0.0 111.619 -178.252 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 24.8 m 49.71 67.22 0.93 Allowed 'General case' 0 N--CA 1.508 2.442 0 O-C-N 121.131 -0.98 . . . . 0.0 110.929 -174.403 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 34' ' ' ILE . . . . . 0.986 HD12 HG22 ' A' ' 48' ' ' VAL . 42.6 mm -122.52 126.1 73.6 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.028 0 O-C-N 121.635 -0.666 . . . . 0.0 109.356 -175.45 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.538 HD12 ' O ' ' A' ' 27' ' ' ASN . 12.3 tp -115.78 120.47 39.41 Favored 'General case' 0 N--CA 1.494 1.739 0 O-C-N 121.699 -0.626 . . . . 0.0 110.589 -169.464 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 99.0 mt-30 -91.08 132.96 35.71 Favored 'General case' 0 N--CA 1.49 1.538 0 N-CA-C 109.517 -0.549 . . . . 0.0 109.517 174.506 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . 0.413 HD23 ' HA ' ' A' ' 25' ' ' ILE . 15.5 mt -117.95 123.84 46.76 Favored 'General case' 0 N--CA 1.495 1.811 0 O-C-N 121.902 -0.498 . . . . 0.0 109.964 176.034 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 38' ' ' ARG . . . . . 0.794 ' HG3' HG21 ' A' ' 26' ' ' THR . 11.6 mtt85 -96.83 106.91 19.31 Favored 'General case' 0 N--CA 1.498 1.934 0 O-C-N 121.646 -0.659 . . . . 0.0 109.924 175.792 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . 0.532 HD13 ' O ' ' A' ' 22' ' ' ARG . 16.8 tp -84.67 152.48 23.75 Favored 'General case' 0 N--CA 1.495 1.777 0 C-N-CA 120.24 -0.584 . . . . 0.0 110.813 -174.807 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -66.8 -5.44 12.19 Favored 'General case' 0 N--CA 1.502 2.146 0 O-C-N 121.941 -0.474 . . . . 0.0 112.041 -171.658 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 91.6 m-20 -86.99 28.09 0.95 Allowed 'General case' 0 N--CA 1.499 2.001 0 O-C-N 121.115 -0.991 . . . . 0.0 110.879 174.547 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 8.5 t70 62.91 29.27 16.55 Favored 'General case' 0 N--CA 1.505 2.278 0 O-C-N 120.981 -1.074 . . . . 0.0 110.462 175.769 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 50.1 m -124.5 137.86 54.39 Favored 'General case' 0 N--CA 1.496 1.838 0 O-C-N 121.401 -0.812 . . . . 0.0 110.49 -179.438 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 9.8 t -97.7 150.99 20.59 Favored 'General case' 0 N--CA 1.497 1.911 0 O-C-N 121.818 -0.552 . . . . 0.0 110.194 175.47 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 41.3 tttp -149.3 119.13 7.07 Favored 'General case' 0 N--CA 1.495 1.786 0 O-C-N 121.546 -0.721 . . . . 0.0 110.313 178.679 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 90.2 p -95.61 122.27 38.18 Favored 'General case' 0 N--CA 1.494 1.769 0 O-C-N 121.701 -0.625 . . . . 0.0 110.194 179.005 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 82.3 mt -129.21 134.38 64.0 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.924 0 O-C-N 121.717 -0.614 . . . . 0.0 109.423 179.396 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 48' ' ' VAL . . . . . 0.986 HG22 HD12 ' A' ' 34' ' ' ILE . 49.1 t -82.62 127.88 39.24 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.941 0 O-C-N 121.66 -0.65 . . . . 0.0 109.321 179.14 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 49' ' ' THR . . . . . 0.444 HG21 ' CE1' ' A' ' 28' ' ' PHE . 33.9 p -58.53 -24.98 61.93 Favored 'General case' 0 N--CA 1.505 2.285 0 O-C-N 121.649 -0.657 . . . . 0.0 112.332 -166.013 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 24.6 pttm -56.34 -22.59 31.87 Favored 'General case' 0 N--CA 1.505 2.278 0 O-C-N 121.488 -0.757 . . . . 0.0 111.239 -175.779 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 9.9 p30 -82.51 -0.53 46.98 Favored 'General case' 0 N--CA 1.5 2.042 0 O-C-N 121.563 -0.711 . . . . 0.0 111.199 176.253 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 94.1 mt -77.0 126.96 38.06 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.069 0 O-C-N 121.176 -0.953 . . . . 0.0 110.012 177.585 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 41.1 tttp -92.02 -29.84 16.38 Favored 'General case' 0 N--CA 1.494 1.765 0 O-C-N 121.809 -0.557 . . . . 0.0 109.822 170.592 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 5.3 m-20 -164.24 156.97 17.31 Favored 'General case' 0 N--CA 1.5 2.026 0 O-C-N 121.717 -0.614 . . . . 0.0 110.058 -177.923 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . 0.608 ' CD2' HG22 ' A' ' 13' ' ' VAL . 74.4 mt -132.9 148.73 52.29 Favored 'General case' 0 N--CA 1.497 1.902 0 O-C-N 121.721 -0.612 . . . . 0.0 110.429 -179.287 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 7.0 ptm180 -151.06 141.53 22.5 Favored 'General case' 0 N--CA 1.496 1.863 0 O-C-N 121.694 -0.629 . . . . 0.0 109.868 175.634 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 57' ' ' ILE . . . . . 0.538 ' HA ' HG12 ' A' ' 11' ' ' VAL . 59.1 mt -85.74 133.36 29.74 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.888 0 O-C-N 121.47 -0.769 . . . . 0.0 110.012 176.205 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . 0.456 HD11 ' HB2' ' A' ' 22' ' ' ARG . 20.8 mt . . . . . 0 N--CA 1.498 1.962 0 O-C-N 121.606 -0.684 . . . . 0.0 109.942 -179.202 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 257' ' ' SER . . . . . 0.463 ' HA ' HD12 ' B' ' 260' ' ' LEU . 58.4 m . . . . . 0 N--CA 1.502 2.173 0 CA-C-O 121.359 0.6 . . . . 0.0 110.465 . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 258' ' ' SER . . . . . . . . . . . . . 25.4 m -67.75 -33.19 74.36 Favored 'General case' 0 N--CA 1.498 1.936 0 O-C-N 121.827 -0.545 . . . . 0.0 110.204 -179.684 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 259' ' ' GLN . . . . . . . . . . . . . 98.4 mt-30 -64.76 -33.51 76.15 Favored 'General case' 0 N--CA 1.5 2.05 0 O-C-N 121.632 -0.668 . . . . 0.0 110.323 178.883 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 260' ' ' LEU . . . . . 0.51 ' HA ' HD12 ' B' ' 263' ' ' LEU . 82.2 mt -65.38 -40.05 93.01 Favored 'General case' 0 N--CA 1.5 2.071 0 O-C-N 121.636 -0.665 . . . . 0.0 110.181 178.808 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 261' ' ' LEU . . . . . . . . . . . . . 25.5 tp -69.15 -39.93 78.5 Favored 'General case' 0 N--CA 1.499 2.015 0 O-C-N 121.671 -0.643 . . . . 0.0 109.862 176.634 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 262' ' ' SER . . . . . . . . . . . . . 22.7 m -62.55 -37.14 84.98 Favored 'General case' 0 N--CA 1.502 2.136 0 O-C-N 121.74 -0.6 . . . . 0.0 110.493 177.853 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 263' ' ' LEU . . . . . 0.51 HD12 ' HA ' ' B' ' 260' ' ' LEU . 30.2 mt . . . . . 0 N--CA 1.501 2.085 0 O-C-N 121.649 -0.657 . . . . 0.0 110.315 179.46 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 70.4 m . . . . . 0 N--CA 1.493 1.715 0 CA-C-O 120.935 0.398 . . . . 0.0 110.179 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 3' ' ' VAL . . . . . 0.443 HG12 ' CE1' ' A' ' 7' ' ' TYR . 63.2 t -66.35 -27.85 41.75 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.093 0 O-C-N 121.644 -0.66 . . . . 0.0 110.188 -179.467 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -55.06 -30.98 60.75 Favored 'General case' 0 N--CA 1.505 2.275 0 O-C-N 121.394 -0.816 . . . . 0.0 110.439 -179.214 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 74.3 m-20 -68.57 -30.8 69.65 Favored 'General case' 0 N--CA 1.499 1.996 0 O-C-N 121.81 -0.556 . . . . 0.0 110.226 174.776 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 96.7 m-85 -95.8 10.15 38.06 Favored 'General case' 0 N--CA 1.496 1.859 0 O-C-N 121.574 -0.704 . . . . 0.0 111.524 -178.589 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 7' ' ' TYR . . . . . 0.443 ' CE1' HG12 ' A' ' 3' ' ' VAL . 4.0 m-30 -67.34 139.43 57.22 Favored 'General case' 0 N--CA 1.504 2.228 0 O-C-N 121.211 -0.931 . . . . 0.0 109.964 174.123 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 82.06 3.14 90.67 Favored Glycine 0 N--CA 1.497 2.727 0 N-CA-C 110.56 -1.016 . . . . 0.0 110.56 -176.595 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 73.9 m -78.12 135.74 37.74 Favored 'General case' 0 N--CA 1.498 1.929 0 O-C-N 121.114 -1.227 . . . . 0.0 110.524 175.943 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 14.0 t-20 -83.92 117.43 23.34 Favored 'General case' 0 N--CA 1.497 1.91 0 O-C-N 121.6 -0.687 . . . . 0.0 109.588 172.169 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . 0.546 HG12 ' HA ' ' A' ' 57' ' ' ILE . 35.4 m -142.29 164.39 17.9 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.691 0 N-CA-C 109.319 -0.622 . . . . 0.0 109.319 -179.275 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 12' ' ' GLU . . . . . 0.438 ' HB2' HD21 ' A' ' 58' ' ' LEU . 44.8 tt0 -109.36 129.04 55.54 Favored 'General case' 0 N--CA 1.492 1.666 0 C-N-CA 119.739 -0.785 . . . . 0.0 109.914 177.453 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 13' ' ' VAL . . . . . 0.551 HG22 ' CD2' ' A' ' 55' ' ' LEU . 58.3 t -106.74 125.14 62.69 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.697 0 O-C-N 121.575 -0.703 . . . . 0.0 109.873 -179.566 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 30.2 tp -95.85 128.43 42.72 Favored 'General case' 0 N--CA 1.494 1.728 0 N-CA-C 109.272 -0.64 . . . . 0.0 109.272 175.124 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 84.8 mt -98.28 166.31 11.45 Favored 'General case' 0 N--CA 1.496 1.846 0 O-C-N 121.683 -0.636 . . . . 0.0 111.047 -173.304 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 24.3 p30 -58.86 -21.66 57.55 Favored 'General case' 0 N--CA 1.504 2.271 0 O-C-N 121.769 -0.582 . . . . 0.0 111.64 -176.833 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 43.5 p-10 -92.64 23.4 4.09 Favored 'General case' 0 N--CA 1.498 1.953 0 O-C-N 121.547 -0.72 . . . . 0.0 110.905 -175.725 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 74.3 m-20 58.5 27.1 15.12 Favored 'General case' 0 N--CA 1.506 2.339 0 O-C-N 121.406 -0.809 . . . . 0.0 110.65 176.306 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 51.1 m -106.51 145.85 31.32 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.587 -0.696 . . . . 0.0 109.55 172.531 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 49.7 mttp -109.7 150.26 28.55 Favored 'General case' 0 N--CA 1.494 1.759 0 O-C-N 121.625 -0.672 . . . . 0.0 110.573 -175.531 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -152.97 150.37 29.16 Favored 'General case' 0 N--CA 1.496 1.861 0 O-C-N 121.682 -0.636 . . . . 0.0 110.111 176.05 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . 0.515 ' O ' HD13 ' A' ' 39' ' ' LEU . 5.8 ptm180 -144.06 140.26 29.4 Favored 'General case' 0 N--CA 1.498 1.934 0 O-C-N 121.614 -0.679 . . . . 0.0 110.509 179.407 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -171.8 171.4 44.09 Favored Glycine 0 N--CA 1.496 2.678 0 N-CA-C 109.085 -1.606 . . . . 0.0 109.085 -176.051 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 60.4 t -94.59 121.57 45.31 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.91 0 O-C-N 121.511 -0.993 . . . . 0.0 109.357 -177.338 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 25' ' ' ILE . . . . . 0.665 ' HA ' HD23 ' A' ' 37' ' ' LEU . 91.9 mt -65.09 144.04 15.19 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.066 0 O-C-N 121.636 -0.665 . . . . 0.0 110.65 -171.332 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 26' ' ' THR . . . . . 0.611 HG21 ' HB2' ' A' ' 38' ' ' ARG . 7.0 p -121.23 -27.56 4.86 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.78 -0.575 . . . . 0.0 111.133 178.807 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 27' ' ' ASN . . . . . 0.5 ' O ' HD12 ' A' ' 35' ' ' LEU . 8.0 t30 -161.56 160.94 29.59 Favored 'General case' 0 N--CA 1.5 2.044 0 C-N-CA 118.985 -1.086 . . . . 0.0 111.904 -178.547 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 28' ' ' PHE . . . . . 0.577 ' HE1' HG21 ' A' ' 49' ' ' THR . 84.5 t80 -150.15 125.09 9.9 Favored 'General case' 0 N--CA 1.498 1.934 0 N-CA-C 108.87 -0.789 . . . . 0.0 108.87 170.366 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 18.0 t70 -99.44 130.31 45.69 Favored 'General case' 0 N--CA 1.491 1.591 0 N-CA-C 108.986 -0.746 . . . . 0.0 108.986 -176.449 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 20.1 m -69.75 -50.88 39.11 Favored 'General case' 0 N--CA 1.498 1.935 0 C-N-CA 120.004 -0.678 . . . . 0.0 110.449 -177.142 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 23.2 m -59.88 -41.95 92.71 Favored 'General case' 0 N--CA 1.501 2.104 0 O-C-N 121.597 -0.689 . . . . 0.0 110.781 -174.771 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 29.7 m120 -103.93 -10.13 18.38 Favored 'General case' 0 N--CA 1.497 1.915 0 O-C-N 121.676 -0.64 . . . . 0.0 111.644 -177.766 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 1.8 m 49.94 67.31 0.93 Allowed 'General case' 0 N--CA 1.508 2.442 0 O-C-N 121.046 -1.034 . . . . 0.0 111.037 -175.003 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 34' ' ' ILE . . . . . 1.107 HD12 HG22 ' A' ' 48' ' ' VAL . 47.7 mm -126.26 127.39 70.66 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.089 0 O-C-N 121.51 -0.744 . . . . 0.0 109.46 -175.864 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.5 HD12 ' O ' ' A' ' 27' ' ' ASN . 11.2 tp -115.89 120.59 39.7 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.742 -0.599 . . . . 0.0 110.511 -170.832 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 58.6 mt-30 -91.55 134.59 34.53 Favored 'General case' 0 N--CA 1.492 1.65 0 N-CA-C 109.481 -0.563 . . . . 0.0 109.481 174.639 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . 0.665 HD23 ' HA ' ' A' ' 25' ' ' ILE . 89.4 mt -117.87 123.94 47.11 Favored 'General case' 0 N--CA 1.497 1.895 0 C-N-CA 120.406 -0.518 . . . . 0.0 109.929 174.641 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 38' ' ' ARG . . . . . 0.611 ' HB2' HG21 ' A' ' 26' ' ' THR . 57.7 ttt85 -96.34 107.21 19.54 Favored 'General case' 0 N--CA 1.497 1.914 0 O-C-N 121.596 -0.69 . . . . 0.0 109.736 175.79 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . 0.515 HD13 ' O ' ' A' ' 22' ' ' ARG . 18.4 tp -85.36 153.58 22.44 Favored 'General case' 0 N--CA 1.495 1.811 0 O-C-N 121.693 -0.629 . . . . 0.0 111.085 -173.65 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -62.99 -9.76 11.24 Favored 'General case' 0 N--CA 1.503 2.186 0 O-C-N 122.031 -0.418 . . . . 0.0 112.045 -170.475 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 53.6 p-10 -85.12 28.94 0.68 Allowed 'General case' 0 N--CA 1.499 2.011 0 O-C-N 121.024 -1.048 . . . . 0.0 111.049 175.064 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 74.4 m-20 57.95 29.59 17.88 Favored 'General case' 0 N--CA 1.504 2.252 0 O-C-N 121.112 -0.992 . . . . 0.0 110.404 176.619 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 28.2 m -119.71 137.9 53.63 Favored 'General case' 0 N--CA 1.496 1.852 0 O-C-N 121.518 -0.739 . . . . 0.0 110.306 178.604 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 9.8 t -97.86 150.07 21.69 Favored 'General case' 0 N--CA 1.495 1.79 0 O-C-N 121.728 -0.608 . . . . 0.0 110.327 176.608 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 19.9 mtpp -148.93 122.25 9.01 Favored 'General case' 0 N--CA 1.495 1.815 0 O-C-N 121.714 -0.616 . . . . 0.0 110.423 178.207 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 90.6 p -96.37 123.79 40.14 Favored 'General case' 0 N--CA 1.496 1.85 0 O-C-N 121.815 -0.553 . . . . 0.0 110.202 179.802 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 82.0 mt -129.28 134.23 64.18 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.858 0 O-C-N 121.673 -0.642 . . . . 0.0 109.269 179.111 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 48' ' ' VAL . . . . . 1.107 HG22 HD12 ' A' ' 34' ' ' ILE . 57.8 t -81.93 127.61 39.46 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.9 0 C-N-CA 120.036 -0.666 . . . . 0.0 109.306 179.989 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 49' ' ' THR . . . . . 0.577 HG21 ' HE1' ' A' ' 28' ' ' PHE . 39.3 p -59.91 -24.79 64.6 Favored 'General case' 0 N--CA 1.504 2.241 0 O-C-N 121.582 -0.698 . . . . 0.0 112.054 -170.415 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 32.3 ttpt -56.25 -23.29 35.12 Favored 'General case' 0 N--CA 1.503 2.214 0 O-C-N 121.43 -0.794 . . . . 0.0 111.138 -177.037 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 48.5 p30 -84.16 1.95 41.94 Favored 'General case' 0 N--CA 1.498 1.933 0 O-C-N 121.463 -0.773 . . . . 0.0 111.342 176.61 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 97.4 mt -75.55 127.84 37.09 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.145 0 O-C-N 121.154 -0.966 . . . . 0.0 110.084 178.66 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 52.3 tttm -92.6 -30.4 15.64 Favored 'General case' 0 N--CA 1.494 1.77 0 O-C-N 121.843 -0.536 . . . . 0.0 109.687 169.379 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 5.1 m-20 -163.9 158.04 19.39 Favored 'General case' 0 N--CA 1.5 2.038 0 O-C-N 121.785 -0.572 . . . . 0.0 109.994 -178.304 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . 0.551 ' CD2' HG22 ' A' ' 13' ' ' VAL . 83.4 mt -132.94 149.59 52.23 Favored 'General case' 0 N--CA 1.496 1.863 0 O-C-N 121.656 -0.653 . . . . 0.0 110.38 -179.201 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 20.1 ptp180 -151.51 144.84 24.76 Favored 'General case' 0 N--CA 1.497 1.895 0 O-C-N 121.705 -0.622 . . . . 0.0 110.16 175.813 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 57' ' ' ILE . . . . . 0.546 ' HA ' HG12 ' A' ' 11' ' ' VAL . 66.4 mt -86.59 133.41 29.91 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.88 0 O-C-N 121.661 -0.649 . . . . 0.0 110.042 174.221 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . 0.448 HD11 ' HB2' ' A' ' 22' ' ' ARG . 16.6 mt . . . . . 0 N--CA 1.498 1.935 0 O-C-N 121.64 -0.662 . . . . 0.0 109.894 -179.092 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 257' ' ' SER . . . . . . . . . . . . . 59.2 m . . . . . 0 N--CA 1.502 2.157 0 CA-C-O 121.232 0.539 . . . . 0.0 110.594 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' B' B ' 258' ' ' SER . . . . . . . . . . . . . 68.9 p -69.93 -31.86 69.83 Favored 'General case' 0 N--CA 1.498 1.96 0 C-N-CA 120.248 -0.581 . . . . 0.0 110.302 -178.983 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 259' ' ' GLN . . . . . . . . . . . . . 98.8 mt-30 -64.61 -37.02 86.13 Favored 'General case' 0 N--CA 1.501 2.081 0 O-C-N 121.54 -0.725 . . . . 0.0 110.39 -179.888 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 260' ' ' LEU . . . . . 0.491 ' HA ' HD12 ' B' ' 263' ' ' LEU . 47.1 mt -66.24 -42.22 88.92 Favored 'General case' 0 N--CA 1.501 2.075 0 O-C-N 121.699 -0.625 . . . . 0.0 110.199 179.637 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 261' ' ' LEU . . . . . . . . . . . . . 21.5 tp -70.57 -38.05 74.05 Favored 'General case' 0 N--CA 1.497 1.887 0 O-C-N 121.704 -0.623 . . . . 0.0 109.762 176.561 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 262' ' ' SER . . . . . . . . . . . . . 66.6 m -62.51 -36.04 81.3 Favored 'General case' 0 N--CA 1.501 2.124 0 O-C-N 121.733 -0.604 . . . . 0.0 110.444 176.724 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 263' ' ' LEU . . . . . 0.491 HD12 ' HA ' ' B' ' 260' ' ' LEU . 22.5 mt . . . . . 0 N--CA 1.501 2.098 0 O-C-N 121.669 -0.644 . . . . 0.0 110.241 179.803 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 75.5 m . . . . . 0 N--CA 1.494 1.758 0 CA-C-O 120.985 0.421 . . . . 0.0 110.222 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 58.1 t -65.78 -27.98 42.79 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.176 0 O-C-N 121.721 -0.612 . . . . 0.0 110.326 -179.146 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -55.63 -32.45 63.17 Favored 'General case' 0 N--CA 1.504 2.24 0 O-C-N 121.427 -0.796 . . . . 0.0 110.424 -178.319 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -68.7 -34.4 75.58 Favored 'General case' 0 N--CA 1.498 1.937 0 C-N-CA 120.389 -0.524 . . . . 0.0 109.971 174.79 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 6' ' ' PHE . . . . . 0.447 ' CE2' HD11 ' B' ' 260' ' ' LEU . 96.2 m-85 -97.37 10.21 40.25 Favored 'General case' 0 N--CA 1.498 1.958 0 O-C-N 121.767 -0.583 . . . . 0.0 111.166 178.798 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -67.43 128.88 38.06 Favored 'General case' 0 N--CA 1.5 2.071 0 O-C-N 121.247 -0.908 . . . . 0.0 110.006 -179.832 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 8' ' ' GLY . . . . . 0.466 ' O ' HG13 ' A' ' 24' ' ' VAL . . . 82.77 -0.82 89.23 Favored Glycine 0 N--CA 1.497 2.723 0 N-CA-C 110.839 -0.904 . . . . 0.0 110.839 -176.463 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 57.7 p -76.37 138.7 40.59 Favored 'General case' 0 N--CA 1.497 1.918 0 O-C-N 121.07 -1.253 . . . . 0.0 110.335 177.171 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 11.3 t-20 -84.55 119.17 24.87 Favored 'General case' 0 N--CA 1.496 1.844 0 O-C-N 121.666 -0.646 . . . . 0.0 109.784 174.154 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . 0.529 HG12 ' HA ' ' A' ' 57' ' ' ILE . 35.1 m -141.75 163.99 19.38 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.717 0 O-C-N 121.737 -0.602 . . . . 0.0 109.427 -179.41 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 37.7 tt0 -109.37 130.15 55.51 Favored 'General case' 0 N--CA 1.492 1.649 0 C-N-CA 119.855 -0.738 . . . . 0.0 109.996 177.574 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 13' ' ' VAL . . . . . 0.534 HG22 ' CD2' ' A' ' 55' ' ' LEU . 58.4 t -106.78 127.35 62.39 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.692 0 O-C-N 121.551 -0.718 . . . . 0.0 109.827 -179.799 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 29.4 tp -95.81 125.85 40.66 Favored 'General case' 0 N--CA 1.494 1.769 0 N-CA-C 109.102 -0.703 . . . . 0.0 109.102 174.344 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 85.0 mt -97.07 166.79 11.42 Favored 'General case' 0 N--CA 1.495 1.792 0 O-C-N 121.624 -0.672 . . . . 0.0 111.293 -171.968 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 24.4 p30 -58.0 -21.49 45.08 Favored 'General case' 0 N--CA 1.507 2.382 0 O-C-N 121.83 -0.544 . . . . 0.0 111.569 -177.296 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 43.5 p-10 -93.54 27.1 2.74 Favored 'General case' 0 N--CA 1.497 1.887 0 O-C-N 121.537 -0.727 . . . . 0.0 110.539 -178.135 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 1.1 p30 53.08 27.28 5.6 Favored 'General case' 0 N--CA 1.506 2.345 0 CA-C-O 121.173 0.511 . . . . 0.0 111.042 172.249 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 51.1 m -107.62 147.33 30.79 Favored 'General case' 0 N--CA 1.491 1.585 0 N-CA-C 109.149 -0.685 . . . . 0.0 109.149 171.026 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 49.6 mttp -109.62 147.81 32.4 Favored 'General case' 0 N--CA 1.495 1.784 0 O-C-N 121.595 -0.691 . . . . 0.0 110.62 -174.744 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -153.02 156.61 39.13 Favored 'General case' 0 N--CA 1.496 1.826 0 O-C-N 121.742 -0.599 . . . . 0.0 110.129 176.18 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . 0.406 ' O ' HD22 ' A' ' 39' ' ' LEU . 30.8 ptt180 -144.07 152.84 41.52 Favored 'General case' 0 N--CA 1.496 1.838 0 O-C-N 121.679 -0.638 . . . . 0.0 110.416 178.464 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . 0.451 ' HA2' HD13 ' A' ' 39' ' ' LEU . . . -171.9 171.07 43.93 Favored Glycine 0 N--CA 1.493 2.453 0 N-CA-C 109.184 -1.566 . . . . 0.0 109.184 179.597 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . 0.466 HG13 ' O ' ' A' ' 8' ' ' GLY . 45.4 t -94.57 126.31 47.02 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.925 0 O-C-N 121.643 -0.916 . . . . 0.0 109.178 175.498 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 25' ' ' ILE . . . . . 0.475 ' HA ' HD23 ' A' ' 37' ' ' LEU . 52.7 mt -62.86 138.36 22.97 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.147 0 O-C-N 121.589 -0.694 . . . . 0.0 111.012 -170.806 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 26' ' ' THR . . . . . 0.622 HG21 ' HG3' ' A' ' 38' ' ' ARG . 18.1 p -121.25 -19.09 7.19 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.861 -0.524 . . . . 0.0 111.563 179.501 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 27' ' ' ASN . . . . . 0.445 ' O ' HD12 ' A' ' 35' ' ' LEU . 2.2 t-20 -165.26 157.94 15.87 Favored 'General case' 0 N--CA 1.504 2.263 0 O-C-N 120.949 -1.095 . . . . 0.0 111.732 175.329 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 28' ' ' PHE . . . . . 0.435 ' HE1' HG21 ' A' ' 49' ' ' THR . 64.3 t80 -150.29 121.11 7.58 Favored 'General case' 0 N--CA 1.495 1.79 0 N-CA-C 109.246 -0.65 . . . . 0.0 109.246 173.683 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 17.8 t70 -98.28 130.42 44.98 Favored 'General case' 0 N--CA 1.492 1.645 0 N-CA-C 109.114 -0.699 . . . . 0.0 109.114 -176.708 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 23.2 t -70.22 -52.32 24.07 Favored 'General case' 0 N--CA 1.497 1.91 0 C-N-CA 119.977 -0.689 . . . . 0.0 110.618 -176.653 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 22.5 m -60.42 -40.69 91.91 Favored 'General case' 0 N--CA 1.502 2.171 0 O-C-N 121.654 -0.654 . . . . 0.0 110.798 -174.993 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 29.8 m120 -104.0 -10.09 18.35 Favored 'General case' 0 N--CA 1.497 1.914 0 O-C-N 121.578 -0.701 . . . . 0.0 111.601 -177.266 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 7.7 m 49.54 67.22 0.93 Allowed 'General case' 0 N--CA 1.508 2.441 0 O-C-N 121.114 -0.991 . . . . 0.0 110.886 -174.606 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 34' ' ' ILE . . . . . 1.028 HD12 HG22 ' A' ' 48' ' ' VAL . 44.7 mm -121.41 125.9 74.23 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.001 0 O-C-N 121.603 -0.686 . . . . 0.0 109.329 -175.886 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.445 HD12 ' O ' ' A' ' 27' ' ' ASN . 15.8 tp -116.19 118.91 34.12 Favored 'General case' 0 N--CA 1.494 1.743 0 O-C-N 121.617 -0.677 . . . . 0.0 110.537 -171.088 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 92.1 mt-30 -91.35 131.24 36.97 Favored 'General case' 0 N--CA 1.491 1.624 0 N-CA-C 109.391 -0.596 . . . . 0.0 109.391 171.299 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . 0.475 HD23 ' HA ' ' A' ' 25' ' ' ILE . 44.6 mt -117.81 123.54 46.2 Favored 'General case' 0 N--CA 1.494 1.764 0 O-C-N 121.752 -0.592 . . . . 0.0 110.15 176.41 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 38' ' ' ARG . . . . . 0.622 ' HG3' HG21 ' A' ' 26' ' ' THR . 66.0 mtt-85 -103.18 106.59 17.14 Favored 'General case' 0 N--CA 1.498 1.942 0 O-C-N 121.688 -0.632 . . . . 0.0 110.246 171.583 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . 0.451 HD13 ' HA2' ' A' ' 23' ' ' GLY . 56.9 tp -83.53 151.76 25.24 Favored 'General case' 0 N--CA 1.497 1.925 0 O-C-N 121.527 -0.733 . . . . 0.0 110.488 -178.256 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -68.69 -2.95 10.37 Favored 'General case' 0 N--CA 1.503 2.202 0 O-C-N 121.722 -0.611 . . . . 0.0 112.172 -170.641 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 91.4 m-20 -87.89 28.83 0.98 Allowed 'General case' 0 N--CA 1.498 1.938 0 O-C-N 121.033 -1.042 . . . . 0.0 110.74 174.769 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 6.3 t70 64.99 28.8 12.46 Favored 'General case' 0 N--CA 1.506 2.326 0 O-C-N 121.205 -0.934 . . . . 0.0 110.397 175.771 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 67.2 m -123.97 139.72 53.67 Favored 'General case' 0 N--CA 1.495 1.777 0 O-C-N 121.449 -0.782 . . . . 0.0 110.035 177.869 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 7.6 t -128.16 147.1 50.54 Favored 'General case' 0 N--CA 1.496 1.861 0 O-C-N 121.736 -0.603 . . . . 0.0 109.939 179.486 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . 0.544 ' HE3' HD11 ' A' ' 47' ' ' ILE . 21.8 ttpt -152.25 132.4 13.54 Favored 'General case' 0 N--CA 1.496 1.869 0 C-N-CA 120.1 -0.64 . . . . 0.0 110.686 -177.526 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 86.9 p -95.27 124.33 39.25 Favored 'General case' 0 N--CA 1.495 1.779 0 O-C-N 121.75 -0.594 . . . . 0.0 110.108 177.574 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 47' ' ' ILE . . . . . 0.544 HD11 ' HE3' ' A' ' 45' ' ' LYS . 77.8 mt -129.25 134.94 62.97 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.855 0 O-C-N 121.651 -0.655 . . . . 0.0 109.333 179.724 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 48' ' ' VAL . . . . . 1.028 HG22 HD12 ' A' ' 34' ' ' ILE . 64.2 t -81.78 127.67 39.39 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.916 0 N-CA-C 109.074 -0.713 . . . . 0.0 109.074 177.646 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 49' ' ' THR . . . . . 0.435 HG21 ' HE1' ' A' ' 28' ' ' PHE . 61.0 p -58.03 -24.96 60.41 Favored 'General case' 0 N--CA 1.506 2.365 0 O-C-N 121.49 -0.756 . . . . 0.0 111.872 -167.763 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 33.5 tttp -56.65 -24.8 50.95 Favored 'General case' 0 N--CA 1.503 2.196 0 O-C-N 121.444 -0.785 . . . . 0.0 111.014 -177.228 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 46.3 p30 -84.06 3.28 35.31 Favored 'General case' 0 N--CA 1.499 1.992 0 C-N-CA 119.725 -0.79 . . . . 0.0 111.363 176.691 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 52' ' ' ILE . . . . . 0.427 HG21 HD11 ' A' ' 55' ' ' LEU . 98.9 mt -75.2 124.38 32.94 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.104 0 O-C-N 121.185 -0.947 . . . . 0.0 109.926 177.976 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 74.7 tttt -93.26 -28.59 16.15 Favored 'General case' 0 N--CA 1.495 1.786 0 O-C-N 121.81 -0.556 . . . . 0.0 109.959 171.227 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 5.0 m-20 -163.3 153.58 15.89 Favored 'General case' 0 N--CA 1.499 2.02 0 O-C-N 121.707 -0.62 . . . . 0.0 110.068 -178.094 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . 0.534 ' CD2' HG22 ' A' ' 13' ' ' VAL . 83.8 mt -132.96 148.8 52.27 Favored 'General case' 0 N--CA 1.497 1.902 0 O-C-N 121.681 -0.637 . . . . 0.0 110.512 -178.535 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 20.2 ptp180 -151.97 145.19 24.66 Favored 'General case' 0 N--CA 1.495 1.799 0 O-C-N 121.7 -0.625 . . . . 0.0 110.123 175.152 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 57' ' ' ILE . . . . . 0.529 ' HA ' HG12 ' A' ' 11' ' ' VAL . 67.1 mt -85.84 133.48 29.5 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.822 0 O-C-N 121.539 -0.726 . . . . 0.0 109.765 172.405 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . 0.402 HD11 ' HB2' ' A' ' 22' ' ' ARG . 30.5 mt . . . . . 0 N--CA 1.497 1.898 0 O-C-N 121.446 -0.784 . . . . 0.0 109.802 -177.215 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 257' ' ' SER . . . . . . . . . . . . . 50.0 m . . . . . 0 N--CA 1.503 2.224 0 CA-C-O 121.268 0.556 . . . . 0.0 110.518 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' B' B ' 258' ' ' SER . . . . . . . . . . . . . 23.4 t -68.23 -33.04 73.66 Favored 'General case' 0 N--CA 1.499 2.0 0 C-N-CA 120.463 -0.495 . . . . 0.0 110.242 -179.814 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 259' ' ' GLN . . . . . . . . . . . . . 78.3 mt-30 -64.65 -34.91 79.4 Favored 'General case' 0 N--CA 1.5 2.031 0 O-C-N 121.665 -0.647 . . . . 0.0 110.37 179.717 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 260' ' ' LEU . . . . . 0.525 ' HA ' HD12 ' B' ' 263' ' ' LEU . 85.7 mt -65.66 -42.6 91.17 Favored 'General case' 0 N--CA 1.501 2.082 0 O-C-N 121.728 -0.608 . . . . 0.0 110.259 179.288 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 261' ' ' LEU . . . . . . . . . . . . . 22.5 tp -69.79 -36.91 76.1 Favored 'General case' 0 N--CA 1.498 1.943 0 C-N-CA 120.175 -0.61 . . . . 0.0 109.73 176.391 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 262' ' ' SER . . . . . . . . . . . . . 22.8 t -62.33 -36.4 82.08 Favored 'General case' 0 N--CA 1.5 2.07 0 O-C-N 121.756 -0.59 . . . . 0.0 110.516 177.198 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 263' ' ' LEU . . . . . 0.525 HD12 ' HA ' ' B' ' 260' ' ' LEU . 18.2 mt . . . . . 0 N--CA 1.501 2.076 0 O-C-N 121.654 -0.654 . . . . 0.0 110.154 179.764 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 70.3 m . . . . . 0 N--CA 1.494 1.733 0 CA-C-O 120.936 0.398 . . . . 0.0 110.124 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 3' ' ' VAL . . . . . 0.453 HG12 ' CE1' ' A' ' 7' ' ' TYR . 65.7 t -66.33 -27.81 41.64 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.131 0 O-C-N 121.792 -0.568 . . . . 0.0 110.249 -179.771 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -55.14 -30.94 60.85 Favored 'General case' 0 N--CA 1.505 2.292 0 O-C-N 121.462 -0.774 . . . . 0.0 110.449 -178.671 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 9.7 m-20 -68.66 -30.87 69.66 Favored 'General case' 0 N--CA 1.499 2.024 0 O-C-N 121.88 -0.513 . . . . 0.0 110.24 174.789 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 96.5 m-85 -95.84 10.1 38.28 Favored 'General case' 0 N--CA 1.497 1.921 0 O-C-N 121.679 -0.638 . . . . 0.0 111.449 -178.398 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 7' ' ' TYR . . . . . 0.453 ' CE1' HG12 ' A' ' 3' ' ' VAL . 3.7 m-30 -67.16 141.81 57.24 Favored 'General case' 0 N--CA 1.501 2.105 0 O-C-N 121.147 -0.971 . . . . 0.0 110.112 174.966 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 8' ' ' GLY . . . . . 0.431 ' O ' HG13 ' A' ' 24' ' ' VAL . . . 82.95 -1.39 88.66 Favored Glycine 0 N--CA 1.498 2.776 0 N-CA-C 110.745 -0.942 . . . . 0.0 110.745 -177.056 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . 0.521 ' OG ' HD12 ' A' ' 25' ' ' ILE . 88.5 p -77.34 141.01 40.09 Favored 'General case' 0 N--CA 1.498 1.972 0 O-C-N 121.125 -1.221 . . . . 0.0 110.509 -179.454 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 10' ' ' ASN . . . . . 0.679 ' CG ' HG22 ' A' ' 24' ' ' VAL . 2.5 m120 -85.16 118.53 24.78 Favored 'General case' 0 N--CA 1.498 1.943 0 O-C-N 121.669 -0.644 . . . . 0.0 109.646 174.323 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . 0.668 HG21 HD11 ' A' ' 25' ' ' ILE . 35.8 m -143.12 160.94 17.6 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.796 0 O-C-N 121.732 -0.605 . . . . 0.0 109.76 -178.746 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 12' ' ' GLU . . . . . 0.588 ' HB2' HD11 ' A' ' 58' ' ' LEU . 44.6 tt0 -109.43 125.36 52.34 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.575 -0.703 . . . . 0.0 110.16 178.142 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 13' ' ' VAL . . . . . 0.591 HG22 ' CD2' ' A' ' 55' ' ' LEU . 59.6 t -106.87 123.17 61.74 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.839 0 O-C-N 121.565 -0.709 . . . . 0.0 109.946 -177.629 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . 0.438 HD13 ' HD3' ' A' ' 20' ' ' LYS . 27.6 tp -96.2 128.95 43.58 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.726 -0.609 . . . . 0.0 109.636 175.222 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 82.8 mt -99.04 167.16 10.9 Favored 'General case' 0 N--CA 1.497 1.922 0 O-C-N 121.609 -0.682 . . . . 0.0 110.97 -171.799 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 9.5 p30 -57.77 -22.11 45.23 Favored 'General case' 0 N--CA 1.505 2.294 0 O-C-N 121.76 -0.587 . . . . 0.0 111.39 -179.961 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 24.6 p30 -90.03 21.3 3.75 Favored 'General case' 0 N--CA 1.5 2.063 0 O-C-N 121.59 -0.694 . . . . 0.0 111.163 -177.721 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 74.4 m-20 59.87 28.8 18.35 Favored 'General case' 0 N--CA 1.506 2.36 0 O-C-N 121.339 -0.851 . . . . 0.0 110.813 172.675 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 18.0 m -111.66 133.94 53.57 Favored 'General case' 0 N--CA 1.494 1.769 0 O-C-N 121.494 -0.754 . . . . 0.0 109.573 170.617 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . 0.438 ' HD3' HD13 ' A' ' 14' ' ' LEU . 5.3 ttpm? -109.84 142.15 41.52 Favored 'General case' 0 N--CA 1.494 1.731 0 O-C-N 121.647 -0.658 . . . . 0.0 110.523 -177.114 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -152.99 160.27 43.0 Favored 'General case' 0 N--CA 1.496 1.828 0 O-C-N 121.773 -0.579 . . . . 0.0 110.09 179.562 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . 0.496 ' O ' HD13 ' A' ' 39' ' ' LEU . 30.9 ptt180 -140.28 148.57 41.63 Favored 'General case' 0 N--CA 1.497 1.916 0 O-C-N 121.622 -0.674 . . . . 0.0 110.8 -178.844 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -171.71 171.44 44.08 Favored Glycine 0 N--CA 1.495 2.617 0 N-CA-C 108.701 -1.759 . . . . 0.0 108.701 -176.332 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . 0.679 HG22 ' CG ' ' A' ' 10' ' ' ASN . 39.0 t -94.6 118.84 41.6 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.925 0 O-C-N 121.462 -1.022 . . . . 0.0 109.314 -175.913 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 25' ' ' ILE . . . . . 0.668 HD11 HG21 ' A' ' 11' ' ' VAL . 95.3 mt -63.95 143.41 15.7 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.142 0 O-C-N 121.665 -0.647 . . . . 0.0 110.333 -172.073 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 26' ' ' THR . . . . . 0.623 HG21 ' HB2' ' A' ' 38' ' ' ARG . 7.5 p -121.25 -27.01 4.95 Favored 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.721 -0.612 . . . . 0.0 111.336 -179.887 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 27' ' ' ASN . . . . . 0.528 ' O ' HD12 ' A' ' 35' ' ' LEU . 27.2 t30 -162.03 160.67 27.84 Favored 'General case' 0 N--CA 1.499 1.991 0 C-N-CA 119.002 -1.079 . . . . 0.0 111.814 -179.109 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 28' ' ' PHE . . . . . 0.553 ' HE1' HG21 ' A' ' 49' ' ' THR . 83.3 t80 -150.19 126.73 10.86 Favored 'General case' 0 N--CA 1.497 1.901 0 N-CA-C 108.964 -0.754 . . . . 0.0 108.964 170.599 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 21.3 t70 -99.73 130.51 45.95 Favored 'General case' 0 N--CA 1.491 1.597 0 N-CA-C 108.955 -0.757 . . . . 0.0 108.955 -177.431 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 20.1 m -70.31 -51.68 28.4 Favored 'General case' 0 N--CA 1.498 1.946 0 C-N-CA 119.999 -0.681 . . . . 0.0 110.394 -176.9 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 23.1 m -60.07 -41.25 92.02 Favored 'General case' 0 N--CA 1.502 2.17 0 O-C-N 121.619 -0.676 . . . . 0.0 110.829 -174.967 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 29.8 m120 -103.91 -10.14 18.4 Favored 'General case' 0 N--CA 1.496 1.87 0 O-C-N 121.624 -0.673 . . . . 0.0 111.613 -177.662 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 1.8 m 49.91 67.34 0.92 Allowed 'General case' 0 N--CA 1.509 2.51 0 O-C-N 121.098 -1.001 . . . . 0.0 111.07 -175.776 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 34' ' ' ILE . . . . . 1.128 HD12 HG22 ' A' ' 48' ' ' VAL . 47.4 mm -126.69 127.03 69.76 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.167 0 O-C-N 121.597 -0.689 . . . . 0.0 109.479 -176.066 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.528 HD12 ' O ' ' A' ' 27' ' ' ASN . 11.7 tp -115.88 121.61 42.87 Favored 'General case' 0 N--CA 1.494 1.765 0 O-C-N 121.708 -0.62 . . . . 0.0 110.521 -170.432 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 79.5 mt-30 -91.61 134.19 34.9 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.829 -0.544 . . . . 0.0 109.539 173.83 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . 0.409 HD23 ' HA ' ' A' ' 25' ' ' ILE . 13.9 mt -117.82 123.81 46.83 Favored 'General case' 0 N--CA 1.493 1.725 0 O-C-N 121.798 -0.564 . . . . 0.0 109.989 174.52 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 38' ' ' ARG . . . . . 0.623 ' HB2' HG21 ' A' ' 26' ' ' THR . 56.6 ttt85 -98.42 107.69 20.2 Favored 'General case' 0 N--CA 1.497 1.878 0 O-C-N 121.63 -0.669 . . . . 0.0 109.756 175.986 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . 0.496 HD13 ' O ' ' A' ' 22' ' ' ARG . 18.9 tp -85.1 150.75 24.63 Favored 'General case' 0 N--CA 1.495 1.797 0 O-C-N 121.697 -0.627 . . . . 0.0 110.993 -173.933 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -63.15 -9.17 9.83 Favored 'General case' 0 N--CA 1.503 2.184 0 O-C-N 121.922 -0.486 . . . . 0.0 111.962 -173.223 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 37.7 t30 -85.01 29.08 0.66 Allowed 'General case' 0 N--CA 1.499 2.018 0 O-C-N 121.146 -0.971 . . . . 0.0 110.952 174.202 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 74.4 m-20 59.67 31.81 21.1 Favored 'General case' 0 N--CA 1.504 2.27 0 O-C-N 121.257 -0.902 . . . . 0.0 110.428 174.176 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 48.9 m -123.92 137.78 54.58 Favored 'General case' 0 N--CA 1.496 1.859 0 O-C-N 121.394 -0.816 . . . . 0.0 110.374 178.836 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 9.0 t -97.55 150.21 21.35 Favored 'General case' 0 N--CA 1.497 1.906 0 O-C-N 121.735 -0.603 . . . . 0.0 110.212 176.244 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 42.1 tttp -149.81 119.16 6.85 Favored 'General case' 0 N--CA 1.496 1.861 0 O-C-N 121.662 -0.649 . . . . 0.0 110.255 178.466 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 90.3 p -96.07 122.63 39.12 Favored 'General case' 0 N--CA 1.495 1.807 0 O-C-N 121.676 -0.64 . . . . 0.0 110.21 178.431 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 82.5 mt -129.27 135.68 61.24 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.845 0 O-C-N 121.565 -0.709 . . . . 0.0 109.328 179.835 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 48' ' ' VAL . . . . . 1.128 HG22 HD12 ' A' ' 34' ' ' ILE . 58.7 t -81.95 127.57 39.5 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.902 0 O-C-N 121.531 -0.731 . . . . 0.0 109.232 179.56 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 49' ' ' THR . . . . . 0.553 HG21 ' HE1' ' A' ' 28' ' ' PHE . 37.4 p -59.41 -24.81 63.78 Favored 'General case' 0 N--CA 1.504 2.273 0 O-C-N 121.659 -0.651 . . . . 0.0 112.055 -170.101 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 73.5 tttt -56.23 -22.78 31.62 Favored 'General case' 0 N--CA 1.503 2.183 0 O-C-N 121.401 -0.812 . . . . 0.0 111.1 -177.161 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 51.4 p30 -83.8 0.92 45.42 Favored 'General case' 0 N--CA 1.499 1.985 0 O-C-N 121.443 -0.786 . . . . 0.0 111.358 176.369 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 96.3 mt -75.99 127.76 37.36 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.089 0 O-C-N 121.162 -0.961 . . . . 0.0 110.084 178.72 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 75.0 tttt -91.76 -32.39 15.41 Favored 'General case' 0 N--CA 1.493 1.711 0 N-CA-C 109.443 -0.577 . . . . 0.0 109.443 169.901 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -161.47 157.29 24.79 Favored 'General case' 0 N--CA 1.497 1.898 0 O-C-N 121.723 -0.611 . . . . 0.0 109.815 -177.037 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . 0.591 ' CD2' HG22 ' A' ' 13' ' ' VAL . 85.2 mt -132.92 148.55 52.28 Favored 'General case' 0 N--CA 1.497 1.904 0 O-C-N 121.65 -0.656 . . . . 0.0 110.462 -179.851 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 6.5 ptm180 -150.76 139.6 20.85 Favored 'General case' 0 N--CA 1.495 1.782 0 O-C-N 121.765 -0.584 . . . . 0.0 109.94 176.335 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 57' ' ' ILE . . . . . 0.471 ' HA ' HG12 ' A' ' 11' ' ' VAL . 67.7 mt -84.98 133.26 29.73 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.872 0 O-C-N 121.522 -0.736 . . . . 0.0 109.671 174.079 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . 0.588 HD11 ' HB2' ' A' ' 12' ' ' GLU . 45.1 mt . . . . . 0 N--CA 1.498 1.952 0 O-C-N 121.566 -0.709 . . . . 0.0 110.255 -178.462 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 257' ' ' SER . . . . . . . . . . . . . 6.6 t . . . . . 0 N--CA 1.503 2.198 0 CA-C-O 121.324 0.583 . . . . 0.0 110.421 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' B' B ' 258' ' ' SER . . . . . . . . . . . . . 24.8 m -68.09 -32.53 72.91 Favored 'General case' 0 N--CA 1.497 1.908 0 O-C-N 121.864 -0.522 . . . . 0.0 110.239 179.983 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 259' ' ' GLN . . . . . . . . . . . . . 78.1 mt-30 -64.64 -35.03 79.71 Favored 'General case' 0 N--CA 1.5 2.028 0 O-C-N 121.593 -0.692 . . . . 0.0 110.367 179.782 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 260' ' ' LEU . . . . . 0.544 ' HA ' HD12 ' B' ' 263' ' ' LEU . 51.4 mt -65.52 -43.4 90.17 Favored 'General case' 0 N--CA 1.501 2.082 0 O-C-N 121.67 -0.644 . . . . 0.0 110.281 179.045 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 261' ' ' LEU . . . . . . . . . . . . . 21.5 tp -71.05 -36.94 72.5 Favored 'General case' 0 N--CA 1.498 1.932 0 C-N-CA 120.088 -0.645 . . . . 0.0 109.586 174.97 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 262' ' ' SER . . . . . . . . . . . . . 22.6 t -62.25 -35.69 79.73 Favored 'General case' 0 N--CA 1.501 2.09 0 O-C-N 121.714 -0.616 . . . . 0.0 110.438 175.893 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 263' ' ' LEU . . . . . 0.544 HD12 ' HA ' ' B' ' 260' ' ' LEU . 16.2 mt . . . . . 0 N--CA 1.5 2.068 0 O-C-N 121.683 -0.635 . . . . 0.0 110.242 179.433 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 66.2 m . . . . . 0 N--CA 1.495 1.786 0 CA-C-O 121.046 0.451 . . . . 0.0 110.181 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 3' ' ' VAL . . . . . 0.472 HG12 ' CE1' ' A' ' 7' ' ' TYR . 69.5 t -66.46 -27.82 41.51 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.048 0 O-C-N 121.652 -0.655 . . . . 0.0 110.254 -179.265 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -55.17 -31.27 61.23 Favored 'General case' 0 N--CA 1.504 2.273 0 O-C-N 121.499 -0.751 . . . . 0.0 110.42 -178.891 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 74.5 m-20 -68.63 -31.33 70.4 Favored 'General case' 0 N--CA 1.499 1.99 0 O-C-N 121.883 -0.511 . . . . 0.0 110.131 174.714 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 87.4 m-85 -95.59 10.05 38.07 Favored 'General case' 0 N--CA 1.497 1.887 0 O-C-N 121.641 -0.662 . . . . 0.0 111.398 -179.573 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 7' ' ' TYR . . . . . 0.472 ' CE1' HG12 ' A' ' 3' ' ' VAL . 3.1 m-30 -67.24 144.05 56.16 Favored 'General case' 0 N--CA 1.502 2.128 0 O-C-N 121.154 -0.966 . . . . 0.0 110.042 175.52 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 8' ' ' GLY . . . . . 0.429 ' O ' HG13 ' A' ' 24' ' ' VAL . . . 82.06 0.71 89.88 Favored Glycine 0 N--CA 1.497 2.717 0 N-CA-C 110.483 -1.047 . . . . 0.0 110.483 -175.766 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . 0.478 ' OG ' HD12 ' A' ' 25' ' ' ILE . 89.2 p -77.75 141.04 39.52 Favored 'General case' 0 N--CA 1.497 1.889 0 O-C-N 121.079 -1.248 . . . . 0.0 110.514 -178.851 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 10' ' ' ASN . . . . . 0.699 ' CG ' HG22 ' A' ' 24' ' ' VAL . 2.6 m120 -85.08 120.2 26.32 Favored 'General case' 0 N--CA 1.497 1.92 0 O-C-N 121.665 -0.647 . . . . 0.0 109.495 173.532 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . 0.71 HG21 HD11 ' A' ' 25' ' ' ILE . 35.5 m -143.5 162.93 16.21 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.78 0 O-C-N 121.715 -0.616 . . . . 0.0 109.566 -178.838 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 12' ' ' GLU . . . . . 0.463 ' HB2' HD11 ' A' ' 58' ' ' LEU . 33.3 tt0 -109.4 127.87 54.7 Favored 'General case' 0 N--CA 1.494 1.729 0 C-N-CA 119.896 -0.722 . . . . 0.0 109.952 177.539 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 13' ' ' VAL . . . . . 0.592 HG22 ' CD2' ' A' ' 55' ' ' LEU . 60.5 t -106.92 124.1 62.4 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.863 0 O-C-N 121.673 -0.642 . . . . 0.0 109.808 -179.67 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 15.4 tp -96.03 125.96 40.94 Favored 'General case' 0 N--CA 1.494 1.749 0 O-C-N 121.761 -0.587 . . . . 0.0 109.47 175.144 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 83.1 mt -97.44 163.17 12.99 Favored 'General case' 0 N--CA 1.498 1.937 0 O-C-N 121.553 -0.717 . . . . 0.0 111.054 -172.594 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 24.9 p30 -59.21 -21.64 59.81 Favored 'General case' 0 N--CA 1.505 2.294 0 O-C-N 121.722 -0.611 . . . . 0.0 111.489 -177.961 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 25.5 p30 -92.19 23.52 3.79 Favored 'General case' 0 N--CA 1.498 1.959 0 O-C-N 121.532 -0.73 . . . . 0.0 110.977 -176.571 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 74.4 m-20 60.18 28.63 18.22 Favored 'General case' 0 N--CA 1.504 2.265 0 O-C-N 121.414 -0.804 . . . . 0.0 110.836 173.07 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 43.2 m -107.99 134.94 50.18 Favored 'General case' 0 N--CA 1.495 1.793 0 O-C-N 121.491 -0.755 . . . . 0.0 109.567 170.395 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 37.4 ttmt -109.64 137.73 47.04 Favored 'General case' 0 N--CA 1.494 1.761 0 O-C-N 121.756 -0.59 . . . . 0.0 110.345 -176.137 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -153.05 158.86 42.58 Favored 'General case' 0 N--CA 1.496 1.836 0 O-C-N 121.686 -0.634 . . . . 0.0 110.498 -179.782 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . 0.49 ' O ' HD13 ' A' ' 39' ' ' LEU . 42.9 ptt85 -144.02 150.88 38.92 Favored 'General case' 0 N--CA 1.496 1.836 0 O-C-N 121.683 -0.635 . . . . 0.0 110.5 178.838 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -171.64 171.42 44.06 Favored Glycine 0 N--CA 1.494 2.535 0 N-CA-C 108.872 -1.691 . . . . 0.0 108.872 -174.493 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . 0.699 HG22 ' CG ' ' A' ' 10' ' ' ASN . 38.5 t -94.49 117.17 37.58 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.933 0 O-C-N 121.522 -0.987 . . . . 0.0 109.402 -176.519 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 25' ' ' ILE . . . . . 0.71 HD11 HG21 ' A' ' 11' ' ' VAL . 92.0 mt -63.93 143.16 15.94 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.154 0 O-C-N 121.642 -0.661 . . . . 0.0 110.397 -172.157 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 26' ' ' THR . . . . . 0.607 HG21 ' HB2' ' A' ' 38' ' ' ARG . 7.8 p -121.21 -26.76 5.01 Favored 'General case' 0 N--CA 1.495 1.785 0 O-C-N 121.685 -0.634 . . . . 0.0 111.245 -179.669 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 7.6 t30 -161.94 156.9 23.01 Favored 'General case' 0 N--CA 1.5 2.051 0 C-N-CA 118.88 -1.128 . . . . 0.0 111.726 -178.17 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 28' ' ' PHE . . . . . 0.528 ' CE1' HG21 ' A' ' 49' ' ' THR . 62.8 t80 -150.07 123.56 9.07 Favored 'General case' 0 N--CA 1.498 1.949 0 N-CA-C 109.373 -0.602 . . . . 0.0 109.373 170.433 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 17.8 t70 -99.3 127.06 45.26 Favored 'General case' 0 N--CA 1.492 1.638 0 N-CA-C 109.162 -0.681 . . . . 0.0 109.162 -178.541 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 22.6 t -64.68 -43.53 93.23 Favored 'General case' 0 N--CA 1.5 2.044 0 O-C-N 121.72 -0.612 . . . . 0.0 110.907 -174.709 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 21.1 m -59.7 -48.09 83.06 Favored 'General case' 0 N--CA 1.502 2.166 0 O-C-N 121.539 -0.726 . . . . 0.0 110.984 -173.444 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 91.5 m-20 -106.99 -0.31 23.15 Favored 'General case' 0 N--CA 1.498 1.966 0 O-C-N 121.613 -0.679 . . . . 0.0 111.675 -179.364 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 45.2 p 45.26 67.02 0.78 Allowed 'General case' 0 N--CA 1.507 2.391 0 O-C-N 121.494 -0.754 . . . . 0.0 111.212 -174.986 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 34' ' ' ILE . . . . . 0.976 HD12 HG22 ' A' ' 48' ' ' VAL . 41.3 mm -114.48 125.86 71.88 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.963 0 O-C-N 121.629 -0.669 . . . . 0.0 109.213 -176.047 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 10.2 tp -115.75 118.84 34.16 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.604 -0.685 . . . . 0.0 110.416 -169.554 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 99.3 mt-30 -91.38 133.13 35.72 Favored 'General case' 0 N--CA 1.49 1.528 0 N-CA-C 109.381 -0.6 . . . . 0.0 109.381 173.731 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 14.6 mt -117.88 123.8 46.76 Favored 'General case' 0 N--CA 1.494 1.753 0 O-C-N 121.837 -0.539 . . . . 0.0 109.945 175.107 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 38' ' ' ARG . . . . . 0.607 ' HB2' HG21 ' A' ' 26' ' ' THR . 72.5 ttt180 -97.36 105.01 17.08 Favored 'General case' 0 N--CA 1.495 1.813 0 O-C-N 121.672 -0.643 . . . . 0.0 109.783 176.001 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . 0.49 HD13 ' O ' ' A' ' 22' ' ' ARG . 22.0 tp -85.16 154.3 22.1 Favored 'General case' 0 N--CA 1.494 1.765 0 O-C-N 121.716 -0.615 . . . . 0.0 111.075 -173.624 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -65.54 -6.48 10.94 Favored 'General case' 0 N--CA 1.503 2.179 0 O-C-N 121.955 -0.466 . . . . 0.0 112.149 -169.961 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 49.4 p-10 -86.17 29.15 0.76 Allowed 'General case' 0 N--CA 1.5 2.064 0 O-C-N 121.12 -0.987 . . . . 0.0 110.873 174.199 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 74.3 m-20 57.65 29.68 17.66 Favored 'General case' 0 N--CA 1.504 2.24 0 O-C-N 121.252 -0.905 . . . . 0.0 110.36 177.126 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 37.8 m -120.62 137.87 54.2 Favored 'General case' 0 N--CA 1.496 1.852 0 O-C-N 121.458 -0.776 . . . . 0.0 110.397 178.996 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 9.7 t -97.47 150.99 20.45 Favored 'General case' 0 N--CA 1.497 1.878 0 O-C-N 121.76 -0.588 . . . . 0.0 110.222 176.46 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 40.9 tttp -148.61 119.14 7.42 Favored 'General case' 0 N--CA 1.497 1.886 0 O-C-N 121.591 -0.693 . . . . 0.0 110.269 178.05 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 91.0 p -96.59 122.12 39.16 Favored 'General case' 0 N--CA 1.494 1.736 0 O-C-N 121.635 -0.666 . . . . 0.0 110.284 179.027 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 82.8 mt -129.32 133.94 64.65 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.909 0 O-C-N 121.628 -0.67 . . . . 0.0 109.422 178.974 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 48' ' ' VAL . . . . . 0.976 HG22 HD12 ' A' ' 34' ' ' ILE . 60.3 t -82.0 127.9 39.2 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.959 0 C-N-CA 120.103 -0.639 . . . . 0.0 109.404 179.41 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 49' ' ' THR . . . . . 0.528 HG21 ' CE1' ' A' ' 28' ' ' PHE . 37.5 p -57.86 -24.83 59.35 Favored 'General case' 0 N--CA 1.505 2.3 0 O-C-N 121.734 -0.604 . . . . 0.0 112.281 -165.869 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 16.6 pttp -56.14 -22.47 28.74 Favored 'General case' 0 N--CA 1.506 2.337 0 O-C-N 121.515 -0.741 . . . . 0.0 111.238 -176.016 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 10.3 p30 -82.01 -1.06 47.0 Favored 'General case' 0 N--CA 1.5 2.046 0 C-N-CA 119.889 -0.724 . . . . 0.0 111.194 176.398 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 89.6 mt -77.37 130.24 36.48 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.082 0 O-C-N 121.223 -0.923 . . . . 0.0 110.129 177.812 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 40.4 tttp -91.53 -31.73 15.83 Favored 'General case' 0 N--CA 1.494 1.766 0 O-C-N 121.772 -0.58 . . . . 0.0 109.496 168.778 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 5.3 m-20 -164.27 159.64 20.19 Favored 'General case' 0 N--CA 1.5 2.052 0 O-C-N 121.832 -0.542 . . . . 0.0 110.063 -177.869 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . 0.592 ' CD2' HG22 ' A' ' 13' ' ' VAL . 83.1 mt -132.99 150.21 52.18 Favored 'General case' 0 N--CA 1.495 1.802 0 O-C-N 121.752 -0.592 . . . . 0.0 110.395 -179.44 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 19.9 ptp180 -150.39 141.39 22.96 Favored 'General case' 0 N--CA 1.495 1.803 0 O-C-N 121.7 -0.625 . . . . 0.0 109.998 175.336 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 57' ' ' ILE . . . . . 0.507 ' HA ' HG12 ' A' ' 11' ' ' VAL . 67.0 mt -85.15 133.21 29.89 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.822 0 O-C-N 121.541 -0.724 . . . . 0.0 109.884 173.702 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . 0.463 HD11 ' HB2' ' A' ' 12' ' ' GLU . 25.2 mt . . . . . 0 N--CA 1.497 1.901 0 O-C-N 121.652 -0.655 . . . . 0.0 110.095 -179.337 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 257' ' ' SER . . . . . . . . . . . . . 44.9 t . . . . . 0 N--CA 1.502 2.16 0 CA-C-O 121.264 0.554 . . . . 0.0 110.563 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' B' B ' 258' ' ' SER . . . . . . . . . . . . . 83.9 p -69.54 -30.76 68.66 Favored 'General case' 0 N--CA 1.498 1.945 0 C-N-CA 120.359 -0.536 . . . . 0.0 110.295 -178.724 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 259' ' ' GLN . . . . . . . . . . . . . 46.4 tt0 -63.25 -37.81 88.7 Favored 'General case' 0 N--CA 1.501 2.091 0 O-C-N 121.614 -0.679 . . . . 0.0 110.378 179.373 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 260' ' ' LEU . . . . . 0.504 ' HA ' HD12 ' B' ' 263' ' ' LEU . 83.3 mt -66.09 -42.45 89.28 Favored 'General case' 0 N--CA 1.5 2.041 0 O-C-N 121.67 -0.644 . . . . 0.0 110.249 179.627 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 261' ' ' LEU . . . . . 0.436 HD12 HD12 ' A' ' 55' ' ' LEU . 22.5 tp -70.32 -38.14 74.84 Favored 'General case' 0 N--CA 1.497 1.921 0 O-C-N 121.679 -0.638 . . . . 0.0 109.772 176.292 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 262' ' ' SER . . . . . . . . . . . . . 69.7 m -62.51 -35.87 80.75 Favored 'General case' 0 N--CA 1.501 2.097 0 O-C-N 121.767 -0.583 . . . . 0.0 110.533 176.916 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 263' ' ' LEU . . . . . 0.504 HD12 ' HA ' ' B' ' 260' ' ' LEU . 21.4 mt . . . . . 0 N--CA 1.501 2.116 0 O-C-N 121.602 -0.686 . . . . 0.0 110.235 -179.822 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 68.4 m . . . . . 0 N--CA 1.495 1.782 0 CA-C-O 121.049 0.452 . . . . 0.0 110.256 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 3' ' ' VAL . . . . . 0.437 HG12 ' CE1' ' A' ' 7' ' ' TYR . 67.3 t -66.45 -27.78 41.4 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.085 0 O-C-N 121.676 -0.64 . . . . 0.0 110.379 -178.98 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -54.91 -30.67 58.9 Favored 'General case' 0 N--CA 1.505 2.296 0 O-C-N 121.451 -0.781 . . . . 0.0 110.538 -177.906 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 74.5 m-20 -69.01 -30.55 68.95 Favored 'General case' 0 N--CA 1.499 1.982 0 O-C-N 121.827 -0.546 . . . . 0.0 110.321 175.018 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 97.2 m-85 -95.49 10.12 37.64 Favored 'General case' 0 N--CA 1.497 1.898 0 O-C-N 121.628 -0.67 . . . . 0.0 111.512 -178.208 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 7' ' ' TYR . . . . . 0.437 ' CE1' HG12 ' A' ' 3' ' ' VAL . 3.8 m-30 -67.18 140.25 57.46 Favored 'General case' 0 N--CA 1.502 2.156 0 O-C-N 121.158 -0.964 . . . . 0.0 110.134 174.735 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 83.15 -2.04 87.66 Favored Glycine 0 N--CA 1.498 2.79 0 N-CA-C 110.67 -0.972 . . . . 0.0 110.67 -176.118 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 67.1 m -75.31 140.95 43.43 Favored 'General case' 0 N--CA 1.497 1.902 0 O-C-N 121.11 -1.229 . . . . 0.0 110.554 -179.536 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 10' ' ' ASN . . . . . 0.695 ' OD1' HG22 ' A' ' 24' ' ' VAL . 4.3 m-80 -85.63 117.82 24.76 Favored 'General case' 0 N--CA 1.497 1.893 0 N-CA-C 109.492 -0.558 . . . . 0.0 109.492 173.525 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . 0.48 HG12 ' HA ' ' A' ' 57' ' ' ILE . 35.3 m -142.55 162.32 18.52 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.889 0 O-C-N 121.675 -0.641 . . . . 0.0 109.746 179.591 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 12' ' ' GLU . . . . . 0.617 ' HB2' HD11 ' A' ' 58' ' ' LEU . 45.3 tt0 -109.41 129.98 55.52 Favored 'General case' 0 N--CA 1.492 1.65 0 C-N-CA 119.851 -0.74 . . . . 0.0 109.887 176.069 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 13' ' ' VAL . . . . . 0.566 HG22 ' CD2' ' A' ' 55' ' ' LEU . 60.3 t -106.74 125.58 62.67 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.714 0 O-C-N 121.725 -0.61 . . . . 0.0 109.831 179.731 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . 0.473 HD13 ' HG2' ' A' ' 20' ' ' LYS . 28.6 tp -95.82 126.28 40.97 Favored 'General case' 0 N--CA 1.493 1.707 0 N-CA-C 109.128 -0.693 . . . . 0.0 109.128 175.225 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 87.1 mt -95.85 168.05 10.88 Favored 'General case' 0 N--CA 1.496 1.839 0 O-C-N 121.689 -0.632 . . . . 0.0 111.087 -172.989 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 24.3 p30 -58.15 -21.86 48.77 Favored 'General case' 0 N--CA 1.507 2.39 0 O-C-N 121.835 -0.54 . . . . 0.0 111.583 -176.896 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 44.0 p-10 -92.2 22.79 4.19 Favored 'General case' 0 N--CA 1.498 1.973 0 O-C-N 121.561 -0.712 . . . . 0.0 110.968 -176.636 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 74.3 m-20 58.75 27.52 16.08 Favored 'General case' 0 N--CA 1.505 2.298 0 O-C-N 121.364 -0.835 . . . . 0.0 110.662 175.77 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 51.1 m -106.86 142.01 37.17 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.473 -0.767 . . . . 0.0 109.568 172.645 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . 0.473 ' HG2' HD13 ' A' ' 14' ' ' LEU . 94.6 mttt -109.62 146.42 34.78 Favored 'General case' 0 N--CA 1.496 1.83 0 O-C-N 121.611 -0.681 . . . . 0.0 110.646 -176.183 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -153.11 151.16 29.86 Favored 'General case' 0 N--CA 1.497 1.877 0 O-C-N 121.825 -0.547 . . . . 0.0 109.991 175.277 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . 0.489 ' O ' HD13 ' A' ' 39' ' ' LEU . 31.0 ptt180 -140.02 146.17 38.69 Favored 'General case' 0 N--CA 1.499 2.001 0 O-C-N 121.568 -0.707 . . . . 0.0 110.654 -179.853 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -171.77 171.49 44.13 Favored Glycine 0 N--CA 1.495 2.609 0 N-CA-C 108.768 -1.733 . . . . 0.0 108.768 -174.378 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . 0.695 HG22 ' OD1' ' A' ' 10' ' ' ASN . 25.2 t -94.55 120.1 43.48 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.907 0 O-C-N 121.49 -1.006 . . . . 0.0 109.34 -176.119 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 25' ' ' ILE . . . . . 0.458 HD11 HG21 ' A' ' 11' ' ' VAL . 87.2 mt -63.45 143.33 15.72 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.24 0 O-C-N 121.479 -0.763 . . . . 0.0 110.462 -172.729 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 26' ' ' THR . . . . . 0.624 HG21 ' HB2' ' A' ' 38' ' ' ARG . 6.7 p -121.15 -28.73 4.67 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.671 -0.643 . . . . 0.0 111.329 179.079 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 26.9 t30 -161.97 158.78 25.67 Favored 'General case' 0 N--CA 1.499 2.004 0 O-C-N 120.985 -1.072 . . . . 0.0 111.661 -177.095 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 28' ' ' PHE . . . . . 0.519 ' HE1' HG21 ' A' ' 49' ' ' THR . 84.3 t80 -150.08 126.86 11.03 Favored 'General case' 0 N--CA 1.497 1.882 0 N-CA-C 109.132 -0.692 . . . . 0.0 109.132 170.78 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 21.3 t70 -100.53 130.92 46.67 Favored 'General case' 0 N--CA 1.491 1.581 0 N-CA-C 109.04 -0.726 . . . . 0.0 109.04 -176.772 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 20.9 m -69.29 -49.99 50.87 Favored 'General case' 0 N--CA 1.498 1.946 0 C-N-CA 120.062 -0.655 . . . . 0.0 110.504 -176.679 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 22.6 m -59.76 -42.72 93.88 Favored 'General case' 0 N--CA 1.502 2.135 0 O-C-N 121.648 -0.658 . . . . 0.0 110.84 -174.478 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 29.6 m120 -103.71 -10.1 18.61 Favored 'General case' 0 N--CA 1.496 1.873 0 O-C-N 121.667 -0.646 . . . . 0.0 111.553 -178.069 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 1.8 m 49.88 67.38 0.91 Allowed 'General case' 0 N--CA 1.507 2.424 0 O-C-N 121.103 -0.998 . . . . 0.0 110.87 -174.795 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 34' ' ' ILE . . . . . 1.106 HD12 HG22 ' A' ' 48' ' ' VAL . 47.4 mm -125.43 126.86 71.25 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.006 0 O-C-N 121.557 -0.715 . . . . 0.0 109.469 -176.061 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.422 HD12 ' HB2' ' A' ' 28' ' ' PHE . 6.7 tp -115.85 120.03 37.93 Favored 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.678 -0.639 . . . . 0.0 110.335 -169.237 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 99.5 mt-30 -90.98 134.68 34.29 Favored 'General case' 0 N--CA 1.492 1.63 0 C-N-CA 120.268 -0.573 . . . . 0.0 109.477 175.386 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . 0.442 HD23 ' HA ' ' A' ' 25' ' ' ILE . 17.2 mt -117.82 123.87 46.98 Favored 'General case' 0 N--CA 1.495 1.781 0 O-C-N 121.854 -0.529 . . . . 0.0 110.023 174.818 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 38' ' ' ARG . . . . . 0.624 ' HB2' HG21 ' A' ' 26' ' ' THR . 74.9 ttt-85 -97.26 108.5 21.25 Favored 'General case' 0 N--CA 1.497 1.88 0 O-C-N 121.756 -0.59 . . . . 0.0 109.778 175.215 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . 0.489 HD13 ' O ' ' A' ' 22' ' ' ARG . 17.8 tp -85.28 151.67 23.88 Favored 'General case' 0 N--CA 1.495 1.797 0 O-C-N 121.703 -0.623 . . . . 0.0 110.981 -174.206 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -62.99 -9.25 9.31 Favored 'General case' 0 N--CA 1.503 2.193 0 O-C-N 121.965 -0.459 . . . . 0.0 111.895 -172.668 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 30.1 m120 -85.38 29.05 0.69 Allowed 'General case' 0 N--CA 1.499 1.981 0 O-C-N 121.086 -1.009 . . . . 0.0 110.95 174.33 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 74.4 m-20 59.33 31.15 20.92 Favored 'General case' 0 N--CA 1.505 2.302 0 O-C-N 121.136 -0.978 . . . . 0.0 110.366 174.378 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 48.7 m -122.81 137.93 54.79 Favored 'General case' 0 N--CA 1.495 1.795 0 O-C-N 121.42 -0.8 . . . . 0.0 110.395 179.121 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 9.0 t -97.19 149.41 22.04 Favored 'General case' 0 N--CA 1.498 1.949 0 O-C-N 121.814 -0.554 . . . . 0.0 110.233 176.77 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 74.7 tttt -149.89 119.2 6.83 Favored 'General case' 0 N--CA 1.494 1.755 0 O-C-N 121.602 -0.687 . . . . 0.0 110.255 178.515 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 88.7 p -95.0 123.97 38.78 Favored 'General case' 0 N--CA 1.496 1.828 0 O-C-N 121.694 -0.629 . . . . 0.0 110.175 179.214 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 82.4 mt -129.32 134.47 63.71 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.9 0 N-CA-C 109.246 -0.649 . . . . 0.0 109.246 -179.967 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 48' ' ' VAL . . . . . 1.106 HG22 HD12 ' A' ' 34' ' ' ILE . 63.1 t -82.11 127.59 39.49 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.891 0 O-C-N 121.574 -0.704 . . . . 0.0 109.268 179.668 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 49' ' ' THR . . . . . 0.519 HG21 ' HE1' ' A' ' 28' ' ' PHE . 38.6 p -59.97 -24.93 64.82 Favored 'General case' 0 N--CA 1.503 2.216 0 O-C-N 121.592 -0.692 . . . . 0.0 112.065 -171.141 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 80.8 mttt -56.82 -25.29 55.65 Favored 'General case' 0 N--CA 1.502 2.174 0 O-C-N 121.445 -0.784 . . . . 0.0 111.03 -176.405 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 6.3 p30 -84.62 5.2 28.91 Favored 'General case' 0 N--CA 1.498 1.947 0 C-N-CA 119.726 -0.79 . . . . 0.0 111.441 176.318 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 98.6 mt -75.56 127.94 37.12 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.146 0 O-C-N 121.136 -0.977 . . . . 0.0 109.92 175.972 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 40.0 tttp -91.92 -32.76 15.15 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.782 -0.573 . . . . 0.0 109.528 168.942 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -161.46 156.82 24.12 Favored 'General case' 0 N--CA 1.499 1.977 0 O-C-N 121.76 -0.587 . . . . 0.0 109.958 -176.936 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . 0.566 ' CD2' HG22 ' A' ' 13' ' ' VAL . 86.2 mt -133.05 150.09 52.14 Favored 'General case' 0 N--CA 1.497 1.922 0 O-C-N 121.639 -0.663 . . . . 0.0 110.517 -179.425 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 20.1 ptp180 -151.86 142.85 23.09 Favored 'General case' 0 N--CA 1.495 1.81 0 O-C-N 121.741 -0.599 . . . . 0.0 110.065 175.518 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 57' ' ' ILE . . . . . 0.48 ' HA ' HG12 ' A' ' 11' ' ' VAL . 66.5 mt -86.49 133.19 30.41 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.912 0 O-C-N 121.558 -0.714 . . . . 0.0 109.835 173.428 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . 0.617 HD11 ' HB2' ' A' ' 12' ' ' GLU . 50.8 mt . . . . . 0 N--CA 1.497 1.924 0 O-C-N 121.583 -0.698 . . . . 0.0 110.091 179.41 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 257' ' ' SER . . . . . . . . . . . . . 43.2 t . . . . . 0 N--CA 1.503 2.195 0 CA-C-O 121.258 0.552 . . . . 0.0 110.499 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' B' B ' 258' ' ' SER . . . . . . . . . . . . . 25.2 m -68.89 -30.87 69.45 Favored 'General case' 0 N--CA 1.498 1.968 0 C-N-CA 120.436 -0.506 . . . . 0.0 110.389 -179.769 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 259' ' ' GLN . . . . . . . . . . . . . 48.9 tt0 -63.56 -39.98 95.81 Favored 'General case' 0 N--CA 1.501 2.108 0 O-C-N 121.589 -0.694 . . . . 0.0 110.43 -179.903 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 260' ' ' LEU . . . . . 0.513 ' HA ' HD12 ' B' ' 263' ' ' LEU . 83.7 mt -67.37 -43.53 81.18 Favored 'General case' 0 N--CA 1.5 2.055 0 O-C-N 121.609 -0.682 . . . . 0.0 110.247 -179.661 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 261' ' ' LEU . . . . . . . . . . . . . 17.1 tp -70.38 -36.77 74.33 Favored 'General case' 0 N--CA 1.498 1.962 0 O-C-N 121.634 -0.666 . . . . 0.0 109.629 177.078 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 262' ' ' SER . . . . . . . . . . . . . 22.8 t -62.79 -35.84 81.2 Favored 'General case' 0 N--CA 1.501 2.076 0 O-C-N 121.776 -0.578 . . . . 0.0 110.565 176.671 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 263' ' ' LEU . . . . . 0.513 HD12 ' HA ' ' B' ' 260' ' ' LEU . 19.9 mt . . . . . 0 N--CA 1.501 2.078 0 O-C-N 121.598 -0.689 . . . . 0.0 110.247 -179.331 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 65.5 m . . . . . 0 N--CA 1.494 1.77 0 CA-C-O 120.956 0.408 . . . . 0.0 109.976 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 3' ' ' VAL . . . . . 0.466 HG12 ' CE1' ' A' ' 7' ' ' TYR . 69.3 t -66.81 -27.82 41.09 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.082 0 O-C-N 121.596 -0.69 . . . . 0.0 110.097 179.823 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -55.21 -30.62 60.33 Favored 'General case' 0 N--CA 1.504 2.25 0 O-C-N 121.401 -0.812 . . . . 0.0 110.313 179.711 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -68.17 -31.48 71.06 Favored 'General case' 0 N--CA 1.498 1.948 0 O-C-N 121.847 -0.533 . . . . 0.0 110.151 174.533 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 88.2 m-85 -95.73 9.53 40.08 Favored 'General case' 0 N--CA 1.497 1.888 0 O-C-N 121.711 -0.618 . . . . 0.0 111.342 179.869 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 7' ' ' TYR . . . . . 0.466 ' CE1' HG12 ' A' ' 3' ' ' VAL . 3.5 m-30 -67.3 142.15 56.94 Favored 'General case' 0 N--CA 1.501 2.123 0 O-C-N 121.181 -0.949 . . . . 0.0 110.113 174.324 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 8' ' ' GLY . . . . . 0.425 ' O ' HG13 ' A' ' 24' ' ' VAL . . . 82.45 -0.2 89.32 Favored Glycine 0 N--CA 1.498 2.769 0 N-CA-C 110.648 -0.981 . . . . 0.0 110.648 -176.746 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . 0.554 ' OG ' HD12 ' A' ' 25' ' ' ILE . 84.5 p -77.4 137.37 38.68 Favored 'General case' 0 N--CA 1.497 1.909 0 O-C-N 121.081 -1.247 . . . . 0.0 110.478 179.32 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 12.1 t-20 -84.05 119.09 24.54 Favored 'General case' 0 N--CA 1.497 1.923 0 O-C-N 121.644 -0.66 . . . . 0.0 109.45 172.944 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . 0.576 HG12 ' HA ' ' A' ' 57' ' ' ILE . 35.6 m -142.64 164.0 17.39 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.63 0 O-C-N 121.829 -0.545 . . . . 0.0 109.541 -179.166 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 12' ' ' GLU . . . . . 0.434 ' HB2' HD11 ' A' ' 58' ' ' LEU . 35.6 tt0 -109.32 129.13 55.53 Favored 'General case' 0 N--CA 1.493 1.687 0 C-N-CA 119.929 -0.708 . . . . 0.0 109.916 177.183 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 13' ' ' VAL . . . . . 0.46 HG22 HD23 ' A' ' 55' ' ' LEU . 61.4 t -106.69 127.92 61.78 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.713 0 O-C-N 121.581 -0.7 . . . . 0.0 109.818 179.763 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 29.9 tp -95.94 128.33 42.74 Favored 'General case' 0 N--CA 1.493 1.718 0 N-CA-C 109.26 -0.644 . . . . 0.0 109.26 176.511 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 86.1 mt -95.02 160.94 14.34 Favored 'General case' 0 N--CA 1.495 1.813 0 O-C-N 121.615 -0.678 . . . . 0.0 111.015 -173.687 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 24.3 p30 -58.05 -21.87 47.56 Favored 'General case' 0 N--CA 1.506 2.343 0 O-C-N 121.819 -0.55 . . . . 0.0 111.571 -178.166 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 38.3 p-10 -93.28 24.02 4.1 Favored 'General case' 0 N--CA 1.497 1.923 0 O-C-N 121.507 -0.745 . . . . 0.0 110.782 -177.378 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 74.2 m-20 59.24 27.88 17.04 Favored 'General case' 0 N--CA 1.505 2.311 0 O-C-N 121.437 -0.789 . . . . 0.0 110.661 175.812 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 50.8 m -103.65 142.3 34.55 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.551 -0.718 . . . . 0.0 109.517 172.182 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 96.5 mttt -109.6 142.75 40.28 Favored 'General case' 0 N--CA 1.494 1.77 0 O-C-N 121.633 -0.667 . . . . 0.0 110.581 -175.806 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -153.07 152.82 31.77 Favored 'General case' 0 N--CA 1.497 1.897 0 O-C-N 121.725 -0.609 . . . . 0.0 110.304 176.376 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . 0.508 ' O ' HD13 ' A' ' 39' ' ' LEU . 32.9 ptt180 -144.08 149.13 36.11 Favored 'General case' 0 N--CA 1.498 1.951 0 O-C-N 121.691 -0.631 . . . . 0.0 110.519 177.574 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -171.77 171.46 44.11 Favored Glycine 0 N--CA 1.496 2.656 0 N-CA-C 108.954 -1.658 . . . . 0.0 108.954 -176.365 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . 0.425 HG13 ' O ' ' A' ' 8' ' ' GLY . 46.7 t -94.62 119.32 42.44 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.909 0 O-C-N 121.444 -1.033 . . . . 0.0 109.298 -177.27 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 25' ' ' ILE . . . . . 0.644 ' HA ' HD23 ' A' ' 37' ' ' LEU . 95.8 mt -64.39 143.59 15.56 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.179 0 O-C-N 121.69 -0.631 . . . . 0.0 110.601 -171.312 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 26' ' ' THR . . . . . 0.603 HG21 ' HB2' ' A' ' 38' ' ' ARG . 7.9 p -121.17 -26.91 5.0 Favored 'General case' 0 N--CA 1.494 1.758 0 O-C-N 121.779 -0.575 . . . . 0.0 111.258 178.988 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 27' ' ' ASN . . . . . 0.478 ' O ' HD12 ' A' ' 35' ' ' LEU . 6.4 t30 -161.9 159.25 26.5 Favored 'General case' 0 N--CA 1.499 2.02 0 C-N-CA 118.969 -1.092 . . . . 0.0 111.671 -179.08 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 28' ' ' PHE . . . . . 0.523 ' HE1' HG21 ' A' ' 49' ' ' THR . 75.6 t80 -150.13 125.93 10.42 Favored 'General case' 0 N--CA 1.497 1.876 0 N-CA-C 109.089 -0.708 . . . . 0.0 109.089 170.478 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 17.9 t70 -99.64 130.61 45.88 Favored 'General case' 0 N--CA 1.491 1.605 0 N-CA-C 108.981 -0.748 . . . . 0.0 108.981 -177.395 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 34.7 m -69.64 -50.94 39.46 Favored 'General case' 0 N--CA 1.498 1.944 0 C-N-CA 120.01 -0.676 . . . . 0.0 110.534 -176.349 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 5.4 t -59.58 -42.74 93.21 Favored 'General case' 0 N--CA 1.502 2.138 0 O-C-N 121.477 -0.764 . . . . 0.0 110.791 -174.818 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 28.6 m120 -103.27 -10.06 19.03 Favored 'General case' 0 N--CA 1.497 1.893 0 O-C-N 121.573 -0.705 . . . . 0.0 111.446 -177.416 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 1.8 m 49.72 67.29 0.92 Allowed 'General case' 0 N--CA 1.507 2.407 0 O-C-N 121.054 -1.029 . . . . 0.0 111.08 -175.202 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 34' ' ' ILE . . . . . 1.13 HD12 HG22 ' A' ' 48' ' ' VAL . 47.6 mm -124.91 126.19 70.9 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.092 0 O-C-N 121.595 -0.691 . . . . 0.0 109.438 -175.899 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.478 HD12 ' O ' ' A' ' 27' ' ' ASN . 11.5 tp -115.86 121.07 41.28 Favored 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.596 -0.69 . . . . 0.0 110.622 -169.897 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 58.1 mt-30 -91.78 133.83 35.28 Favored 'General case' 0 N--CA 1.491 1.618 0 N-CA-C 109.435 -0.58 . . . . 0.0 109.435 173.49 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . 0.644 HD23 ' HA ' ' A' ' 25' ' ' ILE . 90.5 mt -117.96 123.8 46.66 Favored 'General case' 0 N--CA 1.497 1.884 0 O-C-N 121.801 -0.562 . . . . 0.0 109.921 174.963 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 38' ' ' ARG . . . . . 0.603 ' HB2' HG21 ' A' ' 26' ' ' THR . 64.9 ttt180 -96.07 105.06 17.05 Favored 'General case' 0 N--CA 1.497 1.877 0 O-C-N 121.682 -0.636 . . . . 0.0 109.777 175.99 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . 0.508 HD13 ' O ' ' A' ' 22' ' ' ARG . 20.1 tp -85.0 155.31 21.62 Favored 'General case' 0 N--CA 1.495 1.791 0 O-C-N 121.701 -0.624 . . . . 0.0 110.951 -173.692 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -68.63 -2.99 10.31 Favored 'General case' 0 N--CA 1.503 2.178 0 O-C-N 121.943 -0.473 . . . . 0.0 112.203 -169.494 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 43.3 p-10 -86.91 25.78 1.25 Allowed 'General case' 0 N--CA 1.499 1.994 0 O-C-N 121.004 -1.06 . . . . 0.0 110.853 173.637 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 7.8 t70 61.74 28.07 17.25 Favored 'General case' 0 N--CA 1.504 2.267 0 O-C-N 121.115 -0.991 . . . . 0.0 110.484 178.717 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 36.7 m -120.54 137.93 54.13 Favored 'General case' 0 N--CA 1.496 1.87 0 O-C-N 121.396 -0.815 . . . . 0.0 110.431 -179.893 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 8.7 t -97.86 151.01 20.67 Favored 'General case' 0 N--CA 1.496 1.864 0 O-C-N 121.719 -0.613 . . . . 0.0 110.172 175.98 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 70.3 tttt -149.44 119.13 7.0 Favored 'General case' 0 N--CA 1.496 1.847 0 O-C-N 121.612 -0.68 . . . . 0.0 110.27 178.762 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 88.4 p -95.71 122.8 38.88 Favored 'General case' 0 N--CA 1.495 1.801 0 O-C-N 121.713 -0.617 . . . . 0.0 110.208 179.057 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 81.7 mt -129.39 136.48 59.27 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.813 0 O-C-N 121.584 -0.697 . . . . 0.0 109.385 179.64 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 48' ' ' VAL . . . . . 1.13 HG22 HD12 ' A' ' 34' ' ' ILE . 57.8 t -81.8 127.53 39.52 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.896 0 N-CA-C 109.1 -0.704 . . . . 0.0 109.1 178.276 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 49' ' ' THR . . . . . 0.523 HG21 ' HE1' ' A' ' 28' ' ' PHE . 42.2 p -59.49 -25.74 64.7 Favored 'General case' 0 N--CA 1.504 2.229 0 O-C-N 121.558 -0.714 . . . . 0.0 112.071 -169.029 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 19.2 tptm -57.93 -23.39 53.3 Favored 'General case' 0 N--CA 1.502 2.154 0 O-C-N 121.512 -0.742 . . . . 0.0 111.346 -174.95 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 9.8 p30 -80.95 -4.32 54.61 Favored 'General case' 0 N--CA 1.499 2.02 0 C-N-CA 119.734 -0.786 . . . . 0.0 110.993 176.135 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 52' ' ' ILE . . . . . 0.794 HG21 HD11 ' A' ' 55' ' ' LEU . 85.5 mt -80.57 135.58 24.98 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.056 0 O-C-N 121.209 -0.932 . . . . 0.0 110.127 178.329 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 62.0 tttt -91.32 -30.66 16.45 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.84 -0.537 . . . . 0.0 109.62 169.567 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 54' ' ' ASP . . . . . 0.404 ' HA ' HD13 ' B' ' 261' ' ' LEU . 1.7 m-20 -165.31 159.97 17.78 Favored 'General case' 0 N--CA 1.502 2.156 0 O-C-N 121.833 -0.542 . . . . 0.0 110.505 -176.53 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . 0.794 HD11 HG21 ' A' ' 52' ' ' ILE . 4.4 mp -132.96 157.37 45.34 Favored 'General case' 0 N--CA 1.496 1.845 0 O-C-N 121.726 -0.609 . . . . 0.0 110.227 177.179 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 7.9 ptm180 -150.61 146.58 26.61 Favored 'General case' 0 N--CA 1.495 1.813 0 O-C-N 121.634 -0.666 . . . . 0.0 109.672 174.538 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 57' ' ' ILE . . . . . 0.576 ' HA ' HG12 ' A' ' 11' ' ' VAL . 55.9 mt -86.04 133.31 29.96 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.876 0 O-C-N 121.508 -0.745 . . . . 0.0 109.952 175.49 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . 0.434 HD11 ' HB2' ' A' ' 12' ' ' GLU . 79.2 mt . . . . . 0 N--CA 1.498 1.942 0 O-C-N 121.589 -0.695 . . . . 0.0 110.076 -178.932 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 257' ' ' SER . . . . . . . . . . . . . 24.2 m . . . . . 0 N--CA 1.503 2.204 0 CA-C-O 121.181 0.515 . . . . 0.0 110.521 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' B' B ' 258' ' ' SER . . . . . . . . . . . . . 22.7 t -69.46 -38.25 77.66 Favored 'General case' 0 N--CA 1.498 1.925 0 C-N-CA 120.481 -0.487 . . . . 0.0 110.317 -179.04 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 259' ' ' GLN . . . . . . . . . . . . . 88.7 mm-40 -64.73 -35.44 81.07 Favored 'General case' 0 N--CA 1.501 2.087 0 O-C-N 121.6 -0.687 . . . . 0.0 110.407 -179.748 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 260' ' ' LEU . . . . . . . . . . . . . 83.6 mt -67.56 -38.62 84.38 Favored 'General case' 0 N--CA 1.498 1.971 0 O-C-N 121.639 -0.663 . . . . 0.0 110.27 179.269 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 261' ' ' LEU . . . . . 0.61 HD13 HD12 ' A' ' 55' ' ' LEU . 47.9 tp -67.99 -39.89 83.19 Favored 'General case' 0 N--CA 1.498 1.957 0 O-C-N 121.57 -0.706 . . . . 0.0 109.994 178.668 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 262' ' ' SER . . . . . . . . . . . . . 21.0 m -63.18 -40.65 98.14 Favored 'General case' 0 N--CA 1.5 2.072 0 O-C-N 121.695 -0.628 . . . . 0.0 110.488 177.323 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 263' ' ' LEU . . . . . . . . . . . . . 51.5 mt . . . . . 0 N--CA 1.501 2.083 0 O-C-N 121.715 -0.615 . . . . 0.0 110.23 179.327 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 70.5 m . . . . . 0 N--CA 1.494 1.768 0 CA-C-O 120.945 0.402 . . . . 0.0 110.067 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 3' ' ' VAL . . . . . 0.43 HG11 ' CB ' ' A' ' 28' ' ' PHE . 51.0 t -64.7 -28.33 44.56 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.207 0 O-C-N 121.625 -0.672 . . . . 0.0 110.245 -179.283 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -56.09 -32.55 64.26 Favored 'General case' 0 N--CA 1.503 2.215 0 O-C-N 121.479 -0.763 . . . . 0.0 110.35 179.609 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 9.7 m-20 -68.8 -35.63 77.25 Favored 'General case' 0 N--CA 1.498 1.958 0 O-C-N 121.862 -0.524 . . . . 0.0 109.932 175.725 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 6' ' ' PHE . . . . . 0.402 ' CD1' HD21 ' B' ' 260' ' ' LEU . 97.0 m-85 -97.94 10.08 41.17 Favored 'General case' 0 N--CA 1.497 1.891 0 O-C-N 121.723 -0.611 . . . . 0.0 111.24 178.904 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -67.51 128.2 35.56 Favored 'General case' 0 N--CA 1.5 2.047 0 O-C-N 121.294 -0.879 . . . . 0.0 109.927 179.134 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 8' ' ' GLY . . . . . 0.466 ' O ' HG13 ' A' ' 24' ' ' VAL . . . 82.27 -0.33 88.99 Favored Glycine 0 N--CA 1.496 2.694 0 N-CA-C 110.616 -0.994 . . . . 0.0 110.616 -174.976 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 32.0 t -77.17 137.69 39.03 Favored 'General case' 0 N--CA 1.498 1.93 0 O-C-N 121.144 -1.21 . . . . 0.0 110.432 177.599 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 14.6 t-20 -83.96 119.23 24.65 Favored 'General case' 0 N--CA 1.498 1.953 0 O-C-N 121.671 -0.643 . . . . 0.0 109.782 174.642 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . 0.521 HG12 ' HA ' ' A' ' 57' ' ' ILE . 34.6 m -143.01 161.83 17.54 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.811 0 N-CA-C 109.567 -0.531 . . . . 0.0 109.567 -179.854 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 12' ' ' GLU . . . . . 0.451 ' HB2' HD11 ' A' ' 58' ' ' LEU . 35.4 tt0 -109.41 129.59 55.54 Favored 'General case' 0 N--CA 1.493 1.685 0 C-N-CA 119.87 -0.732 . . . . 0.0 110.126 178.448 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 13' ' ' VAL . . . . . 0.562 HG22 ' CD2' ' A' ' 55' ' ' LEU . 58.9 t -106.74 127.65 62.08 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.772 0 O-C-N 121.68 -0.638 . . . . 0.0 109.827 -179.402 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 28.5 tp -95.86 126.05 40.85 Favored 'General case' 0 N--CA 1.494 1.746 0 N-CA-C 109.077 -0.712 . . . . 0.0 109.077 174.485 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 86.7 mt -96.01 166.93 11.53 Favored 'General case' 0 N--CA 1.495 1.794 0 C-N-CA 120.087 -0.645 . . . . 0.0 111.166 -172.496 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 24.1 p30 -58.4 -21.82 51.82 Favored 'General case' 0 N--CA 1.505 2.323 0 O-C-N 121.82 -0.55 . . . . 0.0 111.668 -177.029 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 42.5 p-10 -92.73 23.45 4.11 Favored 'General case' 0 N--CA 1.498 1.966 0 O-C-N 121.576 -0.703 . . . . 0.0 110.811 -176.041 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 74.4 m-20 58.85 27.29 15.93 Favored 'General case' 0 N--CA 1.507 2.379 0 O-C-N 121.558 -0.714 . . . . 0.0 110.608 175.805 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 50.5 m -106.96 145.44 32.25 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.526 -0.734 . . . . 0.0 109.575 172.831 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 98.1 mttt -109.61 147.72 32.55 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.59 -0.694 . . . . 0.0 110.571 -176.345 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -153.08 153.97 33.91 Favored 'General case' 0 N--CA 1.497 1.911 0 O-C-N 121.796 -0.565 . . . . 0.0 110.254 176.204 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 33.0 ptt180 -142.69 150.35 40.04 Favored 'General case' 0 N--CA 1.496 1.842 0 O-C-N 121.648 -0.658 . . . . 0.0 110.308 178.364 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . 0.425 ' HA2' HD13 ' A' ' 39' ' ' LEU . . . -171.9 171.17 43.98 Favored Glycine 0 N--CA 1.492 2.429 0 N-CA-C 109.167 -1.573 . . . . 0.0 109.167 -179.871 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . 0.466 HG13 ' O ' ' A' ' 8' ' ' GLY . 45.2 t -94.61 126.65 46.99 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.88 0 O-C-N 121.7 -0.882 . . . . 0.0 109.237 176.363 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 25' ' ' ILE . . . . . 0.468 ' HA ' HD23 ' A' ' 37' ' ' LEU . 47.7 mt -61.73 138.0 22.94 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.249 0 O-C-N 121.57 -0.706 . . . . 0.0 110.854 -170.373 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 26' ' ' THR . . . . . 0.671 HG21 ' HB2' ' A' ' 38' ' ' ARG . 13.2 p -121.24 -19.65 7.0 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.9 -0.5 . . . . 0.0 111.515 -179.937 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 33.0 t30 -165.98 158.18 14.47 Favored 'General case' 0 N--CA 1.504 2.25 0 O-C-N 120.826 -1.172 . . . . 0.0 111.922 176.221 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 28' ' ' PHE . . . . . 0.43 ' CB ' HG11 ' A' ' 3' ' ' VAL . 65.0 t80 -150.3 120.7 7.37 Favored 'General case' 0 N--CA 1.495 1.818 0 N-CA-C 109.166 -0.679 . . . . 0.0 109.166 173.431 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 17.9 t70 -97.81 127.42 43.75 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.593 -0.692 . . . . 0.0 109.212 -177.713 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 22.1 m -66.41 -46.53 76.24 Favored 'General case' 0 N--CA 1.499 2.0 0 O-C-N 121.524 -0.735 . . . . 0.0 110.772 -175.174 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 21.1 m -58.92 -47.36 85.3 Favored 'General case' 0 N--CA 1.502 2.174 0 O-C-N 121.602 -0.686 . . . . 0.0 110.957 -173.796 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 92.4 m-20 -106.29 -3.22 21.45 Favored 'General case' 0 N--CA 1.497 1.889 0 O-C-N 121.536 -0.727 . . . . 0.0 111.711 -178.188 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 15.3 m 49.14 67.15 0.92 Allowed 'General case' 0 N--CA 1.507 2.419 0 O-C-N 121.049 -1.032 . . . . 0.0 110.907 -174.314 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 34' ' ' ILE . . . . . 1.067 HD12 HG22 ' A' ' 48' ' ' VAL . 43.7 mm -114.64 125.78 72.04 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.936 0 O-C-N 121.545 -0.722 . . . . 0.0 109.21 -175.55 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 14.5 tp -115.98 119.03 34.6 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.609 -0.682 . . . . 0.0 110.47 -169.858 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 55.4 mt-30 -91.04 131.94 36.32 Favored 'General case' 0 N--CA 1.491 1.593 0 N-CA-C 109.182 -0.673 . . . . 0.0 109.182 170.838 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . 0.468 HD23 ' HA ' ' A' ' 25' ' ' ILE . 49.4 mt -117.73 123.49 46.17 Favored 'General case' 0 N--CA 1.493 1.707 0 C-N-CA 120.177 -0.609 . . . . 0.0 110.041 175.926 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 38' ' ' ARG . . . . . 0.671 ' HB2' HG21 ' A' ' 26' ' ' THR . 57.2 ttt85 -105.0 104.95 14.78 Favored 'General case' 0 N--CA 1.495 1.782 0 O-C-N 121.77 -0.582 . . . . 0.0 110.076 173.877 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . 0.425 HD13 ' HA2' ' A' ' 23' ' ' GLY . 65.3 tp -83.29 157.23 22.71 Favored 'General case' 0 N--CA 1.497 1.923 0 O-C-N 121.626 -0.671 . . . . 0.0 110.669 -176.344 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -67.89 -2.94 8.28 Favored 'General case' 0 N--CA 1.503 2.193 0 O-C-N 121.823 -0.548 . . . . 0.0 112.208 -170.819 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 29.9 m120 -86.63 29.21 0.8 Allowed 'General case' 0 N--CA 1.498 1.971 0 O-C-N 121.05 -1.031 . . . . 0.0 110.789 173.591 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 73.7 m-20 60.33 31.47 20.42 Favored 'General case' 0 N--CA 1.506 2.334 0 O-C-N 121.164 -0.96 . . . . 0.0 110.258 175.699 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 68.1 m -126.05 144.72 50.61 Favored 'General case' 0 N--CA 1.494 1.755 0 O-C-N 121.477 -0.765 . . . . 0.0 110.112 177.873 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 9.8 t -128.17 147.82 50.58 Favored 'General case' 0 N--CA 1.496 1.828 0 O-C-N 121.653 -0.654 . . . . 0.0 109.919 179.604 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . 0.778 ' HE2' HD11 ' A' ' 47' ' ' ILE . 6.0 ttpm? -150.38 130.04 13.15 Favored 'General case' 0 N--CA 1.495 1.82 0 O-C-N 121.716 -0.615 . . . . 0.0 110.505 -177.369 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 88.5 p -95.89 123.47 39.49 Favored 'General case' 0 N--CA 1.494 1.77 0 O-C-N 121.683 -0.635 . . . . 0.0 110.396 179.748 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 47' ' ' ILE . . . . . 0.778 HD11 ' HE2' ' A' ' 45' ' ' LYS . 80.6 mt -129.31 138.25 54.86 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.889 0 N-CA-C 109.19 -0.67 . . . . 0.0 109.19 177.647 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 48' ' ' VAL . . . . . 1.067 HG22 HD12 ' A' ' 34' ' ' ILE . 67.9 t -82.05 127.65 39.43 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.876 0 O-C-N 121.6 -0.687 . . . . 0.0 109.183 177.766 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 47.3 p -58.13 -24.92 60.59 Favored 'General case' 0 N--CA 1.505 2.283 0 O-C-N 121.539 -0.726 . . . . 0.0 111.964 -169.142 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 31.5 tttp -56.92 -26.87 60.17 Favored 'General case' 0 N--CA 1.502 2.131 0 O-C-N 121.529 -0.732 . . . . 0.0 110.963 -177.08 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 4.7 p30 -85.21 7.37 22.23 Favored 'General case' 0 N--CA 1.499 1.99 0 C-N-CA 119.677 -0.809 . . . . 0.0 111.353 176.538 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 98.2 mt -75.04 125.59 34.78 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.111 0 O-C-N 121.119 -0.988 . . . . 0.0 109.878 175.186 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 50.4 tttm -92.16 -31.34 15.52 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.812 -0.555 . . . . 0.0 109.718 170.68 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 54' ' ' ASP . . . . . 0.405 ' HA ' HD22 ' B' ' 261' ' ' LEU . 1.0 OUTLIER -161.11 153.38 20.17 Favored 'General case' 0 N--CA 1.499 1.991 0 O-C-N 121.699 -0.626 . . . . 0.0 110.072 -176.418 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . 0.562 ' CD2' HG22 ' A' ' 13' ' ' VAL . 85.2 mt -132.92 149.92 52.2 Favored 'General case' 0 N--CA 1.497 1.925 0 O-C-N 121.745 -0.597 . . . . 0.0 110.523 -179.311 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 4.9 ptm180 -152.27 140.86 20.79 Favored 'General case' 0 N--CA 1.496 1.869 0 O-C-N 121.783 -0.573 . . . . 0.0 109.856 175.118 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 57' ' ' ILE . . . . . 0.521 ' HA ' HG12 ' A' ' 11' ' ' VAL . 59.3 mt -85.28 133.3 29.73 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.863 0 O-C-N 121.428 -0.795 . . . . 0.0 109.856 174.667 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . 0.451 HD11 ' HB2' ' A' ' 12' ' ' GLU . 83.1 mt . . . . . 0 N--CA 1.498 1.942 0 O-C-N 121.631 -0.668 . . . . 0.0 110.051 -179.09 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 257' ' ' SER . . . . . . . . . . . . . 49.0 m . . . . . 0 N--CA 1.503 2.21 0 CA-C-O 121.3 0.572 . . . . 0.0 110.482 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' B' B ' 258' ' ' SER . . . . . . . . . . . . . 25.1 m -69.29 -31.79 70.52 Favored 'General case' 0 N--CA 1.497 1.892 0 O-C-N 121.864 -0.523 . . . . 0.0 110.351 -179.937 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 259' ' ' GLN . . . . . . . . . . . . . 58.2 tp60 -62.65 -40.04 95.78 Favored 'General case' 0 N--CA 1.501 2.1 0 O-C-N 121.601 -0.687 . . . . 0.0 110.494 -178.665 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 260' ' ' LEU . . . . . 0.488 ' HA ' HD12 ' B' ' 263' ' ' LEU . 82.8 mt -68.83 -43.04 76.36 Favored 'General case' 0 N--CA 1.499 1.996 0 O-C-N 121.691 -0.631 . . . . 0.0 110.293 179.958 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 261' ' ' LEU . . . . . 0.405 HD22 ' HA ' ' A' ' 54' ' ' ASP . 17.6 tp -69.24 -36.22 76.94 Favored 'General case' 0 N--CA 1.498 1.941 0 O-C-N 121.586 -0.696 . . . . 0.0 109.768 177.87 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 262' ' ' SER . . . . . . . . . . . . . 22.7 t -62.33 -37.33 85.22 Favored 'General case' 0 N--CA 1.501 2.105 0 O-C-N 121.762 -0.586 . . . . 0.0 110.424 176.864 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 263' ' ' LEU . . . . . 0.488 HD12 ' HA ' ' B' ' 260' ' ' LEU . 33.0 mt . . . . . 0 N--CA 1.5 2.068 0 O-C-N 121.726 -0.609 . . . . 0.0 110.31 179.552 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 73.1 m . . . . . 0 N--CA 1.494 1.751 0 CA-C-O 121.036 0.446 . . . . 0.0 110.285 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 3' ' ' VAL . . . . . 0.424 HG12 ' CE1' ' A' ' 7' ' ' TYR . 83.2 t -67.74 -27.64 38.78 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.095 0 O-C-N 121.754 -0.591 . . . . 0.0 110.251 -179.407 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -54.99 -30.33 59.12 Favored 'General case' 0 N--CA 1.505 2.281 0 O-C-N 121.446 -0.783 . . . . 0.0 110.533 -178.196 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 74.5 m-20 -68.74 -30.69 69.36 Favored 'General case' 0 N--CA 1.499 1.998 0 O-C-N 121.82 -0.55 . . . . 0.0 110.298 174.859 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 96.0 m-85 -95.59 10.03 38.14 Favored 'General case' 0 N--CA 1.497 1.903 0 O-C-N 121.538 -0.726 . . . . 0.0 111.485 -178.24 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 7' ' ' TYR . . . . . 0.424 ' CE1' HG12 ' A' ' 3' ' ' VAL . 3.6 m-30 -67.3 138.6 56.95 Favored 'General case' 0 N--CA 1.501 2.095 0 O-C-N 121.154 -0.966 . . . . 0.0 110.166 174.27 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 83.3 -2.27 87.35 Favored Glycine 0 N--CA 1.498 2.8 0 N-CA-C 110.757 -0.937 . . . . 0.0 110.757 -177.289 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 27.7 t -76.24 138.2 40.44 Favored 'General case' 0 N--CA 1.497 1.878 0 O-C-N 121.117 -1.225 . . . . 0.0 110.446 179.581 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 10' ' ' ASN . . . . . 0.684 ' CG ' HG22 ' A' ' 24' ' ' VAL . 2.5 m120 -83.4 118.37 23.67 Favored 'General case' 0 N--CA 1.498 1.937 0 O-C-N 121.629 -0.669 . . . . 0.0 109.411 173.882 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . 0.594 HG21 HD11 ' A' ' 25' ' ' ILE . 35.2 m -143.21 161.0 17.42 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.836 0 O-C-N 121.812 -0.555 . . . . 0.0 109.638 -178.361 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 12' ' ' GLU . . . . . 0.566 ' HB2' HD11 ' A' ' 58' ' ' LEU . 40.6 tt0 -109.48 126.02 53.08 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.481 -0.762 . . . . 0.0 110.111 178.075 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 13' ' ' VAL . . . . . 0.588 HG22 ' CD2' ' A' ' 55' ' ' LEU . 60.0 t -106.81 124.4 62.44 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.782 0 O-C-N 121.663 -0.648 . . . . 0.0 110.005 -178.521 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 21.9 tp -95.96 129.27 43.26 Favored 'General case' 0 N--CA 1.494 1.758 0 O-C-N 121.697 -0.627 . . . . 0.0 109.495 174.073 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 85.9 mt -98.86 167.24 10.88 Favored 'General case' 0 N--CA 1.495 1.803 0 O-C-N 121.607 -0.683 . . . . 0.0 111.052 -172.75 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 9.6 p30 -57.95 -22.35 48.63 Favored 'General case' 0 N--CA 1.505 2.313 0 O-C-N 121.832 -0.543 . . . . 0.0 111.555 -177.412 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 43.5 p-10 -92.46 23.28 4.05 Favored 'General case' 0 N--CA 1.498 1.97 0 O-C-N 121.428 -0.795 . . . . 0.0 110.847 -176.823 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 58.77 27.83 16.52 Favored 'General case' 0 N--CA 1.505 2.279 0 O-C-N 121.498 -0.751 . . . . 0.0 110.714 175.194 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 50.8 m -105.54 133.98 49.4 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.531 -0.731 . . . . 0.0 109.542 171.754 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 33.0 ttmt -109.81 141.86 41.88 Favored 'General case' 0 N--CA 1.495 1.799 0 O-C-N 121.714 -0.616 . . . . 0.0 110.46 -176.044 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -153.12 156.09 37.99 Favored 'General case' 0 N--CA 1.496 1.836 0 O-C-N 121.625 -0.672 . . . . 0.0 110.267 178.941 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . 0.5 ' O ' HD13 ' A' ' 39' ' ' LEU . 31.1 ptt180 -140.55 146.58 38.25 Favored 'General case' 0 N--CA 1.497 1.9 0 O-C-N 121.623 -0.673 . . . . 0.0 110.558 179.832 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -171.73 171.48 44.11 Favored Glycine 0 N--CA 1.495 2.589 0 N-CA-C 108.829 -1.709 . . . . 0.0 108.829 -175.132 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . 0.684 HG22 ' CG ' ' A' ' 10' ' ' ASN . 39.8 t -94.56 120.54 44.13 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.874 0 O-C-N 121.419 -1.048 . . . . 0.0 109.309 -175.904 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 25' ' ' ILE . . . . . 0.648 ' HA ' HD23 ' A' ' 37' ' ' LEU . 75.2 mt -64.31 141.98 17.47 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.102 0 O-C-N 121.545 -0.722 . . . . 0.0 110.402 -172.093 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 26' ' ' THR . . . . . 0.645 HG21 ' HB2' ' A' ' 38' ' ' ARG . 5.7 p -121.26 -26.44 5.06 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.653 -0.654 . . . . 0.0 111.345 -179.949 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 27' ' ' ASN . . . . . 0.51 ' O ' HD12 ' A' ' 35' ' ' LEU . 2.1 t-20 -162.09 160.41 27.34 Favored 'General case' 0 N--CA 1.5 2.053 0 C-N-CA 118.877 -1.129 . . . . 0.0 111.872 -179.244 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 28' ' ' PHE . . . . . 0.534 ' HE1' HG21 ' A' ' 49' ' ' THR . 85.0 t80 -150.01 126.57 10.9 Favored 'General case' 0 N--CA 1.497 1.904 0 N-CA-C 109.116 -0.698 . . . . 0.0 109.116 169.436 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 26.7 t0 -99.77 130.4 45.97 Favored 'General case' 0 N--CA 1.491 1.599 0 N-CA-C 109.064 -0.717 . . . . 0.0 109.064 -177.019 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 22.8 t -68.85 -50.15 52.39 Favored 'General case' 0 N--CA 1.498 1.962 0 C-N-CA 120.037 -0.665 . . . . 0.0 110.597 -176.662 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 19.8 m -59.7 -42.55 93.26 Favored 'General case' 0 N--CA 1.502 2.146 0 O-C-N 121.614 -0.679 . . . . 0.0 110.915 -174.366 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 91.4 m-20 -103.97 -10.08 18.38 Favored 'General case' 0 N--CA 1.497 1.921 0 O-C-N 121.565 -0.709 . . . . 0.0 111.66 -178.136 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 3.0 m 50.09 67.21 0.95 Allowed 'General case' 0 N--CA 1.508 2.443 0 O-C-N 121.0 -1.062 . . . . 0.0 110.943 -174.345 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 34' ' ' ILE . . . . . 1.122 HD12 HG22 ' A' ' 48' ' ' VAL . 47.4 mm -124.72 126.95 72.36 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.072 0 O-C-N 121.541 -0.724 . . . . 0.0 109.469 -175.711 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.51 HD12 ' O ' ' A' ' 27' ' ' ASN . 11.7 tp -115.78 120.57 39.73 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.675 -0.641 . . . . 0.0 110.501 -169.851 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 99.1 mt-30 -91.06 134.66 34.33 Favored 'General case' 0 N--CA 1.491 1.607 0 N-CA-C 109.39 -0.596 . . . . 0.0 109.39 174.24 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . 0.648 HD23 ' HA ' ' A' ' 25' ' ' ILE . 88.8 mt -117.87 123.8 46.75 Favored 'General case' 0 N--CA 1.497 1.915 0 O-C-N 121.772 -0.58 . . . . 0.0 109.896 173.527 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 38' ' ' ARG . . . . . 0.645 ' HB2' HG21 ' A' ' 26' ' ' THR . 73.3 ttt-85 -97.11 109.09 21.91 Favored 'General case' 0 N--CA 1.497 1.877 0 O-C-N 121.699 -0.626 . . . . 0.0 109.8 175.863 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . 0.5 HD13 ' O ' ' A' ' 22' ' ' ARG . 17.6 tp -85.07 150.63 24.73 Favored 'General case' 0 N--CA 1.494 1.774 0 O-C-N 121.706 -0.621 . . . . 0.0 110.928 -173.91 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -62.3 -10.39 10.86 Favored 'General case' 0 N--CA 1.504 2.233 0 O-C-N 121.907 -0.495 . . . . 0.0 111.892 -173.059 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 39.7 t30 -85.16 29.14 0.67 Allowed 'General case' 0 N--CA 1.499 2.008 0 O-C-N 121.151 -0.968 . . . . 0.0 110.94 174.651 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 74.3 m-20 59.68 31.69 21.03 Favored 'General case' 0 N--CA 1.505 2.307 0 O-C-N 121.213 -0.929 . . . . 0.0 110.424 174.031 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 52.2 m -123.3 137.91 54.74 Favored 'General case' 0 N--CA 1.495 1.797 0 O-C-N 121.413 -0.805 . . . . 0.0 110.348 178.609 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 8.9 t -98.06 149.5 22.42 Favored 'General case' 0 N--CA 1.497 1.902 0 O-C-N 121.694 -0.629 . . . . 0.0 110.274 176.937 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 78.0 tttt -149.72 119.16 6.89 Favored 'General case' 0 N--CA 1.495 1.805 0 O-C-N 121.577 -0.702 . . . . 0.0 110.33 177.897 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 88.7 p -95.52 123.98 39.33 Favored 'General case' 0 N--CA 1.494 1.767 0 O-C-N 121.673 -0.642 . . . . 0.0 110.24 179.009 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 81.4 mt -129.35 135.3 62.05 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.838 0 O-C-N 121.621 -0.674 . . . . 0.0 109.311 179.555 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 48' ' ' VAL . . . . . 1.122 HG22 HD12 ' A' ' 34' ' ' ILE . 59.7 t -82.21 127.59 39.49 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.883 0 O-C-N 121.581 -0.699 . . . . 0.0 109.265 179.122 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 49' ' ' THR . . . . . 0.534 HG21 ' HE1' ' A' ' 28' ' ' PHE . 37.7 p -59.21 -24.95 63.57 Favored 'General case' 0 N--CA 1.504 2.25 0 O-C-N 121.611 -0.681 . . . . 0.0 112.06 -169.721 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 57.9 mttm -56.55 -22.91 36.5 Favored 'General case' 0 N--CA 1.503 2.213 0 O-C-N 121.466 -0.771 . . . . 0.0 110.991 -176.833 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 51.0 p30 -83.98 1.26 44.49 Favored 'General case' 0 N--CA 1.499 1.995 0 O-C-N 121.406 -0.809 . . . . 0.0 111.288 176.376 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 99.0 mt -75.63 126.66 36.63 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.066 0 O-C-N 121.171 -0.956 . . . . 0.0 110.042 178.883 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 37.6 ttpt -93.08 -29.27 15.88 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.851 -0.53 . . . . 0.0 109.893 170.562 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 5.1 m-20 -164.07 155.86 16.57 Favored 'General case' 0 N--CA 1.5 2.056 0 O-C-N 121.748 -0.595 . . . . 0.0 109.952 -178.251 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . 0.588 ' CD2' HG22 ' A' ' 13' ' ' VAL . 82.7 mt -132.89 149.69 52.23 Favored 'General case' 0 N--CA 1.496 1.849 0 O-C-N 121.645 -0.659 . . . . 0.0 110.62 -178.804 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 9.5 ptp85 -151.43 144.55 24.63 Favored 'General case' 0 N--CA 1.496 1.838 0 O-C-N 121.71 -0.619 . . . . 0.0 110.083 174.438 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 57' ' ' ILE . . . . . 0.482 ' HA ' HG12 ' A' ' 11' ' ' VAL . 66.6 mt -86.33 133.16 30.43 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.745 0 O-C-N 121.523 -0.736 . . . . 0.0 109.66 171.697 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . 0.566 HD11 ' HB2' ' A' ' 12' ' ' GLU . 61.8 mt . . . . . 0 N--CA 1.497 1.884 0 O-C-N 121.626 -0.671 . . . . 0.0 109.981 -179.781 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 257' ' ' SER . . . . . . . . . . . . . 74.2 m . . . . . 0 N--CA 1.503 2.208 0 CA-C-O 121.259 0.552 . . . . 0.0 110.499 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' B' B ' 258' ' ' SER . . . . . . . . . . . . . 24.9 m -68.16 -33.25 74.11 Favored 'General case' 0 N--CA 1.498 1.949 0 O-C-N 121.914 -0.491 . . . . 0.0 110.248 -179.468 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 259' ' ' GLN . . . . . . . . . . . . . 94.0 mm-40 -63.24 -36.79 84.83 Favored 'General case' 0 N--CA 1.501 2.109 0 O-C-N 121.648 -0.658 . . . . 0.0 110.463 -179.138 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 260' ' ' LEU . . . . . 0.496 ' HA ' HD12 ' B' ' 263' ' ' LEU . 81.9 mt -67.28 -42.43 83.84 Favored 'General case' 0 N--CA 1.499 2.025 0 O-C-N 121.646 -0.659 . . . . 0.0 110.191 178.989 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 261' ' ' LEU . . . . . . . . . . . . . 24.0 tp -69.79 -36.18 75.48 Favored 'General case' 0 N--CA 1.497 1.893 0 O-C-N 121.615 -0.678 . . . . 0.0 109.736 176.407 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 262' ' ' SER . . . . . . . . . . . . . 69.4 m -62.3 -36.34 81.84 Favored 'General case' 0 N--CA 1.5 2.066 0 O-C-N 121.761 -0.587 . . . . 0.0 110.465 177.41 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 263' ' ' LEU . . . . . 0.496 HD12 ' HA ' ' B' ' 260' ' ' LEU . 20.7 mt . . . . . 0 N--CA 1.501 2.076 0 O-C-N 121.679 -0.638 . . . . 0.0 110.116 179.779 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 69.1 m . . . . . 0 N--CA 1.495 1.825 0 CA-C-O 121.131 0.491 . . . . 0.0 110.545 . . . . . . . . . 0 0 . 1 . 021 nuclear nobuild core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 52.2 t -66.13 -27.84 41.97 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.153 0 O-C-N 121.667 -0.645 . . . . 0.0 110.344 -179.059 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -55.43 -31.81 62.19 Favored 'General case' 0 N--CA 1.505 2.29 0 O-C-N 121.538 -0.726 . . . . 0.0 110.371 -178.057 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 73.7 m-20 -68.84 -35.16 76.62 Favored 'General case' 0 N--CA 1.498 1.951 0 O-C-N 121.747 -0.596 . . . . 0.0 109.912 175.24 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 6' ' ' PHE . . . . . 0.468 ' CE2' HD11 ' B' ' 260' ' ' LEU . 97.8 m-85 -97.93 10.02 41.31 Favored 'General case' 0 N--CA 1.497 1.9 0 O-C-N 121.751 -0.593 . . . . 0.0 111.284 178.826 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -67.41 129.53 40.19 Favored 'General case' 0 N--CA 1.501 2.114 0 O-C-N 121.208 -0.932 . . . . 0.0 109.975 178.694 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 8' ' ' GLY . . . . . 0.459 ' O ' HG13 ' A' ' 24' ' ' VAL . . . 82.08 0.93 90.14 Favored Glycine 0 N--CA 1.497 2.734 0 N-CA-C 110.647 -0.981 . . . . 0.0 110.647 -175.397 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 57.6 m -76.08 135.24 39.89 Favored 'General case' 0 N--CA 1.498 1.944 0 O-C-N 121.09 -1.241 . . . . 0.0 110.445 178.24 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 10' ' ' ASN . . . . . 0.405 ' CG ' HG22 ' A' ' 24' ' ' VAL . 0.1 OUTLIER -84.31 114.25 21.72 Favored 'General case' 0 N--CA 1.498 1.958 0 O-C-N 121.67 -0.644 . . . . 0.0 109.695 174.375 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . 0.553 HG12 ' HA ' ' A' ' 57' ' ' ILE . 35.8 m -140.23 164.04 22.93 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.835 0 O-C-N 121.772 -0.58 . . . . 0.0 109.463 179.992 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 12' ' ' GLU . . . . . 0.49 ' HB2' HD11 ' A' ' 58' ' ' LEU . 44.1 tt0 -109.36 129.6 55.53 Favored 'General case' 0 N--CA 1.492 1.654 0 C-N-CA 119.782 -0.767 . . . . 0.0 110.02 179.129 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 13' ' ' VAL . . . . . 0.598 HG22 ' CD2' ' A' ' 55' ' ' LEU . 60.3 t -106.69 127.36 62.24 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.726 0 O-C-N 121.546 -0.721 . . . . 0.0 110.015 -179.042 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . 0.445 HD13 ' HG2' ' A' ' 20' ' ' LYS . 27.1 tp -95.87 125.45 40.44 Favored 'General case' 0 N--CA 1.494 1.769 0 N-CA-C 109.031 -0.729 . . . . 0.0 109.031 173.42 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 87.0 mt -95.51 168.29 10.79 Favored 'General case' 0 N--CA 1.496 1.847 0 O-C-N 121.581 -0.7 . . . . 0.0 111.113 -172.73 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 24.4 p30 -58.02 -21.68 46.21 Favored 'General case' 0 N--CA 1.506 2.339 0 O-C-N 121.856 -0.528 . . . . 0.0 111.632 -176.94 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 46.0 p-10 -91.6 22.51 4.02 Favored 'General case' 0 N--CA 1.499 1.996 0 O-C-N 121.517 -0.739 . . . . 0.0 110.919 -176.641 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 74.4 m-20 58.55 27.37 15.56 Favored 'General case' 0 N--CA 1.506 2.35 0 O-C-N 121.469 -0.769 . . . . 0.0 110.712 175.738 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 49.9 m -108.18 144.39 35.68 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.579 -0.701 . . . . 0.0 109.578 172.887 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . 0.445 ' HG2' HD13 ' A' ' 14' ' ' LEU . 48.2 mttm -109.57 145.47 36.32 Favored 'General case' 0 N--CA 1.495 1.806 0 O-C-N 121.61 -0.681 . . . . 0.0 110.615 -176.512 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -153.07 154.11 34.2 Favored 'General case' 0 N--CA 1.496 1.865 0 O-C-N 121.784 -0.573 . . . . 0.0 109.868 176.272 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . 0.407 ' O ' HD22 ' A' ' 39' ' ' LEU . 30.4 ptt180 -140.4 151.5 44.99 Favored 'General case' 0 N--CA 1.496 1.841 0 O-C-N 121.635 -0.666 . . . . 0.0 110.529 -179.513 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . 0.426 ' HA2' HD13 ' A' ' 39' ' ' LEU . . . -171.85 171.09 43.93 Favored Glycine 0 N--CA 1.492 2.419 0 N-CA-C 109.037 -1.625 . . . . 0.0 109.037 -179.846 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . 0.459 HG13 ' O ' ' A' ' 8' ' ' GLY . 61.3 t -94.63 127.24 46.77 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.845 0 O-C-N 121.651 -0.911 . . . . 0.0 109.163 176.34 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 25' ' ' ILE . . . . . 0.515 ' HA ' HD23 ' A' ' 37' ' ' LEU . 49.3 mt -61.37 138.4 22.12 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.185 0 O-C-N 121.594 -0.691 . . . . 0.0 110.874 -171.099 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 26' ' ' THR . . . . . 0.674 HG21 ' HB2' ' A' ' 38' ' ' ARG . 11.4 p -121.25 -20.59 6.66 Favored 'General case' 0 N--CA 1.493 1.717 0 O-C-N 121.876 -0.515 . . . . 0.0 111.49 -179.548 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 6.7 t30 -165.48 158.57 15.99 Favored 'General case' 0 N--CA 1.505 2.311 0 O-C-N 120.945 -1.097 . . . . 0.0 111.871 177.093 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 65.1 t80 -150.41 119.95 6.95 Favored 'General case' 0 N--CA 1.497 1.901 0 N-CA-C 109.226 -0.657 . . . . 0.0 109.226 173.766 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 17.9 t70 -97.14 127.2 42.88 Favored 'General case' 0 N--CA 1.494 1.757 0 O-C-N 121.641 -0.662 . . . . 0.0 109.293 -177.113 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 22.7 t -65.85 -46.34 78.82 Favored 'General case' 0 N--CA 1.5 2.042 0 O-C-N 121.557 -0.715 . . . . 0.0 110.865 -175.11 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 21.4 t -58.61 -48.06 82.25 Favored 'General case' 0 N--CA 1.502 2.13 0 O-C-N 121.505 -0.747 . . . . 0.0 111.0 -173.575 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 92.4 m-20 -107.02 -1.87 21.69 Favored 'General case' 0 N--CA 1.498 1.927 0 O-C-N 121.594 -0.691 . . . . 0.0 111.804 -178.316 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 69.1 m 49.18 67.18 0.92 Allowed 'General case' 0 N--CA 1.508 2.438 0 O-C-N 121.082 -1.011 . . . . 0.0 110.901 -174.437 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 34' ' ' ILE . . . . . 1.102 HD12 HG22 ' A' ' 48' ' ' VAL . 44.2 mm -113.82 125.79 71.18 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.971 0 O-C-N 121.544 -0.723 . . . . 0.0 109.136 -175.215 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 10.9 tp -116.0 119.03 34.56 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.613 -0.679 . . . . 0.0 110.451 -169.816 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 78.2 mt-30 -90.98 132.39 36.0 Favored 'General case' 0 N--CA 1.489 1.523 0 N-CA-C 109.191 -0.67 . . . . 0.0 109.191 170.862 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . 0.515 HD23 ' HA ' ' A' ' 25' ' ' ILE . 48.8 mt -117.81 123.47 46.03 Favored 'General case' 0 N--CA 1.493 1.71 0 C-N-CA 120.152 -0.619 . . . . 0.0 109.949 175.218 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 38' ' ' ARG . . . . . 0.674 ' HB2' HG21 ' A' ' 26' ' ' THR . 56.5 ttt85 -105.1 105.85 16.08 Favored 'General case' 0 N--CA 1.495 1.786 0 O-C-N 121.78 -0.575 . . . . 0.0 110.091 174.101 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . 0.426 HD13 ' HA2' ' A' ' 23' ' ' GLY . 63.3 tp -83.37 155.04 23.72 Favored 'General case' 0 N--CA 1.498 1.949 0 O-C-N 121.609 -0.682 . . . . 0.0 110.515 -177.054 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -68.82 -2.91 10.61 Favored 'General case' 0 N--CA 1.504 2.243 0 O-C-N 121.885 -0.51 . . . . 0.0 112.131 -170.347 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 30.1 m120 -88.04 28.59 1.03 Allowed 'General case' 0 N--CA 1.497 1.907 0 O-C-N 121.029 -1.045 . . . . 0.0 110.795 174.878 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 13.5 t0 64.9 29.03 12.6 Favored 'General case' 0 N--CA 1.505 2.295 0 O-C-N 121.205 -0.934 . . . . 0.0 110.387 175.755 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 74.5 m -125.01 137.95 54.23 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.432 -0.792 . . . . 0.0 110.137 177.897 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 9.1 t -128.22 149.72 50.34 Favored 'General case' 0 N--CA 1.496 1.843 0 O-C-N 121.711 -0.618 . . . . 0.0 110.018 178.818 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . 0.422 ' HD3' HD11 ' A' ' 47' ' ' ILE . 57.7 tttm -151.15 134.9 16.44 Favored 'General case' 0 N--CA 1.497 1.879 0 O-C-N 121.704 -0.623 . . . . 0.0 110.574 -178.339 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 91.0 p -95.0 120.99 36.15 Favored 'General case' 0 N--CA 1.495 1.796 0 O-C-N 121.727 -0.608 . . . . 0.0 110.215 177.556 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 47' ' ' ILE . . . . . 0.422 HD11 ' HD3' ' A' ' 45' ' ' LYS . 80.9 mt -129.35 136.05 60.31 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.85 0 O-C-N 121.681 -0.637 . . . . 0.0 109.359 -179.597 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 48' ' ' VAL . . . . . 1.102 HG22 HD12 ' A' ' 34' ' ' ILE . 66.4 t -81.71 127.79 39.28 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.001 0 O-C-N 121.631 -0.668 . . . . 0.0 109.202 179.204 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 51.6 p -57.99 -25.06 60.56 Favored 'General case' 0 N--CA 1.505 2.295 0 O-C-N 121.463 -0.773 . . . . 0.0 111.87 -168.97 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 43.4 tptt -57.19 -26.06 60.02 Favored 'General case' 0 N--CA 1.502 2.134 0 O-C-N 121.507 -0.745 . . . . 0.0 111.066 -176.805 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 5.0 p30 -84.69 5.72 27.08 Favored 'General case' 0 N--CA 1.498 1.95 0 C-N-CA 119.69 -0.804 . . . . 0.0 111.286 176.323 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 96.5 mt -75.77 124.41 33.76 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.144 0 O-C-N 121.146 -0.971 . . . . 0.0 109.837 175.461 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 42.5 tttp -92.36 -28.68 16.76 Favored 'General case' 0 N--CA 1.495 1.803 0 C-N-CA 120.396 -0.521 . . . . 0.0 109.953 171.962 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 5.4 m-20 -163.75 154.57 15.92 Favored 'General case' 0 N--CA 1.501 2.085 0 O-C-N 121.791 -0.568 . . . . 0.0 110.125 -178.461 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . 0.598 ' CD2' HG22 ' A' ' 13' ' ' VAL . 84.4 mt -132.96 150.75 52.14 Favored 'General case' 0 N--CA 1.497 1.887 0 O-C-N 121.669 -0.645 . . . . 0.0 110.487 -179.181 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 19.6 ptp180 -151.59 145.71 25.31 Favored 'General case' 0 N--CA 1.495 1.797 0 O-C-N 121.688 -0.632 . . . . 0.0 110.009 174.824 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 57' ' ' ILE . . . . . 0.553 ' HA ' HG12 ' A' ' 11' ' ' VAL . 64.8 mt -86.32 133.27 30.16 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.837 0 O-C-N 121.527 -0.733 . . . . 0.0 109.86 173.864 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . 0.49 HD11 ' HB2' ' A' ' 12' ' ' GLU . 61.1 mt . . . . . 0 N--CA 1.497 1.893 0 O-C-N 121.594 -0.692 . . . . 0.0 110.145 -178.903 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' B' B ' 257' ' ' SER . . . . . . . . . . . . . 34.5 t . . . . . 0 N--CA 1.503 2.204 0 CA-C-O 121.325 0.583 . . . . 0.0 110.396 . . . . . . . . . 0 0 . 1 . 021 nuclear nobuild core ' B' B ' 258' ' ' SER . . . . . . . . . . . . . 25.3 m -67.99 -31.25 70.82 Favored 'General case' 0 N--CA 1.498 1.934 0 O-C-N 121.888 -0.507 . . . . 0.0 110.25 178.978 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' B' B ' 259' ' ' GLN . . . . . . . . . . . . . 48.7 tt0 -61.47 -37.59 84.17 Favored 'General case' 0 N--CA 1.502 2.134 0 O-C-N 121.635 -0.666 . . . . 0.0 110.381 178.964 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' B' B ' 260' ' ' LEU . . . . . 0.502 ' HA ' HD12 ' B' ' 263' ' ' LEU . 46.0 mt -65.93 -42.36 90.2 Favored 'General case' 0 N--CA 1.5 2.038 0 O-C-N 121.721 -0.612 . . . . 0.0 110.306 178.449 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' B' B ' 261' ' ' LEU . . . . . . . . . . . . . 18.9 tp -69.89 -36.55 75.53 Favored 'General case' 0 N--CA 1.498 1.961 0 O-C-N 121.717 -0.614 . . . . 0.0 109.75 176.83 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' B' B ' 262' ' ' SER . . . . . . . . . . . . . 49.1 m -62.16 -37.0 83.56 Favored 'General case' 0 N--CA 1.501 2.078 0 O-C-N 121.714 -0.616 . . . . 0.0 110.556 176.614 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' B' B ' 263' ' ' LEU . . . . . 0.502 HD12 ' HA ' ' B' ' 260' ' ' LEU . 18.9 mt . . . . . 0 N--CA 1.502 2.133 0 O-C-N 121.698 -0.626 . . . . 0.0 110.186 179.64 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 69.7 m . . . . . 0 N--CA 1.496 1.843 0 CA-C-O 121.021 0.439 . . . . 0.0 110.247 . . . . . . . . . 0 0 . 1 . 022 nuclear nobuild core ' A' A ' 3' ' ' VAL . . . . . 0.431 HG12 ' CE1' ' A' ' 7' ' ' TYR . 65.6 t -66.4 -27.73 41.31 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.065 0 O-C-N 121.727 -0.608 . . . . 0.0 110.337 -178.887 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -54.98 -30.63 59.62 Favored 'General case' 0 N--CA 1.505 2.303 0 O-C-N 121.487 -0.758 . . . . 0.0 110.439 -178.422 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 9.7 m-20 -68.89 -30.72 69.27 Favored 'General case' 0 N--CA 1.499 1.995 0 O-C-N 121.753 -0.592 . . . . 0.0 110.244 174.981 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 97.4 m-85 -95.56 10.06 37.96 Favored 'General case' 0 N--CA 1.497 1.909 0 O-C-N 121.636 -0.665 . . . . 0.0 111.502 -178.16 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 7' ' ' TYR . . . . . 0.431 ' CE1' HG12 ' A' ' 3' ' ' VAL . 3.9 m-30 -67.3 139.88 57.29 Favored 'General case' 0 N--CA 1.502 2.135 0 O-C-N 121.171 -0.955 . . . . 0.0 110.077 174.184 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 8' ' ' GLY . . . . . 0.424 ' O ' HG13 ' A' ' 24' ' ' VAL . . . 83.65 -3.14 86.13 Favored Glycine 0 N--CA 1.497 2.746 0 N-CA-C 110.768 -0.933 . . . . 0.0 110.768 -177.089 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 66.2 m -75.27 138.97 42.23 Favored 'General case' 0 N--CA 1.497 1.887 0 O-C-N 121.115 -1.227 . . . . 0.0 110.508 179.685 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 10' ' ' ASN . . . . . 0.669 ' CG ' HG22 ' A' ' 24' ' ' VAL . 2.4 m120 -84.58 118.8 24.57 Favored 'General case' 0 N--CA 1.498 1.971 0 O-C-N 121.651 -0.656 . . . . 0.0 109.454 174.407 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . 0.474 HG12 ' HA ' ' A' ' 57' ' ' ILE . 35.8 m -143.19 162.3 17.02 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.822 0 O-C-N 121.693 -0.629 . . . . 0.0 109.854 -179.116 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 12' ' ' GLU . . . . . 0.584 ' HB2' HD11 ' A' ' 58' ' ' LEU . 47.7 tt0 -109.47 127.22 54.26 Favored 'General case' 0 N--CA 1.493 1.692 0 O-C-N 121.56 -0.713 . . . . 0.0 110.047 176.331 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 13' ' ' VAL . . . . . 0.548 HG22 ' CD2' ' A' ' 55' ' ' LEU . 58.0 t -106.89 123.52 62.0 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.747 0 O-C-N 121.48 -0.763 . . . . 0.0 109.951 -178.324 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . 0.637 HD12 ' O ' ' A' ' 19' ' ' SER . 17.6 tp -96.0 135.1 38.22 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.663 -0.648 . . . . 0.0 109.472 175.737 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 86.2 mt -103.67 169.0 8.78 Favored 'General case' 0 N--CA 1.497 1.908 0 O-C-N 121.61 -0.681 . . . . 0.0 111.22 -172.605 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 24.1 p30 -59.05 -21.73 59.59 Favored 'General case' 0 N--CA 1.507 2.391 0 O-C-N 121.843 -0.535 . . . . 0.0 111.677 -177.507 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 47.7 p-10 -93.45 24.53 3.9 Favored 'General case' 0 N--CA 1.498 1.96 0 O-C-N 121.497 -0.752 . . . . 0.0 110.797 -175.309 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 74.3 m-20 59.31 25.64 14.33 Favored 'General case' 0 N--CA 1.505 2.298 0 O-C-N 121.523 -0.736 . . . . 0.0 110.73 176.834 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 19' ' ' SER . . . . . 0.637 ' O ' HD12 ' A' ' 14' ' ' LEU . 70.7 m -97.67 163.07 12.98 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.631 -0.668 . . . . 0.0 109.274 170.657 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 13.0 ptmt -145.4 138.02 25.98 Favored 'General case' 0 N--CA 1.495 1.818 0 O-C-N 121.59 -0.694 . . . . 0.0 110.46 -176.688 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -153.02 161.62 42.31 Favored 'General case' 0 N--CA 1.496 1.863 0 O-C-N 121.728 -0.607 . . . . 0.0 110.299 179.893 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . 0.486 ' O ' HD13 ' A' ' 39' ' ' LEU . 32.5 ptt180 -142.06 147.15 36.35 Favored 'General case' 0 N--CA 1.496 1.826 0 O-C-N 121.701 -0.624 . . . . 0.0 110.782 -179.751 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -171.73 171.42 44.08 Favored Glycine 0 N--CA 1.494 2.561 0 N-CA-C 108.76 -1.736 . . . . 0.0 108.76 -175.47 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . 0.669 HG22 ' CG ' ' A' ' 10' ' ' ASN . 39.9 t -94.59 120.89 44.65 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.901 0 O-C-N 121.424 -1.045 . . . . 0.0 109.35 -175.451 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 25' ' ' ILE . . . . . 0.662 ' HA ' HD23 ' A' ' 37' ' ' LEU . 92.6 mt -64.29 143.45 15.69 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.118 0 O-C-N 121.566 -0.709 . . . . 0.0 110.498 -171.899 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 26' ' ' THR . . . . . 0.619 HG21 ' HB2' ' A' ' 38' ' ' ARG . 6.3 p -121.23 -28.16 4.75 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.785 -0.572 . . . . 0.0 111.256 179.334 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 27' ' ' ASN . . . . . 0.518 ' O ' HD12 ' A' ' 35' ' ' LEU . 27.5 t30 -161.66 160.77 29.07 Favored 'General case' 0 N--CA 1.5 2.065 0 C-N-CA 118.919 -1.112 . . . . 0.0 111.899 -177.881 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 28' ' ' PHE . . . . . 0.56 ' HE1' HG21 ' A' ' 49' ' ' THR . 82.0 t80 -150.08 125.81 10.38 Favored 'General case' 0 N--CA 1.499 2.002 0 N-CA-C 109.052 -0.721 . . . . 0.0 109.052 169.724 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 17.8 t70 -99.68 128.56 45.78 Favored 'General case' 0 N--CA 1.492 1.664 0 N-CA-C 109.089 -0.708 . . . . 0.0 109.089 -177.484 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 21.8 m -66.43 -46.37 76.71 Favored 'General case' 0 N--CA 1.499 2.015 0 C-N-CA 120.053 -0.659 . . . . 0.0 110.673 -175.736 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 16.3 t -58.22 -48.06 81.55 Favored 'General case' 0 N--CA 1.503 2.206 0 O-C-N 121.485 -0.76 . . . . 0.0 110.957 -173.971 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 90.4 m-20 -104.59 -5.38 21.51 Favored 'General case' 0 N--CA 1.497 1.895 0 O-C-N 121.614 -0.679 . . . . 0.0 111.643 -178.486 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 71.0 m 49.36 67.25 0.91 Allowed 'General case' 0 N--CA 1.507 2.418 0 O-C-N 121.132 -0.98 . . . . 0.0 110.937 -174.32 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 34' ' ' ILE . . . . . 1.034 HD12 HG22 ' A' ' 48' ' ' VAL . 45.5 mm -120.68 126.41 75.21 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.019 0 O-C-N 121.665 -0.647 . . . . 0.0 109.323 -174.959 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.518 HD12 ' O ' ' A' ' 27' ' ' ASN . 11.9 tp -115.76 120.38 39.13 Favored 'General case' 0 N--CA 1.494 1.762 0 O-C-N 121.68 -0.637 . . . . 0.0 110.504 -169.065 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 99.0 mt-30 -90.99 134.68 34.29 Favored 'General case' 0 N--CA 1.491 1.593 0 N-CA-C 109.468 -0.568 . . . . 0.0 109.468 174.485 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . 0.662 HD23 ' HA ' ' A' ' 25' ' ' ILE . 90.2 mt -117.82 123.82 46.86 Favored 'General case' 0 N--CA 1.496 1.842 0 O-C-N 121.841 -0.537 . . . . 0.0 109.915 174.342 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 38' ' ' ARG . . . . . 0.619 ' HB2' HG21 ' A' ' 26' ' ' THR . 58.0 ttt85 -96.64 108.54 21.17 Favored 'General case' 0 N--CA 1.496 1.83 0 O-C-N 121.669 -0.645 . . . . 0.0 109.829 175.283 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . 0.486 HD13 ' O ' ' A' ' 22' ' ' ARG . 17.9 tp -84.83 153.37 22.99 Favored 'General case' 0 N--CA 1.494 1.739 0 O-C-N 121.745 -0.597 . . . . 0.0 110.962 -174.155 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -63.57 -9.65 14.4 Favored 'General case' 0 N--CA 1.503 2.183 0 O-C-N 121.985 -0.447 . . . . 0.0 111.928 -171.781 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 30.0 m120 -86.14 27.47 0.91 Allowed 'General case' 0 N--CA 1.498 1.953 0 O-C-N 121.106 -0.996 . . . . 0.0 110.984 175.679 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 15.7 t0 62.89 29.23 16.57 Favored 'General case' 0 N--CA 1.504 2.235 0 O-C-N 120.975 -1.078 . . . . 0.0 110.595 175.481 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 63.8 m -123.14 137.81 54.81 Favored 'General case' 0 N--CA 1.496 1.872 0 O-C-N 121.344 -0.847 . . . . 0.0 110.402 -179.522 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 10.2 t -97.62 151.02 20.51 Favored 'General case' 0 N--CA 1.495 1.82 0 O-C-N 121.735 -0.603 . . . . 0.0 110.281 176.756 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 57.9 tttt -149.24 119.15 7.11 Favored 'General case' 0 N--CA 1.496 1.854 0 O-C-N 121.691 -0.631 . . . . 0.0 110.202 177.812 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 88.1 p -95.21 123.95 38.99 Favored 'General case' 0 N--CA 1.495 1.798 0 O-C-N 121.64 -0.662 . . . . 0.0 110.294 -179.831 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 82.7 mt -129.27 134.83 63.14 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.866 0 O-C-N 121.692 -0.63 . . . . 0.0 109.379 178.889 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 48' ' ' VAL . . . . . 1.034 HG22 HD12 ' A' ' 34' ' ' ILE . 66.6 t -82.71 127.56 39.55 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.889 0 O-C-N 121.622 -0.674 . . . . 0.0 109.306 179.318 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 49' ' ' THR . . . . . 0.56 HG21 ' HE1' ' A' ' 28' ' ' PHE . 67.9 p -58.29 -24.93 61.09 Favored 'General case' 0 N--CA 1.507 2.408 0 O-C-N 121.545 -0.722 . . . . 0.0 111.916 -169.793 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 56.3 tttt -56.51 -23.26 38.39 Favored 'General case' 0 N--CA 1.502 2.135 0 O-C-N 121.464 -0.772 . . . . 0.0 111.149 -177.055 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 50.4 p30 -84.0 1.47 43.59 Favored 'General case' 0 N--CA 1.498 1.941 0 O-C-N 121.419 -0.8 . . . . 0.0 111.301 176.677 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 52' ' ' ILE . . . . . 0.402 HD12 ' HB ' ' A' ' 49' ' ' THR . 97.8 mt -76.13 127.56 37.44 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.074 0 O-C-N 121.163 -0.961 . . . . 0.0 110.055 179.05 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 45.8 tptt -92.14 -30.86 15.74 Favored 'General case' 0 N--CA 1.495 1.789 0 O-C-N 121.868 -0.52 . . . . 0.0 109.602 169.283 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 5.3 m-20 -163.91 159.37 20.86 Favored 'General case' 0 N--CA 1.499 2.007 0 O-C-N 121.87 -0.519 . . . . 0.0 109.89 -178.56 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . 0.548 ' CD2' HG22 ' A' ' 13' ' ' VAL . 85.5 mt -132.94 149.33 52.25 Favored 'General case' 0 N--CA 1.496 1.868 0 O-C-N 121.699 -0.626 . . . . 0.0 110.342 -179.241 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 6.8 ptm180 -150.71 137.6 19.1 Favored 'General case' 0 N--CA 1.496 1.832 0 O-C-N 121.716 -0.615 . . . . 0.0 109.978 176.462 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 57' ' ' ILE . . . . . 0.474 ' HA ' HG12 ' A' ' 11' ' ' VAL . 68.6 mt -84.77 133.18 29.89 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.795 0 O-C-N 121.503 -0.748 . . . . 0.0 109.843 175.182 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . 0.584 HD11 ' HB2' ' A' ' 12' ' ' GLU . 56.4 mt . . . . . 0 N--CA 1.496 1.863 0 O-C-N 121.592 -0.693 . . . . 0.0 110.137 179.404 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' B' B ' 257' ' ' SER . . . . . . . . . . . . . 45.4 m . . . . . 0 N--CA 1.503 2.219 0 CA-C-O 121.223 0.535 . . . . 0.0 110.422 . . . . . . . . . 0 0 . 1 . 022 nuclear nobuild core ' B' B ' 258' ' ' SER . . . . . . . . . . . . . 25.6 t -69.51 -32.79 71.86 Favored 'General case' 0 N--CA 1.498 1.973 0 C-N-CA 120.365 -0.534 . . . . 0.0 110.274 179.171 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' B' B ' 259' ' ' GLN . . . . . . . . . . . . . 29.2 tt0 -63.27 -38.37 90.88 Favored 'General case' 0 N--CA 1.501 2.1 0 O-C-N 121.629 -0.669 . . . . 0.0 110.472 -179.37 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' B' B ' 260' ' ' LEU . . . . . 0.495 ' HA ' HD12 ' B' ' 263' ' ' LEU . 84.5 mt -67.16 -42.33 84.48 Favored 'General case' 0 N--CA 1.5 2.027 0 O-C-N 121.652 -0.655 . . . . 0.0 110.251 179.872 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' B' B ' 261' ' ' LEU . . . . . . . . . . . . . 21.6 tp -70.01 -36.61 75.24 Favored 'General case' 0 N--CA 1.496 1.873 0 O-C-N 121.668 -0.645 . . . . 0.0 109.757 176.852 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' B' B ' 262' ' ' SER . . . . . . . . . . . . . 22.6 t -62.25 -37.51 85.72 Favored 'General case' 0 N--CA 1.501 2.086 0 O-C-N 121.745 -0.597 . . . . 0.0 110.389 177.036 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' B' B ' 263' ' ' LEU . . . . . 0.495 HD12 ' HA ' ' B' ' 260' ' ' LEU . 28.2 mt . . . . . 0 N--CA 1.501 2.093 0 O-C-N 121.651 -0.655 . . . . 0.0 110.314 179.365 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' -1' ' ' MET . . . . . . . . . . . . . 61.1 mtt . . . . . 0 N--CA 1.493 1.724 0 CA-C-O 121.019 0.437 . . . . 6.75 110.16 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 0' ' ' GLY . . . . . . . . . . . . . . . 159.21 127.5 0.92 Allowed Glycine 0 N--CA 1.493 2.486 0 N-CA-C 109.528 -1.429 . . . . 2.52 109.528 179.944 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 74.1 mtm -129.59 163.5 25.88 Favored 'General case' 0 N--CA 1.496 1.826 0 O-C-N 121.723 -0.869 . . . . 2.5 110.253 -179.571 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 73.0 m -94.8 174.51 7.06 Favored 'General case' 0 N--CA 1.496 1.829 0 O-C-N 121.727 -0.608 . . . . 0.64000000000000001 110.027 179.377 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' VAL . . . . . 0.426 HG12 ' CE1' ' A' ' 7' ' ' TYR . 66.8 t -66.55 -27.82 41.43 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.13 0 O-C-N 121.675 -0.641 . . . . 0.69999999999999996 110.301 -178.486 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -55.18 -31.16 61.16 Favored 'General case' 0 N--CA 1.504 2.251 0 O-C-N 121.492 -0.755 . . . . 0.40000000000000002 110.504 -178.262 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 9.7 m-20 -69.05 -30.59 68.96 Favored 'General case' 0 N--CA 1.498 1.962 0 O-C-N 121.833 -0.542 . . . . 1.1699999999999999 110.304 174.903 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' PHE . . . . . 0.423 ' CE1' HD21 ' B' ' 260' ' ' LEU . 95.4 m-85 -95.49 10.01 38.04 Favored 'General case' 0 N--CA 1.497 1.887 0 O-C-N 121.638 -0.664 . . . . 0.66000000000000003 111.537 -177.88 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' TYR . . . . . 0.426 ' CE1' HG12 ' A' ' 3' ' ' VAL . 3.4 m-30 -67.1 136.1 54.64 Favored 'General case' 0 N--CA 1.502 2.144 0 O-C-N 121.2 -0.938 . . . . 2.4100000000000001 109.966 174.172 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' GLY . . . . . 0.423 ' O ' HG13 ' A' ' 24' ' ' VAL . . . 83.13 -0.9 89.5 Favored Glycine 0 N--CA 1.498 2.794 0 N-CA-C 110.583 -1.007 . . . . 0.26000000000000001 110.583 -175.711 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 27.4 t -77.24 134.77 38.49 Favored 'General case' 0 N--CA 1.498 1.951 0 O-C-N 121.2 -1.176 . . . . 1.3 110.451 178.409 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 12.7 t-20 -83.52 120.03 25.43 Favored 'General case' 0 N--CA 1.497 1.896 0 O-C-N 121.623 -0.673 . . . . 2.0899999999999999 109.612 173.227 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . 0.528 HG12 ' HA ' ' A' ' 57' ' ' ILE . 35.9 m -142.73 162.92 17.86 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.714 0 O-C-N 121.79 -0.569 . . . . 0.23999999999999999 109.718 -178.89 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . 0.442 ' HB2' HD11 ' A' ' 58' ' ' LEU . 49.4 tt0 -109.39 147.31 32.99 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.654 -0.654 . . . . 1.0600000000000001 109.533 177.04 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . 0.671 HG22 ' CD2' ' A' ' 55' ' ' LEU . 57.7 t -136.07 125.16 38.77 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.79 0 O-C-N 121.642 -0.661 . . . . 0.28000000000000003 109.742 -174.259 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.443 HD13 ' HG2' ' A' ' 20' ' ' LYS . 24.1 tp -95.93 127.84 42.3 Favored 'General case' 0 N--CA 1.493 1.701 0 N-CA-C 109.238 -0.653 . . . . 0.34000000000000002 109.238 174.942 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 85.1 mt -92.78 171.83 8.73 Favored 'General case' 0 N--CA 1.496 1.83 0 O-C-N 121.659 -0.651 . . . . 0.28000000000000003 110.887 -173.961 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 24.0 p30 -56.89 -22.39 36.93 Favored 'General case' 0 N--CA 1.505 2.281 0 O-C-N 121.731 -0.606 . . . . 0.35999999999999999 111.518 -177.814 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 53.2 p-10 -92.99 22.92 4.55 Favored 'General case' 0 N--CA 1.498 1.972 0 O-C-N 121.613 -0.679 . . . . 0.71999999999999997 110.835 -178.038 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 74.3 m-20 58.73 27.81 16.44 Favored 'General case' 0 N--CA 1.506 2.334 0 O-C-N 121.446 -0.784 . . . . 1.0 110.647 176.279 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 49.9 m -105.81 146.9 29.28 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.511 -0.743 . . . . 0.32000000000000001 109.697 173.052 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . 0.443 ' HG2' HD13 ' A' ' 14' ' ' LEU . 73.6 mttt -109.55 145.55 36.16 Favored 'General case' 0 N--CA 1.495 1.783 0 O-C-N 121.572 -0.705 . . . . 1.6299999999999999 110.609 -176.64 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -153.07 131.52 12.14 Favored 'General case' 0 N--CA 1.496 1.833 0 O-C-N 121.809 -0.557 . . . . 0.38 110.266 176.74 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . 0.519 ' O ' HD13 ' A' ' 39' ' ' LEU . 16.6 ptp180 -126.17 144.26 50.82 Favored 'General case' 0 N--CA 1.497 1.92 0 O-C-N 121.659 -0.651 . . . . 2.1699999999999999 110.427 -178.133 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -171.77 171.4 44.08 Favored Glycine 0 N--CA 1.496 2.642 0 N-CA-C 109.189 -1.564 . . . . 0.25 109.189 -176.101 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . 0.423 HG13 ' O ' ' A' ' 8' ' ' GLY . 47.2 t -94.67 119.9 43.32 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.958 0 O-C-N 121.593 -0.945 . . . . 0.23999999999999999 109.375 -176.963 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' ILE . . . . . 0.425 ' HA ' HD23 ' A' ' 37' ' ' LEU . 90.7 mt -64.21 144.16 14.98 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.139 0 O-C-N 121.658 -0.652 . . . . 0.47999999999999998 110.531 -171.482 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . 0.778 HG21 ' HG3' ' A' ' 38' ' ' ARG . 19.1 p -121.28 -27.28 4.89 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.823 -0.548 . . . . 0.59999999999999998 111.152 178.128 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' ASN . . . . . 0.497 ' O ' HD12 ' A' ' 35' ' ' LEU . 2.1 t-20 -161.37 160.79 29.98 Favored 'General case' 0 N--CA 1.5 2.029 0 C-N-CA 118.97 -1.092 . . . . 1.0900000000000001 111.823 -178.921 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' PHE . . . . . 0.493 ' CE1' HG21 ' A' ' 49' ' ' THR . 84.1 t80 -150.11 126.97 11.07 Favored 'General case' 0 N--CA 1.498 1.954 0 N-CA-C 109.138 -0.689 . . . . 0.65000000000000002 109.138 170.234 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 17.9 t70 -99.7 129.16 45.8 Favored 'General case' 0 N--CA 1.491 1.619 0 N-CA-C 109.121 -0.696 . . . . 1.1499999999999999 109.121 -178.263 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 22.8 m -67.41 -47.67 69.58 Favored 'General case' 0 N--CA 1.498 1.949 0 O-C-N 121.647 -0.658 . . . . 1.3200000000000001 110.714 -175.609 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 22.1 m -59.47 -45.23 92.23 Favored 'General case' 0 N--CA 1.503 2.206 0 O-C-N 121.596 -0.69 . . . . 1.1799999999999999 110.892 -173.878 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 91.3 m-20 -104.69 -7.09 19.83 Favored 'General case' 0 N--CA 1.497 1.891 0 O-C-N 121.645 -0.659 . . . . 1.3400000000000001 111.608 -178.386 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 16.7 m 49.64 67.23 0.93 Allowed 'General case' 0 N--CA 1.507 2.422 0 O-C-N 121.058 -1.026 . . . . 1.1899999999999999 110.857 -174.378 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 34' ' ' ILE . . . . . 1.039 HD12 HG22 ' A' ' 48' ' ' VAL . 45.5 mm -121.4 125.98 74.34 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.993 0 O-C-N 121.545 -0.722 . . . . 0.31 109.333 -175.224 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.497 HD12 ' O ' ' A' ' 27' ' ' ASN . 11.5 tp -115.87 120.76 40.27 Favored 'General case' 0 N--CA 1.494 1.748 0 O-C-N 121.735 -0.603 . . . . 0.26000000000000001 110.559 -168.865 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 98.8 mt-30 -91.03 132.8 35.79 Favored 'General case' 0 N--CA 1.49 1.563 0 N-CA-C 109.494 -0.558 . . . . 1.02 109.494 173.87 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 0.425 HD23 ' HA ' ' A' ' 25' ' ' ILE . 16.3 mt -117.86 123.82 46.82 Favored 'General case' 0 N--CA 1.495 1.819 0 O-C-N 121.824 -0.547 . . . . 0.54000000000000004 109.992 176.408 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 38' ' ' ARG . . . . . 0.778 ' HG3' HG21 ' A' ' 26' ' ' THR . 26.4 mtp85 -96.79 107.09 19.51 Favored 'General case' 0 N--CA 1.496 1.87 0 O-C-N 121.651 -0.656 . . . . 2.79 109.935 175.545 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.519 HD13 ' O ' ' A' ' 22' ' ' ARG . 17.2 tp -84.53 152.08 24.15 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.684 -0.635 . . . . 0.81000000000000005 110.911 -174.618 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -66.37 -5.83 12.18 Favored 'General case' 0 N--CA 1.502 2.143 0 O-C-N 121.946 -0.471 . . . . 0.47999999999999998 112.006 -172.251 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 91.1 m-20 -86.61 27.91 0.92 Allowed 'General case' 0 N--CA 1.498 1.946 0 O-C-N 121.107 -0.995 . . . . 2.3599999999999999 110.925 174.504 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 8.0 t70 62.96 29.46 16.47 Favored 'General case' 0 N--CA 1.504 2.251 0 O-C-N 121.099 -1.0 . . . . 2.02 110.524 175.687 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 49.9 m -124.51 137.91 54.38 Favored 'General case' 0 N--CA 1.495 1.808 0 O-C-N 121.316 -0.865 . . . . 0.81000000000000005 110.554 -179.597 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 8.6 t -97.97 151.0 20.75 Favored 'General case' 0 N--CA 1.497 1.876 0 O-C-N 121.75 -0.593 . . . . 0.66000000000000003 110.116 175.265 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 37.9 ttmt -150.49 119.13 6.52 Favored 'General case' 0 N--CA 1.495 1.791 0 O-C-N 121.521 -0.737 . . . . 1.97 110.393 179.023 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 88.8 p -95.12 122.87 38.24 Favored 'General case' 0 N--CA 1.496 1.834 0 O-C-N 121.687 -0.633 . . . . 0.28999999999999998 110.27 179.356 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 82.0 mt -129.36 136.36 59.58 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.866 0 O-C-N 121.654 -0.654 . . . . 0.31 109.301 179.427 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 48' ' ' VAL . . . . . 1.039 HG22 HD12 ' A' ' 34' ' ' ILE . 66.9 t -81.88 127.63 39.43 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.914 0 O-C-N 121.565 -0.709 . . . . 0.34999999999999998 109.165 179.068 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 49' ' ' THR . . . . . 0.493 HG21 ' CE1' ' A' ' 28' ' ' PHE . 34.6 p -59.53 -24.86 64.04 Favored 'General case' 0 N--CA 1.504 2.266 0 O-C-N 121.56 -0.713 . . . . 0.33000000000000002 111.998 -170.606 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 77.1 tttt -56.55 -25.49 52.29 Favored 'General case' 0 N--CA 1.502 2.173 0 O-C-N 121.45 -0.781 . . . . 3.2799999999999998 110.943 -176.558 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 7.3 p30 -84.09 4.63 29.34 Favored 'General case' 0 N--CA 1.499 2.007 0 C-N-CA 119.714 -0.794 . . . . 0.54000000000000004 111.364 176.517 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 98.2 mt -75.8 126.46 36.56 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.137 0 O-C-N 121.07 -1.019 . . . . 0.48999999999999999 109.872 175.933 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 47.3 tptt -91.44 -29.95 16.76 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.833 -0.542 . . . . 1.8899999999999999 109.903 170.579 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 5.3 m-20 -164.29 157.01 17.24 Favored 'General case' 0 N--CA 1.5 2.06 0 O-C-N 121.795 -0.566 . . . . 0.85999999999999999 110.026 -178.136 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . 0.671 ' CD2' HG22 ' A' ' 13' ' ' VAL . 84.1 mt -132.97 150.74 52.14 Favored 'General case' 0 N--CA 1.497 1.92 0 O-C-N 121.756 -0.59 . . . . 0.58999999999999997 110.581 -178.65 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 9.2 ptp85 -152.79 142.33 21.78 Favored 'General case' 0 N--CA 1.497 1.884 0 O-C-N 121.729 -0.607 . . . . 1.9299999999999999 109.973 175.349 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 57' ' ' ILE . . . . . 0.528 ' HA ' HG12 ' A' ' 11' ' ' VAL . 68.8 mt -86.42 133.25 30.24 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.928 0 O-C-N 121.501 -0.75 . . . . 0.32000000000000001 110.094 175.14 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . 0.482 HD11 ' HB2' ' A' ' 22' ' ' ARG . 59.6 mt -83.56 161.7 55.62 Favored Pre-proline 0 N--CA 1.499 1.981 0 O-C-N 121.634 -0.666 . . . . 0.47999999999999998 110.029 -179.557 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 23.7 Cg_endo -66.04 152.19 81.94 Favored 'Trans proline' 0 N--CA 1.489 1.226 0 O-C-N 123.648 1.341 . . . . 1.28 110.373 178.093 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 49.1 tttm -79.49 125.43 29.56 Favored 'General case' 0 N--CA 1.497 1.899 0 O-C-N 121.644 -0.66 . . . . 5.5 110.238 -178.979 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 8.9 t-20 58.05 166.03 0.04 OUTLIER 'General case' 0 N--CA 1.507 2.396 0 O-C-N 121.633 -0.667 . . . . 5.4000000000000004 110.922 -179.03 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 75.9 mm-40 51.82 30.6 7.19 Favored 'General case' 0 N--CA 1.505 2.322 0 O-C-N 121.503 -0.748 . . . . 7.3799999999999999 111.168 -179.838 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 85.6 mt -68.05 -53.11 32.16 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.155 0 O-C-N 121.658 -0.651 . . . . 8.8900000000000006 109.73 -179.354 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 64' ' ' MET . . . . . . . . . . . . . 10.3 mtt -80.11 -56.81 0.7 Allowed Pre-proline 0 N--CA 1.497 1.892 0 O-C-N 121.623 -0.673 . . . . 12.43 110.614 179.429 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 41.2 Cg_endo -73.18 145.09 38.48 Favored 'Trans proline' 0 N--CA 1.487 1.135 0 O-C-N 123.231 1.122 . . . . 12.01 110.29 -178.549 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 50.2 mttp -111.3 125.89 54.31 Favored 'General case' 0 N--CA 1.496 1.849 0 O-C-N 121.69 -0.631 . . . . 15.83 110.133 179.195 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 28.7 m120 -141.36 167.25 22.61 Favored 'General case' 0 N--CA 1.495 1.783 0 O-C-N 121.761 -0.587 . . . . 14.960000000000001 110.232 179.4 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . -126.31 41.04 1.7 Allowed Glycine 0 N--CA 1.495 2.615 0 N-CA-C 109.623 -1.391 . . . . 16.620000000000001 109.623 -179.731 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 39.7 p -120.6 153.66 36.5 Favored 'General case' 0 N--CA 1.495 1.823 0 O-C-N 121.662 -0.905 . . . . 17.77 110.229 179.779 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 66.9 tttt -66.58 -38.06 86.24 Favored 'General case' 0 N--CA 1.499 2.019 0 O-C-N 121.754 -0.592 . . . . 20.449999999999999 110.347 -179.612 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 1.4 t 52.83 64.3 7.44 Favored Pre-proline 0 N--CA 1.504 2.233 0 O-C-N 121.552 -0.718 . . . . 20.359999999999999 110.787 -178.555 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 25.4 Cg_endo -66.11 -32.61 42.98 Favored 'Trans proline' 0 N--CA 1.488 1.198 0 O-C-N 123.542 1.285 . . . . 21.91 110.635 -178.278 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 23.6 p -119.63 143.87 47.45 Favored 'General case' 0 N--CA 1.495 1.813 0 O-C-N 121.6 -0.687 . . . . 22.420000000000002 110.307 -179.269 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 24.5 m -69.26 -35.68 76.34 Favored 'General case' 0 N--CA 1.498 1.948 0 O-C-N 121.736 -0.603 . . . . 23.309999999999999 110.129 179.349 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 30.4 m120 53.35 44.91 29.44 Favored 'General case' 0 N--CA 1.507 2.382 0 O-C-N 121.717 -0.614 . . . . 24.309999999999999 110.838 -179.851 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 96.3 p -100.26 146.39 26.97 Favored 'General case' 0 N--CA 1.495 1.775 0 O-C-N 121.624 -0.672 . . . . 24.829999999999998 110.155 179.559 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 35.5 p -138.55 39.43 2.23 Favored 'General case' 0 N--CA 1.494 1.76 0 O-C-N 121.69 -0.631 . . . . 26.440000000000001 110.238 -178.992 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 57.7 tttm -67.93 129.04 38.69 Favored 'General case' 0 N--CA 1.5 2.032 0 O-C-N 121.609 -0.682 . . . . 28.149999999999999 110.209 -179.167 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 81.8 mt 53.36 178.97 0.02 OUTLIER 'General case' 0 N--CA 1.507 2.403 0 O-C-N 121.73 -0.606 . . . . 28.030000000000001 111.199 -179.127 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 42.9 tttp 51.97 91.47 0.02 OUTLIER 'General case' 0 N--CA 1.506 2.337 0 O-C-N 121.579 -0.7 . . . . 28.489999999999998 110.994 -179.555 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 27.5 t -115.44 140.86 48.76 Favored 'General case' 0 N--CA 1.496 1.837 0 O-C-N 121.67 -0.644 . . . . 28.789999999999999 110.178 -179.4 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -113.12 -172.01 1.98 Allowed 'General case' 0 N--CA 1.495 1.793 0 O-C-N 121.623 -0.673 . . . . 29.399999999999999 110.142 179.665 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 50.9 mt-10 -97.76 26.41 5.13 Favored 'General case' 0 N--CA 1.496 1.854 0 O-C-N 121.635 -0.665 . . . . 30.48 110.719 -180.0 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 24.4 m -125.85 138.87 53.83 Favored 'General case' 0 N--CA 1.494 1.772 0 O-C-N 121.469 -0.769 . . . . 32.57 110.16 -179.919 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 99.0 m-85 -117.57 137.75 52.38 Favored 'General case' 0 N--CA 1.496 1.866 0 O-C-N 121.717 -0.614 . . . . 33.789999999999999 110.174 -179.999 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 31.9 t -127.69 140.52 52.02 Favored 'General case' 0 N--CA 1.495 1.798 0 O-C-N 121.689 -0.632 . . . . 34.380000000000003 110.21 179.477 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 32.1 t -129.12 138.08 51.59 Favored 'General case' 0 N--CA 1.496 1.848 0 O-C-N 121.739 -0.601 . . . . 35.719999999999999 110.204 179.873 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 27.1 mtpp 55.43 -84.93 0.01 OUTLIER 'General case' 0 N--CA 1.506 2.341 0 O-C-N 121.889 -0.507 . . . . 36.18 111.309 -179.203 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 46.2 p-10 -146.99 148.99 32.26 Favored 'General case' 0 N--CA 1.496 1.852 0 O-C-N 121.114 -0.991 . . . . 37.240000000000002 110.345 -179.438 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 49.7 mttp -66.68 -39.17 88.03 Favored 'General case' 0 N--CA 1.499 2.007 0 O-C-N 121.668 -0.645 . . . . 39.539999999999999 110.347 -179.728 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 91' ' ' TRP . . . . . . . . . . . . . 98.5 m95 -116.82 135.64 53.58 Favored 'General case' 0 N--CA 1.495 1.812 0 O-C-N 121.651 -0.656 . . . . 39.640000000000001 110.24 -179.736 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 50.5 m -126.58 144.75 50.79 Favored 'General case' 0 N--CA 1.495 1.823 0 O-C-N 121.746 -0.596 . . . . 39.159999999999997 110.236 179.255 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 93' ' ' MET . . . . . . . . . . . . . 13.4 mmt 52.58 31.91 10.83 Favored 'General case' 0 N--CA 1.504 2.267 0 O-C-N 121.615 -0.678 . . . . 41.229999999999997 111.13 179.496 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 7.0 m-20 . . . . . 0 N--CA 1.495 1.788 0 CA-C-O 117.946 -1.026 . . . . 40.799999999999997 110.273 179.202 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' B' B ' 240' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.295 0 N-CA-C 109.499 -1.44 . . . . 23.280000000000001 109.499 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' B' B ' 241' ' ' ALA . . . . . . . . . . . . . . . -103.7 145.32 30.24 Favored 'General case' 0 N--CA 1.495 1.807 0 O-C-N 121.678 -0.895 . . . . 21.82 110.189 -179.949 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 242' ' ' THR . . . . . . . . . . . . . 52.7 p -128.2 164.13 23.19 Favored 'General case' 0 N--CA 1.496 1.843 0 O-C-N 121.665 -0.647 . . . . 19.989999999999998 110.094 -179.933 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 243' ' ' THR . . . . . . . . . . . . . 23.9 m -65.47 -39.24 91.74 Favored 'General case' 0 N--CA 1.501 2.079 0 O-C-N 121.685 -0.634 . . . . 18.5 110.371 -179.758 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 244' ' ' LYS . . . . . . . . . . . . . 45.3 mtpt -103.56 133.31 48.8 Favored 'General case' 0 N--CA 1.495 1.785 0 O-C-N 121.653 -0.654 . . . . 17.829999999999998 110.15 179.702 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 245' ' ' GLU . . . . . . . . . . . . . 54.7 mt-10 -68.36 -34.24 75.72 Favored 'General case' 0 N--CA 1.499 1.996 0 O-C-N 121.653 -0.654 . . . . 15.5 110.267 179.692 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 246' ' ' LYS . . . . . . . . . . . . . 39.2 tttp -96.85 132.1 42.93 Favored 'General case' 0 N--CA 1.494 1.761 0 O-C-N 121.742 -0.599 . . . . 16.68 110.228 -179.665 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 247' ' ' ASN . . . . . . . . . . . . . 35.2 t-20 -131.41 -54.24 1.02 Allowed 'General case' 0 N--CA 1.495 1.823 0 O-C-N 121.701 -0.624 . . . . 12.92 110.126 179.4 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 248' ' ' ILE . . . . . . . . . . . . . 33.8 pt 38.99 -159.78 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.515 2.814 0 N-CA-C 112.253 0.464 . . . . 11.91 112.253 -179.648 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 249' ' ' SER . . . . . 0.456 ' C ' HG22 ' B' ' 250' ' ' VAL . 56.7 p -138.47 -64.01 0.53 Allowed 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.322 -0.861 . . . . 9.0299999999999994 110.228 178.919 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 250' ' ' VAL . . . . . 0.456 HG22 ' C ' ' B' ' 249' ' ' SER . 19.7 m 41.19 -159.46 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.515 2.797 0 N-CA-C 112.118 0.414 . . . . 8.1300000000000008 112.118 177.827 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 251' ' ' ASP . . . . . . . . . . . . . 8.8 p-10 -161.2 103.88 1.28 Allowed 'General case' 0 N--CA 1.497 1.89 0 O-C-N 121.367 -0.833 . . . . 6.3600000000000003 110.312 179.09 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 252' ' ' VAL . . . . . 0.574 ' O ' HG13 ' B' ' 252' ' ' VAL . 8.3 p -162.22 81.86 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.497 1.88 0 O-C-N 121.596 -0.69 . . . . 4.5800000000000001 110.02 -179.882 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 253' ' ' ASP . . . . . . . . . . . . . 74.5 m-20 -79.93 140.1 36.81 Favored 'General case' 0 N--CA 1.497 1.918 0 O-C-N 121.457 -0.777 . . . . 3.4700000000000002 110.349 -177.834 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 254' ' ' ALA . . . . . . . . . . . . . . . -66.8 -23.86 66.11 Favored 'General case' 0 N--CA 1.5 2.047 0 O-C-N 121.8 -0.562 . . . . 1.46 110.768 178.935 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 255' ' ' ASP . . . . . . . . . . . . . 16.7 t70 -70.75 -28.72 64.91 Favored 'General case' 0 N--CA 1.499 1.994 0 O-C-N 121.528 -0.732 . . . . 2.1099999999999999 110.465 -178.781 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 256' ' ' ALA . . . . . . . . . . . . . . . -63.19 -38.04 89.6 Favored 'General case' 0 N--CA 1.501 2.11 0 O-C-N 121.475 -0.766 . . . . 0.81999999999999995 110.42 179.689 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 257' ' ' SER . . . . . . . . . . . . . 49.0 m -55.37 -34.98 64.78 Favored 'General case' 0 N--CA 1.503 2.207 0 O-C-N 121.586 -0.696 . . . . 1.2 110.459 177.74 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 258' ' ' SER . . . . . . . . . . . . . 25.4 m -69.07 -32.27 71.6 Favored 'General case' 0 N--CA 1.498 1.968 0 C-N-CA 120.502 -0.479 . . . . 1.3 110.3 -179.883 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 259' ' ' GLN . . . . . . . . . . . . . 98.5 mt-30 -63.42 -36.88 85.2 Favored 'General case' 0 N--CA 1.501 2.086 0 O-C-N 121.557 -0.714 . . . . 2.2400000000000002 110.46 -179.038 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 260' ' ' LEU . . . . . 0.423 HD21 ' CE1' ' A' ' 6' ' ' PHE . 83.3 mt -68.18 -43.9 77.1 Favored 'General case' 0 N--CA 1.5 2.051 0 O-C-N 121.691 -0.631 . . . . 0.48999999999999999 110.206 179.349 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 261' ' ' LEU . . . . . . . . . . . . . 21.7 tp -68.88 -35.06 76.43 Favored 'General case' 0 N--CA 1.498 1.932 0 O-C-N 121.703 -0.623 . . . . 0.39000000000000001 109.756 176.039 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 262' ' ' SER . . . . . . . . . . . . . 23.1 t -62.74 -37.98 88.74 Favored 'General case' 0 N--CA 1.5 2.028 0 O-C-N 121.714 -0.616 . . . . 1.21 110.599 178.127 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 263' ' ' LEU . . . . . . . . . . . . . 33.8 mt -65.55 -46.64 78.73 Favored 'General case' 0 N--CA 1.501 2.117 0 O-C-N 121.663 -0.648 . . . . 0.64000000000000001 110.09 -179.212 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 264' ' ' LEU . . . . . . . . . . . . . 81.2 mt -63.68 -33.73 76.27 Favored 'General case' 0 N--CA 1.502 2.139 0 O-C-N 121.805 -0.56 . . . . 0.81999999999999995 110.651 178.103 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 265' ' ' LYS . . . . . . . . . . . . . 22.5 ttmt -75.68 -42.13 52.01 Favored 'General case' 0 N--CA 1.498 1.934 0 O-C-N 121.67 -0.644 . . . . 2.6600000000000001 110.37 -177.029 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 266' ' ' SER . . . . . . . . . . . . . 85.7 p -163.01 169.51 19.46 Favored 'General case' 0 N--CA 1.496 1.859 0 O-C-N 121.65 -0.656 . . . . 2.6200000000000001 110.389 -178.699 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 267' ' ' SER . . . . . . . . . . . . . 22.7 t -64.97 -31.32 72.5 Favored 'General case' 0 N--CA 1.501 2.095 0 O-C-N 121.742 -0.599 . . . . 3.8700000000000001 110.638 -179.939 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 268' ' ' THR . . . . . . . . . . . . . 3.2 m 65.28 -66.08 0.15 Allowed 'General case' 0 N--CA 1.509 2.498 0 O-C-N 121.944 -0.473 . . . . 6.2800000000000002 110.844 -176.839 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 269' ' ' ALA . . . . . 0.548 ' HB1' ' HD2' ' B' ' 270' ' ' PRO . . . 55.43 177.3 0.03 OUTLIER Pre-proline 0 N--CA 1.506 2.35 0 O-C-N 121.336 -0.853 . . . . 7.5999999999999996 111.108 -179.74 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 270' ' ' PRO . . . . . 0.548 ' HD2' ' HB1' ' B' ' 269' ' ' ALA . 20.5 Cg_exo -62.19 -37.1 65.09 Favored 'Trans proline' 0 N--CA 1.49 1.302 0 O-C-N 123.58 1.305 . . . . 9.4000000000000004 110.87 -178.749 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 271' ' ' SER . . . . . . . . . . . . . 27.5 t -144.36 129.19 18.35 Favored 'General case' 0 N--CA 1.495 1.783 0 O-C-N 121.692 -0.63 . . . . 11.68 110.473 -179.214 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 272' ' ' ASP . . . . . 0.544 ' OD2' ' HB3' ' B' ' 269' ' ' ALA . 3.2 m-20 -161.24 47.66 0.21 Allowed 'General case' 0 N--CA 1.495 1.821 0 CA-C-O 121.324 0.583 . . . . 13.91 109.849 178.644 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 273' ' ' LEU . . . . . . . . . . . . . 20.4 tp -162.06 -44.42 0.04 OUTLIER 'General case' 0 N--CA 1.497 1.881 0 O-C-N 121.531 -0.731 . . . . 16.84 110.184 -178.548 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 274' ' ' ALA . . . . . . . . . . . . . . . -74.95 -178.85 3.95 Favored 'General case' 0 N--CA 1.498 1.927 0 O-C-N 121.642 -0.661 . . . . 15.529999999999999 110.156 179.983 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 275' ' ' THR . . . . . . . . . . . . . 37.9 p -68.09 158.4 84.12 Favored Pre-proline 0 N--CA 1.5 2.045 0 O-C-N 121.707 -0.62 . . . . 16.75 110.171 -179.243 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 276' ' ' PRO . . . . . . . . . . . . . 21.5 Cg_exo -61.38 136.45 63.89 Favored 'Trans proline' 0 N--CA 1.491 1.359 0 O-C-N 123.571 1.301 . . . . 18.02 110.702 -179.605 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 277' ' ' GLN . . . . . . . . . . . . . 39.2 mm-40 -141.88 158.81 61.46 Favored Pre-proline 0 N--CA 1.494 1.749 0 O-C-N 121.673 -0.642 . . . . 20.350000000000001 110.173 179.272 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 278' ' ' PRO . . . . . . . . . . . . . 28.7 Cg_endo -67.58 115.52 3.77 Favored 'Trans proline' 0 N--CA 1.487 1.132 0 O-C-N 123.648 1.341 . . . . 20.309999999999999 110.362 179.701 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 279' ' ' SER . . . . . . . . . . . . . 87.6 p -151.86 160.97 43.37 Favored 'General case' 0 N--CA 1.495 1.804 0 O-C-N 121.732 -0.605 . . . . 21.949999999999999 110.205 179.965 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 280' ' ' THR . . . . . . . . . . . . . 24.6 m -126.13 140.4 52.6 Favored 'General case' 0 N--CA 1.495 1.824 0 O-C-N 121.671 -0.643 . . . . 23.359999999999999 110.116 179.635 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 281' ' ' PHE . . . . . . . . . . . . . 21.6 t80 -124.39 79.49 60.84 Favored Pre-proline 0 N--CA 1.495 1.82 0 O-C-N 121.712 -0.617 . . . . 24.559999999999999 110.074 179.478 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 282' ' ' PRO . . . . . . . . . . . . . 28.1 Cg_endo -67.16 141.17 56.33 Favored 'Trans proline' 0 N--CA 1.488 1.188 0 O-C-N 123.491 1.258 . . . . 26.210000000000001 110.422 -179.648 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 283' ' ' GLN . . . . . . . . . . . . . 45.6 tt0 -130.91 86.54 51.77 Favored Pre-proline 0 N--CA 1.496 1.832 0 O-C-N 121.653 -0.655 . . . . 27.379999999999999 110.149 179.43 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 284' ' ' PRO . . . . . . . . . . . . . 29.8 Cg_endo -68.24 151.95 76.29 Favored 'Trans proline' 0 N--CA 1.487 1.122 0 O-C-N 123.591 1.311 . . . . 28.449999999999999 110.312 -179.85 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 285' ' ' PRO . . . . . . . . . . . . . 30.0 Cg_endo -67.9 -34.18 24.44 Favored 'Trans proline' 0 N--CA 1.488 1.153 0 O-C-N 123.599 1.315 . . . . 29.23 110.451 -179.159 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 286' ' ' VAL . . . . . . . . . . . . . 61.2 t -128.15 137.35 57.73 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.923 0 O-C-N 121.685 -0.635 . . . . 30.039999999999999 109.866 -179.014 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 287' ' ' GLU . . . . . . . . . . . . . 46.3 mt-10 -107.58 145.93 32.6 Favored 'General case' 0 N--CA 1.496 1.845 0 O-C-N 121.665 -0.647 . . . . 31.699999999999999 110.058 178.638 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 288' ' ' SER . . . . . . . . . . . . . 30.5 t -136.12 142.45 44.26 Favored 'General case' 0 N--CA 1.495 1.824 0 O-C-N 121.638 -0.664 . . . . 32.600000000000001 110.283 -179.642 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 289' ' ' HIS . . . . . . . . . . . . . 77.7 m80 -91.58 -31.71 15.8 Favored 'General case' 0 N--CA 1.497 1.877 0 O-C-N 121.656 -0.653 . . . . 33.079999999999998 110.364 179.239 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 290' ' ' SER . . . . . . . . . . . . . 50.7 m -121.04 148.45 44.13 Favored 'General case' 0 N--CA 1.496 1.829 0 O-C-N 121.635 -0.666 . . . . 33.490000000000002 110.194 179.728 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 291' ' ' SER . . . . . . . . . . . . . 42.5 m . . . . . 0 N--CA 1.494 1.773 0 CA-C-O 117.993 -1.003 . . . . 34.909999999999997 110.213 179.987 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' -1' ' ' MET . . . . . . . . . . . . . 74.4 mtm . . . . . 0 N--CA 1.494 1.727 0 CA-C-O 120.989 0.423 . . . . 0.0 110.112 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 0' ' ' GLY . . . . . . . . . . . . . . . 158.19 -151.32 22.42 Favored Glycine 0 N--CA 1.494 2.527 0 N-CA-C 109.51 -1.436 . . . . 0.0 109.51 -179.711 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 90.1 mtp -94.39 148.02 22.65 Favored 'General case' 0 N--CA 1.496 1.833 0 O-C-N 121.675 -0.897 . . . . 0.0 110.103 179.856 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 70.7 m -101.05 167.25 10.36 Favored 'General case' 0 N--CA 1.495 1.794 0 O-C-N 121.661 -0.649 . . . . 0.0 110.085 -179.387 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 3' ' ' VAL . . . . . 0.416 HG12 ' CE1' ' A' ' 7' ' ' TYR . 73.2 t -66.18 -27.82 41.85 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.061 0 O-C-N 121.703 -0.623 . . . . 0.0 110.278 -179.153 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -55.06 -31.07 60.87 Favored 'General case' 0 N--CA 1.505 2.295 0 O-C-N 121.454 -0.779 . . . . 0.0 110.405 -178.907 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 74.4 m-20 -68.91 -30.62 69.13 Favored 'General case' 0 N--CA 1.499 1.991 0 O-C-N 121.845 -0.534 . . . . 0.0 110.279 174.886 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 96.1 m-85 -95.63 10.13 37.85 Favored 'General case' 0 N--CA 1.497 1.909 0 O-C-N 121.652 -0.655 . . . . 0.0 111.507 -178.025 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' TYR . . . . . 0.416 ' CE1' HG12 ' A' ' 3' ' ' VAL . 3.1 m-30 -67.28 133.18 49.2 Favored 'General case' 0 N--CA 1.502 2.141 0 O-C-N 121.17 -0.956 . . . . 0.0 110.018 173.986 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' GLY . . . . . 0.417 ' O ' HG13 ' A' ' 24' ' ' VAL . . . 83.66 -2.15 87.75 Favored Glycine 0 N--CA 1.497 2.753 0 N-CA-C 110.695 -0.962 . . . . 0.0 110.695 -176.086 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 30.4 t -77.27 138.91 39.67 Favored 'General case' 0 N--CA 1.497 1.918 0 O-C-N 121.11 -1.23 . . . . 0.0 110.461 177.948 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 14.8 t-20 -83.7 121.99 28.03 Favored 'General case' 0 N--CA 1.497 1.924 0 O-C-N 121.69 -0.631 . . . . 0.0 109.659 173.652 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . 0.457 HG12 ' HA ' ' A' ' 57' ' ' ILE . 35.8 m -143.24 159.75 17.46 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.775 0 O-C-N 121.79 -0.568 . . . . 0.0 109.598 -179.22 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . 0.565 ' HB2' HD11 ' A' ' 58' ' ' LEU . 46.5 tt0 -109.45 123.74 49.87 Favored 'General case' 0 N--CA 1.493 1.71 0 C-N-CA 119.901 -0.72 . . . . 0.0 109.984 177.009 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . 0.594 HG22 ' CD2' ' A' ' 55' ' ' LEU . 60.3 t -106.77 123.4 61.74 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.822 0 O-C-N 121.592 -0.693 . . . . 0.0 109.964 -177.128 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 27.0 tp -96.03 127.53 42.13 Favored 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.69 -0.631 . . . . 0.0 109.622 175.537 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 84.6 mt -97.83 169.87 9.36 Favored 'General case' 0 N--CA 1.495 1.813 0 O-C-N 121.623 -0.673 . . . . 0.0 110.977 -171.945 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 25.0 p30 -58.07 -21.18 44.71 Favored 'General case' 0 N--CA 1.505 2.314 0 O-C-N 121.782 -0.574 . . . . 0.0 111.594 -178.427 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 52.9 p-10 -90.27 21.01 4.02 Favored 'General case' 0 N--CA 1.499 1.978 0 O-C-N 121.548 -0.72 . . . . 0.0 111.121 -177.372 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 74.4 m-20 58.84 27.39 16.05 Favored 'General case' 0 N--CA 1.505 2.298 0 O-C-N 121.36 -0.838 . . . . 0.0 110.734 175.046 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 49.1 m -109.76 133.85 52.67 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.486 -0.759 . . . . 0.0 109.613 172.159 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 22.2 ttpt -109.78 143.12 40.06 Favored 'General case' 0 N--CA 1.494 1.748 0 O-C-N 121.618 -0.677 . . . . 0.0 110.738 -176.377 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -153.08 159.72 42.84 Favored 'General case' 0 N--CA 1.495 1.805 0 O-C-N 121.756 -0.59 . . . . 0.0 109.838 178.264 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . 0.519 ' O ' HD13 ' A' ' 39' ' ' LEU . 33.9 ptt-85 -141.27 148.64 40.15 Favored 'General case' 0 N--CA 1.497 1.895 0 O-C-N 121.625 -0.672 . . . . 0.0 110.831 -178.779 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -171.7 171.41 44.06 Favored Glycine 0 N--CA 1.495 2.631 0 N-CA-C 108.805 -1.718 . . . . 0.0 108.805 -176.589 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . 0.417 HG13 ' O ' ' A' ' 8' ' ' GLY . 46.4 t -94.57 122.5 46.08 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.944 0 O-C-N 121.428 -1.042 . . . . 0.0 109.348 -175.371 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 25' ' ' ILE . . . . . 0.642 ' HA ' HD23 ' A' ' 37' ' ' LEU . 93.6 mt -64.85 142.73 16.54 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.152 0 O-C-N 121.665 -0.647 . . . . 0.0 110.496 -172.066 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . 0.627 HG21 ' HB2' ' A' ' 38' ' ' ARG . 6.7 p -121.22 -26.46 5.07 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.758 -0.589 . . . . 0.0 111.363 179.09 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 27' ' ' ASN . . . . . 0.523 ' O ' HD12 ' A' ' 35' ' ' LEU . 6.9 t-20 -162.07 160.49 27.49 Favored 'General case' 0 N--CA 1.499 2.009 0 C-N-CA 118.93 -1.108 . . . . 0.0 111.912 -179.109 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 28' ' ' PHE . . . . . 0.498 ' HE1' HG21 ' A' ' 49' ' ' THR . 86.8 t80 -150.03 127.49 11.49 Favored 'General case' 0 N--CA 1.498 1.935 0 N-CA-C 109.136 -0.69 . . . . 0.0 109.136 169.18 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 17.9 t70 -99.43 130.41 45.7 Favored 'General case' 0 N--CA 1.492 1.654 0 N-CA-C 109.002 -0.74 . . . . 0.0 109.002 -177.726 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 23.1 t -68.8 -50.31 51.23 Favored 'General case' 0 N--CA 1.498 1.956 0 C-N-CA 120.097 -0.641 . . . . 0.0 110.538 -176.268 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 21.8 t -59.57 -43.0 93.72 Favored 'General case' 0 N--CA 1.502 2.147 0 O-C-N 121.614 -0.679 . . . . 0.0 110.907 -174.415 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 91.6 m-20 -103.47 -10.02 18.87 Favored 'General case' 0 N--CA 1.498 1.929 0 O-C-N 121.628 -0.67 . . . . 0.0 111.615 -178.079 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 1.9 m 49.94 67.34 0.92 Allowed 'General case' 0 N--CA 1.508 2.443 0 O-C-N 121.072 -1.018 . . . . 0.0 110.938 -174.284 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 34' ' ' ILE . . . . . 1.123 HD12 HG22 ' A' ' 48' ' ' VAL . 46.9 mm -124.31 126.51 72.17 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.09 0 O-C-N 121.615 -0.678 . . . . 0.0 109.472 -175.753 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.523 HD12 ' O ' ' A' ' 27' ' ' ASN . 11.7 tp -115.8 121.17 41.64 Favored 'General case' 0 N--CA 1.494 1.75 0 O-C-N 121.692 -0.63 . . . . 0.0 110.517 -169.243 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 78.9 mt-30 -91.27 134.33 34.66 Favored 'General case' 0 N--CA 1.491 1.577 0 N-CA-C 109.436 -0.579 . . . . 0.0 109.436 173.684 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 0.642 HD23 ' HA ' ' A' ' 25' ' ' ILE . 89.3 mt -117.78 123.85 46.98 Favored 'General case' 0 N--CA 1.497 1.891 0 O-C-N 121.729 -0.607 . . . . 0.0 109.862 173.635 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 38' ' ' ARG . . . . . 0.627 ' HB2' HG21 ' A' ' 26' ' ' THR . 64.8 ttt180 -97.12 108.4 21.12 Favored 'General case' 0 N--CA 1.497 1.918 0 O-C-N 121.678 -0.639 . . . . 0.0 109.813 176.371 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.519 HD13 ' O ' ' A' ' 22' ' ' ARG . 19.1 tp -84.81 151.85 24.05 Favored 'General case' 0 N--CA 1.494 1.77 0 O-C-N 121.758 -0.589 . . . . 0.0 110.925 -174.522 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -65.88 -6.69 13.05 Favored 'General case' 0 N--CA 1.503 2.176 0 O-C-N 121.97 -0.456 . . . . 0.0 111.951 -172.481 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 91.6 m-20 -86.58 27.81 0.93 Allowed 'General case' 0 N--CA 1.498 1.974 0 O-C-N 121.103 -0.998 . . . . 0.0 110.909 174.73 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 7.9 t70 62.99 29.45 16.43 Favored 'General case' 0 N--CA 1.505 2.275 0 O-C-N 121.078 -1.014 . . . . 0.0 110.52 175.591 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 51.0 m -123.19 137.85 54.79 Favored 'General case' 0 N--CA 1.496 1.872 0 O-C-N 121.36 -0.837 . . . . 0.0 110.411 -179.651 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 8.9 t -98.89 151.02 21.31 Favored 'General case' 0 N--CA 1.497 1.902 0 O-C-N 121.754 -0.591 . . . . 0.0 110.278 176.08 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 85.4 tttt -149.81 119.12 6.83 Favored 'General case' 0 N--CA 1.494 1.767 0 O-C-N 121.579 -0.7 . . . . 0.0 110.301 178.183 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 91.2 p -96.12 122.87 39.42 Favored 'General case' 0 N--CA 1.496 1.827 0 O-C-N 121.647 -0.658 . . . . 0.0 110.175 178.653 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 82.3 mt -129.32 136.2 60.0 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.871 0 O-C-N 121.698 -0.626 . . . . 0.0 109.377 179.682 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 48' ' ' VAL . . . . . 1.123 HG22 HD12 ' A' ' 34' ' ' ILE . 59.3 t -82.37 127.6 39.5 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.91 0 O-C-N 121.6 -0.687 . . . . 0.0 109.196 178.762 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 49' ' ' THR . . . . . 0.498 HG21 ' HE1' ' A' ' 28' ' ' PHE . 37.5 p -59.92 -24.88 64.7 Favored 'General case' 0 N--CA 1.505 2.302 0 O-C-N 121.563 -0.711 . . . . 0.0 112.021 -170.265 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 91.4 mttt -56.84 -23.65 45.62 Favored 'General case' 0 N--CA 1.503 2.204 0 O-C-N 121.461 -0.774 . . . . 0.0 111.006 -176.616 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 45.7 p30 -84.34 2.75 38.96 Favored 'General case' 0 N--CA 1.498 1.957 0 C-N-CA 119.718 -0.793 . . . . 0.0 111.402 176.407 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 98.9 mt -75.12 126.15 35.55 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.119 0 O-C-N 121.204 -0.935 . . . . 0.0 109.997 178.17 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 40.9 tttp -92.79 -28.87 16.3 Favored 'General case' 0 N--CA 1.493 1.722 0 O-C-N 121.848 -0.532 . . . . 0.0 109.954 171.111 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 5.3 m-20 -163.98 155.27 16.14 Favored 'General case' 0 N--CA 1.501 2.086 0 O-C-N 121.806 -0.559 . . . . 0.0 110.005 -178.033 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . 0.594 ' CD2' HG22 ' A' ' 13' ' ' VAL . 85.2 mt -132.95 149.03 52.27 Favored 'General case' 0 N--CA 1.496 1.833 0 O-C-N 121.708 -0.62 . . . . 0.0 110.563 -178.973 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 6.6 ptm180 -151.52 136.05 16.99 Favored 'General case' 0 N--CA 1.497 1.88 0 O-C-N 121.784 -0.573 . . . . 0.0 109.893 175.262 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 57' ' ' ILE . . . . . 0.457 ' HA ' HG12 ' A' ' 11' ' ' VAL . 68.7 mt -84.42 133.18 29.84 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.893 0 O-C-N 121.424 -0.798 . . . . 0.0 109.876 175.841 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . 0.565 HD11 ' HB2' ' A' ' 12' ' ' GLU . 32.3 mt -84.7 141.89 39.04 Favored Pre-proline 0 N--CA 1.497 1.909 0 O-C-N 121.581 -0.7 . . . . 0.0 110.01 179.619 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 50.6 Cg_endo -74.78 65.84 5.84 Favored 'Trans proline' 0 N--CA 1.486 1.064 0 O-C-N 123.495 1.261 . . . . 0.0 110.229 179.188 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 39.4 tttp -93.8 -63.1 1.24 Allowed 'General case' 0 N--CA 1.496 1.827 0 O-C-N 121.498 -0.751 . . . . 0.0 110.274 -178.898 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 16.8 t-20 -115.94 120.06 37.94 Favored 'General case' 0 N--CA 1.495 1.793 0 O-C-N 121.647 -0.658 . . . . 0.0 110.219 -178.755 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 78.8 mt-10 -108.53 139.51 43.19 Favored 'General case' 0 N--CA 1.495 1.803 0 O-C-N 121.744 -0.598 . . . . 0.0 110.097 178.819 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 81.9 mt -120.44 130.08 74.84 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.924 0 O-C-N 121.592 -0.692 . . . . 0.0 109.747 -179.761 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 64' ' ' MET . . . . . . . . . . . . . 35.9 ttm 51.75 89.3 0.1 Allowed Pre-proline 0 N--CA 1.505 2.291 0 O-C-N 121.68 -0.637 . . . . 0.0 111.103 179.586 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 22.1 Cg_exo -61.37 -31.48 88.67 Favored 'Trans proline' 0 N--CA 1.491 1.347 0 O-C-N 123.511 1.269 . . . . 0.0 110.701 179.166 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 8.7 tttm 53.35 -163.06 0.1 Allowed 'General case' 0 N--CA 1.507 2.398 0 O-C-N 121.573 -0.705 . . . . 0.0 110.616 179.429 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 89.3 m-20 53.16 39.1 29.09 Favored 'General case' 0 N--CA 1.506 2.346 0 O-C-N 121.502 -0.749 . . . . 0.0 110.901 179.618 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . -75.98 141.98 27.93 Favored Glycine 0 N--CA 1.494 2.507 0 N-CA-C 109.481 -1.447 . . . . 0.0 109.481 179.382 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 24.5 m -124.69 132.4 53.4 Favored 'General case' 0 N--CA 1.495 1.787 0 O-C-N 121.695 -0.885 . . . . 0.0 110.218 -179.842 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 55.0 mtmt -96.74 -33.01 11.86 Favored 'General case' 0 N--CA 1.495 1.823 0 O-C-N 121.65 -0.656 . . . . 0.0 110.253 178.855 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 3.9 m 60.12 159.55 0.11 Allowed Pre-proline 0 N--CA 1.507 2.412 0 O-C-N 121.694 -0.629 . . . . 0.0 110.932 -178.974 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 30.8 Cg_endo -68.45 173.23 10.06 Favored 'Trans proline' 0 N--CA 1.488 1.159 0 O-C-N 123.543 1.286 . . . . 0.0 110.378 179.232 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 30.0 t -97.06 144.93 26.46 Favored 'General case' 0 N--CA 1.495 1.776 0 O-C-N 121.734 -0.604 . . . . 0.0 110.218 179.874 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 23.6 m -117.85 144.92 44.97 Favored 'General case' 0 N--CA 1.495 1.802 0 O-C-N 121.629 -0.67 . . . . 0.0 110.135 -179.522 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 41.6 t-20 -62.72 -34.86 78.04 Favored 'General case' 0 N--CA 1.501 2.12 0 O-C-N 121.678 -0.639 . . . . 0.0 110.602 -178.407 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 22.6 t -63.34 -33.51 75.68 Favored 'General case' 0 N--CA 1.501 2.088 0 O-C-N 121.634 -0.666 . . . . 0.0 110.377 179.943 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 40.3 p -106.67 31.59 5.15 Favored 'General case' 0 N--CA 1.495 1.808 0 O-C-N 121.712 -0.618 . . . . 0.0 110.322 179.009 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 18.8 tptm -62.11 -38.68 89.84 Favored 'General case' 0 N--CA 1.502 2.139 0 O-C-N 121.59 -0.694 . . . . 0.0 110.332 -179.402 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 15.2 tp -112.86 129.24 56.52 Favored 'General case' 0 N--CA 1.495 1.802 0 O-C-N 121.736 -0.603 . . . . 0.0 110.086 178.945 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 49.3 mttp -94.86 148.4 22.34 Favored 'General case' 0 N--CA 1.495 1.785 0 O-C-N 121.668 -0.645 . . . . 0.0 110.276 -179.991 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 85.5 p -77.76 165.03 24.7 Favored 'General case' 0 N--CA 1.498 1.93 0 O-C-N 121.724 -0.61 . . . . 0.0 110.198 -179.777 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -97.73 142.66 29.24 Favored 'General case' 0 N--CA 1.495 1.796 0 O-C-N 121.652 -0.655 . . . . 0.0 110.256 -179.885 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 13.4 pt-20 -64.93 -30.59 71.59 Favored 'General case' 0 N--CA 1.501 2.101 0 O-C-N 121.687 -0.633 . . . . 0.0 110.681 -179.612 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 24.6 m -112.75 139.99 47.9 Favored 'General case' 0 N--CA 1.496 1.84 0 O-C-N 121.626 -0.671 . . . . 0.0 110.169 -179.854 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 59.4 t80 -121.81 140.18 52.68 Favored 'General case' 0 N--CA 1.496 1.827 0 O-C-N 121.703 -0.623 . . . . 0.0 110.123 179.803 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 92.2 p -116.73 157.92 24.69 Favored 'General case' 0 N--CA 1.495 1.784 0 O-C-N 121.609 -0.682 . . . . 0.0 110.246 -179.575 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 22.7 t -63.86 -33.44 75.69 Favored 'General case' 0 N--CA 1.501 2.084 0 O-C-N 121.652 -0.655 . . . . 0.0 110.437 -179.923 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 59.2 mttm -95.23 137.33 34.43 Favored 'General case' 0 N--CA 1.495 1.822 0 O-C-N 121.668 -0.645 . . . . 0.0 110.148 179.232 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 91.2 m-20 -108.79 122.16 46.57 Favored 'General case' 0 N--CA 1.496 1.866 0 O-C-N 121.709 -0.62 . . . . 0.0 110.189 -179.775 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 53.5 mttm -128.71 127.98 43.16 Favored 'General case' 0 N--CA 1.495 1.808 0 O-C-N 121.72 -0.613 . . . . 0.0 110.179 179.377 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 91' ' ' TRP . . . . . . . . . . . . . 74.5 t-105 -161.8 -61.08 0.05 OUTLIER 'General case' 0 N--CA 1.496 1.827 0 O-C-N 121.723 -0.611 . . . . 0.0 110.166 179.641 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 50.0 m -125.02 150.85 46.32 Favored 'General case' 0 N--CA 1.496 1.835 0 O-C-N 121.674 -0.641 . . . . 0.0 110.148 -179.846 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 93' ' ' MET . . . . . . . . . . . . . 74.2 mtm -64.61 -34.8 79.12 Favored 'General case' 0 N--CA 1.5 2.064 0 O-C-N 121.668 -0.645 . . . . 0.0 110.372 179.846 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 20.0 t70 . . . . . 0 N--CA 1.495 1.777 0 CA-C-O 118.026 -0.988 . . . . 0.0 110.148 179.913 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' B' B ' 240' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.286 0 N-CA-C 109.541 -1.423 . . . . 0.0 109.541 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' B' B ' 241' ' ' ALA . . . . . . . . . . . . . . . -144.13 153.73 42.44 Favored 'General case' 0 N--CA 1.495 1.807 0 O-C-N 121.71 -0.876 . . . . 0.0 110.192 179.975 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 242' ' ' THR . . . . . . . . . . . . . 40.2 p -124.28 161.47 25.77 Favored 'General case' 0 N--CA 1.496 1.828 0 O-C-N 121.69 -0.631 . . . . 0.0 110.209 179.978 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 243' ' ' THR . . . . . 0.467 HG22 ' O ' ' B' ' 243' ' ' THR . 18.9 m -107.45 30.92 5.81 Favored 'General case' 0 N--CA 1.496 1.852 0 O-C-N 121.67 -0.644 . . . . 0.0 110.364 179.943 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 244' ' ' LYS . . . . . . . . . . . . . 64.4 tttt -129.96 138.31 50.79 Favored 'General case' 0 N--CA 1.495 1.794 0 O-C-N 121.604 -0.685 . . . . 0.0 110.134 -179.724 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 245' ' ' GLU . . . . . . . . . . . . . 46.3 mt-10 -95.51 137.48 34.51 Favored 'General case' 0 N--CA 1.495 1.812 0 O-C-N 121.702 -0.624 . . . . 0.0 110.268 -179.576 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 246' ' ' LYS . . . . . . . . . . . . . 37.5 ttpt -65.87 -35.89 81.89 Favored 'General case' 0 N--CA 1.5 2.051 0 O-C-N 121.702 -0.624 . . . . 0.0 110.311 179.771 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 247' ' ' ASN . . . . . . . . . . . . . 91.8 m-20 -98.85 157.62 16.18 Favored 'General case' 0 N--CA 1.495 1.81 0 O-C-N 121.745 -0.597 . . . . 0.0 110.265 -178.869 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 248' ' ' ILE . . . . . . . . . . . . . 17.9 tt -161.57 165.33 0.73 Allowed 'Isoleucine or valine' 0 N--CA 1.496 1.873 0 O-C-N 121.75 -0.594 . . . . 0.0 110.005 -179.934 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 249' ' ' SER . . . . . 0.424 ' C ' HG23 ' B' ' 250' ' ' VAL . 33.1 m -113.85 139.46 49.15 Favored 'General case' 0 N--CA 1.496 1.827 0 O-C-N 121.691 -0.631 . . . . 0.0 110.262 -179.28 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 250' ' ' VAL . . . . . 0.424 HG23 ' C ' ' B' ' 249' ' ' SER . 91.3 t -149.65 141.36 17.31 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.951 0 O-C-N 121.671 -0.643 . . . . 0.0 109.382 179.797 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 251' ' ' ASP . . . . . . . . . . . . . 2.3 t0 52.88 -157.84 0.15 Allowed 'General case' 0 N--CA 1.506 2.355 0 O-C-N 121.555 -0.716 . . . . 0.0 110.772 179.253 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 252' ' ' VAL . . . . . . . . . . . . . 48.7 t 54.74 95.36 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.507 2.407 0 O-C-N 121.392 -0.817 . . . . 0.0 110.488 -179.733 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 253' ' ' ASP . . . . . . . . . . . . . 74.5 m-20 52.66 47.41 24.74 Favored 'General case' 0 N--CA 1.505 2.289 0 O-C-N 121.691 -0.631 . . . . 0.0 111.05 179.578 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 254' ' ' ALA . . . . . . . . . . . . . . . -68.43 -38.23 80.99 Favored 'General case' 0 N--CA 1.499 2.013 0 O-C-N 121.701 -0.624 . . . . 0.0 110.153 178.708 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 255' ' ' ASP . . . . . . . . . . . . . 16.5 t70 -74.13 -27.94 61.1 Favored 'General case' 0 N--CA 1.499 1.989 0 O-C-N 121.784 -0.572 . . . . 0.0 110.663 -179.431 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 256' ' ' ALA . . . . . . . . . . . . . . . -62.67 -44.29 96.65 Favored 'General case' 0 N--CA 1.501 2.116 0 O-C-N 121.48 -0.763 . . . . 0.0 110.568 -177.577 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 257' ' ' SER . . . . . . . . . . . . . 24.3 m -55.78 -37.64 68.83 Favored 'General case' 0 N--CA 1.503 2.213 0 O-C-N 121.596 -0.69 . . . . 0.0 110.389 178.1 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 258' ' ' SER . . . . . . . . . . . . . 24.0 m -69.56 -32.75 71.72 Favored 'General case' 0 N--CA 1.498 1.934 0 C-N-CA 120.501 -0.48 . . . . 0.0 110.252 179.189 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 259' ' ' GLN . . . . . . . . . . . . . 48.4 tt0 -63.05 -37.85 88.82 Favored 'General case' 0 N--CA 1.501 2.085 0 O-C-N 121.66 -0.65 . . . . 0.0 110.494 -179.248 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 260' ' ' LEU . . . . . . . . . . . . . 84.5 mt -67.47 -42.68 82.61 Favored 'General case' 0 N--CA 1.499 2.01 0 O-C-N 121.611 -0.681 . . . . 0.0 110.154 179.69 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 261' ' ' LEU . . . . . . . . . . . . . 23.1 tp -69.65 -35.87 75.57 Favored 'General case' 0 N--CA 1.497 1.913 0 O-C-N 121.665 -0.647 . . . . 0.0 109.743 175.802 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 262' ' ' SER . . . . . . . . . . . . . 22.8 t -62.72 -38.29 89.89 Favored 'General case' 0 N--CA 1.5 2.074 0 O-C-N 121.743 -0.598 . . . . 0.0 110.634 178.013 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 263' ' ' LEU . . . . . . . . . . . . . 34.9 mt -64.99 -43.51 92.35 Favored 'General case' 0 N--CA 1.501 2.123 0 O-C-N 121.673 -0.642 . . . . 0.0 110.221 -179.306 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 264' ' ' LEU . . . . . 0.451 ' CD1' HD11 ' A' ' 55' ' ' LEU . 84.0 mt -62.61 -32.7 73.76 Favored 'General case' 0 N--CA 1.502 2.159 0 O-C-N 121.734 -0.604 . . . . 0.0 110.67 178.137 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 265' ' ' LYS . . . . . . . . . . . . . 54.2 tttm -74.61 -33.94 62.72 Favored 'General case' 0 N--CA 1.498 1.962 0 O-C-N 121.665 -0.647 . . . . 0.0 110.187 -178.136 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 266' ' ' SER . . . . . . . . . . . . . 53.1 m -78.51 143.31 36.72 Favored 'General case' 0 N--CA 1.498 1.933 0 O-C-N 121.687 -0.633 . . . . 0.0 110.194 -179.755 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 267' ' ' SER . . . . . . . . . . . . . 87.3 p -153.5 165.09 36.94 Favored 'General case' 0 N--CA 1.495 1.775 0 O-C-N 121.709 -0.619 . . . . 0.0 110.229 -179.869 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 268' ' ' THR . . . . . . . . . . . . . 40.1 p -124.14 158.33 32.58 Favored 'General case' 0 N--CA 1.496 1.873 0 O-C-N 121.664 -0.647 . . . . 0.0 110.144 179.463 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 269' ' ' ALA . . . . . . . . . . . . . . . 48.09 85.58 0.17 Allowed Pre-proline 0 N--CA 1.506 2.357 0 O-C-N 121.778 -0.576 . . . . 0.0 111.346 -178.689 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 270' ' ' PRO . . . . . . . . . . . . . 28.1 Cg_endo -67.11 145.12 72.05 Favored 'Trans proline' 0 N--CA 1.489 1.207 0 O-C-N 123.588 1.309 . . . . 0.0 110.418 179.819 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 271' ' ' SER . . . . . . . . . . . . . 95.4 p -132.27 156.32 46.74 Favored 'General case' 0 N--CA 1.495 1.806 0 O-C-N 121.612 -0.68 . . . . 0.0 110.185 179.551 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 272' ' ' ASP . . . . . . . . . . . . . 26.4 t0 -129.4 108.94 10.67 Favored 'General case' 0 N--CA 1.496 1.843 0 O-C-N 121.707 -0.62 . . . . 0.0 110.211 -179.883 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 273' ' ' LEU . . . . . . . . . . . . . 20.3 tp 51.43 88.25 0.03 OUTLIER 'General case' 0 N--CA 1.506 2.345 0 O-C-N 121.643 -0.661 . . . . 0.0 111.103 179.874 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 274' ' ' ALA . . . . . . . . . . . . . . . 49.9 -165.79 0.03 OUTLIER 'General case' 0 N--CA 1.506 2.37 0 O-C-N 121.649 -0.657 . . . . 0.0 111.244 -179.81 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 275' ' ' THR . . . . . 0.461 HG22 ' O ' ' B' ' 277' ' ' GLN . 26.0 m -114.54 87.76 14.74 Favored Pre-proline 0 N--CA 1.495 1.815 0 O-C-N 121.687 -0.633 . . . . 0.0 110.073 179.848 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 276' ' ' PRO . . . . . . . . . . . . . 25.7 Cg_endo -66.25 -32.28 42.41 Favored 'Trans proline' 0 N--CA 1.49 1.275 0 O-C-N 123.54 1.284 . . . . 0.0 110.6 -178.764 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 277' ' ' GLN . . . . . 0.461 ' O ' HG22 ' B' ' 275' ' ' THR . 40.7 mm-40 -116.58 155.21 49.02 Favored Pre-proline 0 N--CA 1.495 1.806 0 O-C-N 121.603 -0.686 . . . . 0.0 110.238 -179.469 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 278' ' ' PRO . . . . . . . . . . . . . 29.3 Cg_endo -67.83 146.11 71.02 Favored 'Trans proline' 0 N--CA 1.488 1.198 0 O-C-N 123.686 1.361 . . . . 0.0 110.379 -179.58 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 279' ' ' SER . . . . . . . . . . . . . 89.2 p -66.74 -30.44 70.67 Favored 'General case' 0 N--CA 1.5 2.036 0 O-C-N 121.634 -0.666 . . . . 0.0 110.486 179.115 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 280' ' ' THR . . . . . . . . . . . . . 23.3 m -92.98 146.18 23.82 Favored 'General case' 0 N--CA 1.496 1.851 0 O-C-N 121.599 -0.688 . . . . 0.0 110.14 179.774 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 281' ' ' PHE . . . . . . . . . . . . . 63.2 m-85 -116.49 92.49 37.21 Favored Pre-proline 0 N--CA 1.495 1.787 0 O-C-N 121.653 -0.654 . . . . 0.0 110.24 -179.62 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 282' ' ' PRO . . . . . . . . . . . . . 23.6 Cg_exo -60.54 -30.0 89.75 Favored 'Trans proline' 0 N--CA 1.491 1.326 0 O-C-N 123.446 1.235 . . . . 0.0 110.85 179.601 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 283' ' ' GLN . . . . . . . . . . . . . 13.1 mm100 -87.27 160.62 48.19 Favored Pre-proline 0 N--CA 1.496 1.85 0 O-C-N 121.647 -0.658 . . . . 0.0 110.134 179.282 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 284' ' ' PRO . . . . . . . . . . . . . 28.5 Cg_endo -67.56 153.73 75.53 Favored 'Trans proline' 0 N--CA 1.487 1.128 0 O-C-N 123.685 1.361 . . . . 0.0 110.39 -179.235 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 285' ' ' PRO . . . . . . . . . . . . . 29.4 Cg_endo -67.77 153.06 76.78 Favored 'Trans proline' 0 N--CA 1.488 1.184 0 O-C-N 123.645 1.339 . . . . 0.0 110.391 -179.653 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 286' ' ' VAL . . . . . . . . . . . . . 61.0 t -107.81 135.41 46.56 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.897 0 O-C-N 121.658 -0.651 . . . . 0.0 109.674 179.534 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 287' ' ' GLU . . . . . . . . . . . . . 78.5 mt-10 -103.57 151.35 23.0 Favored 'General case' 0 N--CA 1.495 1.792 0 O-C-N 121.717 -0.614 . . . . 0.0 110.27 -179.249 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 288' ' ' SER . . . . . . . . . . . . . 28.6 t -120.95 146.37 46.73 Favored 'General case' 0 N--CA 1.495 1.796 0 O-C-N 121.659 -0.651 . . . . 0.0 110.194 179.861 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 289' ' ' HIS . . . . . . . . . . . . . 77.1 m80 -64.02 -35.15 79.77 Favored 'General case' 0 N--CA 1.501 2.088 0 O-C-N 121.658 -0.651 . . . . 0.0 110.443 -179.811 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 290' ' ' SER . . . . . . . . . . . . . 89.3 p -125.97 155.28 41.63 Favored 'General case' 0 N--CA 1.495 1.807 0 O-C-N 121.697 -0.627 . . . . 0.0 110.153 179.824 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 291' ' ' SER . . . . . . . . . . . . . 44.9 m . . . . . 0 N--CA 1.494 1.749 0 CA-C-O 117.96 -1.019 . . . . 0.0 110.225 179.985 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' -1' ' ' MET . . . . . . . . . . . . . 60.6 mtt . . . . . 0 N--CA 1.493 1.679 0 CA-C-O 120.985 0.421 . . . . 0.0 110.139 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 0' ' ' GLY . . . . . . . . . . . . . . . -84.6 -175.25 50.69 Favored Glycine 0 N--CA 1.493 2.494 0 N-CA-C 109.535 -1.426 . . . . 0.0 109.535 179.923 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 65.9 mtt -97.78 141.56 30.63 Favored 'General case' 0 N--CA 1.494 1.759 0 O-C-N 121.691 -0.888 . . . . 0.0 110.217 179.983 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 70.8 m -101.09 164.86 11.6 Favored 'General case' 0 N--CA 1.494 1.755 0 O-C-N 121.743 -0.598 . . . . 0.0 110.057 -179.631 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 3' ' ' VAL . . . . . 0.45 HG12 ' CE1' ' A' ' 7' ' ' TYR . 67.1 t -66.69 -27.92 41.56 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.084 0 O-C-N 121.652 -0.655 . . . . 0.0 110.086 179.474 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -55.02 -30.46 59.56 Favored 'General case' 0 N--CA 1.505 2.289 0 O-C-N 121.451 -0.781 . . . . 0.0 110.395 -179.523 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 74.4 m-20 -68.46 -31.15 70.25 Favored 'General case' 0 N--CA 1.499 1.99 0 O-C-N 121.802 -0.561 . . . . 0.0 110.186 174.676 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 96.1 m-85 -96.02 10.07 38.67 Favored 'General case' 0 N--CA 1.498 1.948 0 O-C-N 121.712 -0.618 . . . . 0.0 111.469 -178.755 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' TYR . . . . . 0.45 ' CE1' HG12 ' A' ' 3' ' ' VAL . 3.6 m-30 -67.19 140.28 57.46 Favored 'General case' 0 N--CA 1.503 2.178 0 O-C-N 121.153 -0.967 . . . . 0.0 110.102 174.647 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' GLY . . . . . 0.424 ' O ' HG13 ' A' ' 24' ' ' VAL . . . 82.33 0.05 89.43 Favored Glycine 0 N--CA 1.497 2.727 0 N-CA-C 110.574 -1.01 . . . . 0.0 110.574 -175.982 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 30.2 t -77.41 134.91 38.3 Favored 'General case' 0 N--CA 1.497 1.912 0 O-C-N 121.129 -1.218 . . . . 0.0 110.492 179.208 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 11.8 t-20 -83.23 118.73 23.83 Favored 'General case' 0 N--CA 1.497 1.889 0 O-C-N 121.625 -0.672 . . . . 0.0 109.596 173.063 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . 0.538 HG12 ' HA ' ' A' ' 57' ' ' ILE . 35.6 m -142.45 161.68 19.04 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.678 0 O-C-N 121.674 -0.641 . . . . 0.0 109.741 -177.381 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . 0.525 ' HB2' HD11 ' A' ' 58' ' ' LEU . 46.7 tt0 -109.32 147.41 32.74 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.684 -0.635 . . . . 0.0 109.632 177.103 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . 0.594 ' CG1' HG23 ' A' ' 52' ' ' ILE . 60.9 t -137.14 126.41 36.43 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.743 0 O-C-N 121.621 -0.674 . . . . 0.0 109.709 -175.36 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.442 HD13 ' HG2' ' A' ' 20' ' ' LYS . 23.7 tp -95.89 129.79 43.04 Favored 'General case' 0 N--CA 1.492 1.646 0 N-CA-C 109.432 -0.581 . . . . 0.0 109.432 176.525 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.503 HD23 ' HA ' ' A' ' 52' ' ' ILE . 82.3 mt -90.6 170.14 10.42 Favored 'General case' 0 N--CA 1.496 1.857 0 O-C-N 121.657 -0.652 . . . . 0.0 110.565 -175.53 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 23.9 p30 -56.8 -22.95 39.98 Favored 'General case' 0 N--CA 1.506 2.351 0 O-C-N 121.751 -0.593 . . . . 0.0 111.51 -177.799 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 53.6 p-10 -94.2 24.15 4.58 Favored 'General case' 0 N--CA 1.497 1.89 0 O-C-N 121.535 -0.728 . . . . 0.0 110.733 -177.714 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 10.4 m-20 59.41 28.43 17.8 Favored 'General case' 0 N--CA 1.506 2.346 0 O-C-N 121.446 -0.783 . . . . 0.0 110.607 175.721 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 50.3 m -103.87 144.83 30.98 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.437 -0.789 . . . . 0.0 109.659 172.359 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . 0.442 ' HG2' HD13 ' A' ' 14' ' ' LEU . 97.2 mttt -109.57 145.07 36.99 Favored 'General case' 0 N--CA 1.495 1.791 0 O-C-N 121.543 -0.723 . . . . 0.0 110.665 -176.166 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -153.05 133.4 13.58 Favored 'General case' 0 N--CA 1.496 1.86 0 O-C-N 121.713 -0.617 . . . . 0.0 110.229 176.359 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . 0.488 ' O ' HD13 ' A' ' 39' ' ' LEU . 35.1 ptt180 -128.48 144.78 51.2 Favored 'General case' 0 N--CA 1.498 1.957 0 O-C-N 121.685 -0.634 . . . . 0.0 110.39 -178.009 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -171.78 171.43 44.1 Favored Glycine 0 N--CA 1.496 2.635 0 N-CA-C 109.229 -1.548 . . . . 0.0 109.229 -175.36 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . 0.424 HG13 ' O ' ' A' ' 8' ' ' GLY . 47.4 t -94.59 119.11 42.11 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.986 0 O-C-N 121.609 -0.936 . . . . 0.0 109.355 -176.968 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 25' ' ' ILE . . . . . 0.423 ' HA ' HD23 ' A' ' 37' ' ' LEU . 89.7 mt -64.29 143.57 15.57 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.163 0 O-C-N 121.704 -0.623 . . . . 0.0 110.56 -171.381 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . 0.584 HG21 ' HB2' ' A' ' 38' ' ' ARG . 10.1 p -121.24 -25.89 5.17 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.773 -0.58 . . . . 0.0 111.237 178.246 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 2.0 t-20 -162.28 158.07 23.76 Favored 'General case' 0 N--CA 1.501 2.121 0 O-C-N 121.0 -1.063 . . . . 0.0 111.774 -179.08 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 28' ' ' PHE . . . . . 0.568 ' HE1' HG21 ' A' ' 49' ' ' THR . 91.2 t80 -150.16 124.29 9.43 Favored 'General case' 0 N--CA 1.5 2.056 0 N-CA-C 109.361 -0.607 . . . . 0.0 109.361 171.428 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . 0.402 ' O ' ' N ' ' A' ' 33' ' ' SER . 21.7 t70 -98.12 126.27 43.49 Favored 'General case' 0 N--CA 1.492 1.658 0 N-CA-C 109.091 -0.707 . . . . 0.0 109.091 -179.296 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 87.0 p -65.16 -43.03 93.1 Favored 'General case' 0 N--CA 1.5 2.07 0 O-C-N 121.65 -0.656 . . . . 0.0 110.778 -174.143 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 19.6 m -60.21 -48.05 83.37 Favored 'General case' 0 N--CA 1.503 2.196 0 O-C-N 121.522 -0.736 . . . . 0.0 110.884 -173.573 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 91.7 m-20 -107.07 -0.05 23.18 Favored 'General case' 0 N--CA 1.498 1.961 0 O-C-N 121.621 -0.675 . . . . 0.0 111.697 -179.258 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . 0.402 ' N ' ' O ' ' A' ' 29' ' ' ASP . 38.8 p 45.71 67.08 0.79 Allowed 'General case' 0 N--CA 1.508 2.45 0 O-C-N 121.423 -0.798 . . . . 0.0 111.142 -174.754 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 34' ' ' ILE . . . . . 1.074 HD12 HG22 ' A' ' 48' ' ' VAL . 44.8 mm -114.5 125.79 71.89 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.981 0 O-C-N 121.553 -0.717 . . . . 0.0 109.222 -175.917 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 11.3 tp -115.84 120.52 39.53 Favored 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.633 -0.667 . . . . 0.0 110.53 -168.605 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 67.3 mt-30 -91.04 132.11 36.21 Favored 'General case' 0 N--CA 1.489 1.51 0 N-CA-C 109.201 -0.666 . . . . 0.0 109.201 171.952 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 0.423 HD23 ' HA ' ' A' ' 25' ' ' ILE . 16.7 mt -117.77 123.76 46.77 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.812 -0.555 . . . . 0.0 110.07 175.837 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 38' ' ' ARG . . . . . 0.584 ' HB2' HG21 ' A' ' 26' ' ' THR . 72.8 ttt180 -96.29 104.95 16.95 Favored 'General case' 0 N--CA 1.496 1.868 0 O-C-N 121.721 -0.612 . . . . 0.0 109.79 176.001 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.488 HD13 ' O ' ' A' ' 22' ' ' ARG . 18.4 tp -84.56 153.63 23.13 Favored 'General case' 0 N--CA 1.495 1.803 0 O-C-N 121.699 -0.626 . . . . 0.0 110.949 -173.602 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -67.46 -4.59 11.77 Favored 'General case' 0 N--CA 1.503 2.201 0 O-C-N 121.895 -0.503 . . . . 0.0 111.986 -171.753 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 30.1 m120 -87.1 27.62 1.01 Allowed 'General case' 0 N--CA 1.498 1.925 0 O-C-N 121.063 -1.023 . . . . 0.0 110.871 174.063 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 15.3 t0 63.13 29.28 16.16 Favored 'General case' 0 N--CA 1.505 2.286 0 O-C-N 121.079 -1.013 . . . . 0.0 110.521 175.848 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 48.7 m -125.65 137.85 53.89 Favored 'General case' 0 N--CA 1.495 1.818 0 O-C-N 121.357 -0.839 . . . . 0.0 110.528 -179.33 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 9.7 t -97.94 151.03 20.7 Favored 'General case' 0 N--CA 1.497 1.917 0 O-C-N 121.764 -0.585 . . . . 0.0 110.122 174.986 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . 0.426 ' CE ' HD11 ' A' ' 47' ' ' ILE . 42.1 tttp -148.96 119.09 7.21 Favored 'General case' 0 N--CA 1.496 1.84 0 O-C-N 121.562 -0.711 . . . . 0.0 110.384 179.049 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 90.3 p -96.46 120.34 36.6 Favored 'General case' 0 N--CA 1.495 1.805 0 O-C-N 121.712 -0.617 . . . . 0.0 110.286 179.271 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 47' ' ' ILE . . . . . 0.426 HD11 ' CE ' ' A' ' 45' ' ' LYS . 82.5 mt -129.42 138.89 53.16 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.908 0 O-C-N 121.712 -0.618 . . . . 0.0 109.343 179.251 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 48' ' ' VAL . . . . . 1.074 HG22 HD12 ' A' ' 34' ' ' ILE . 63.2 t -82.12 127.69 39.39 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.955 0 C-N-CA 120.001 -0.679 . . . . 0.0 109.207 178.54 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 49' ' ' THR . . . . . 0.568 HG21 ' HE1' ' A' ' 28' ' ' PHE . 41.9 p -59.34 -25.08 63.9 Favored 'General case' 0 N--CA 1.504 2.235 0 O-C-N 121.624 -0.672 . . . . 0.0 112.059 -169.449 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 60.0 tttt -57.58 -23.15 49.2 Favored 'General case' 0 N--CA 1.502 2.149 0 O-C-N 121.546 -0.721 . . . . 0.0 111.261 -175.524 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 10.3 p30 -81.17 -3.46 52.26 Favored 'General case' 0 N--CA 1.499 2.01 0 C-N-CA 119.702 -0.799 . . . . 0.0 111.058 176.078 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 52' ' ' ILE . . . . . 0.761 HG21 HD11 ' A' ' 55' ' ' LEU . 95.8 mt -79.79 135.28 25.84 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.021 0 O-C-N 121.265 -0.897 . . . . 0.0 110.219 177.926 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 83.6 tttt -92.08 -28.47 17.11 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.9 -0.5 . . . . 0.0 109.785 170.294 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . 0.402 ' HA ' HD13 ' B' ' 261' ' ' LEU . 1.6 m-20 -164.83 158.46 17.42 Favored 'General case' 0 N--CA 1.503 2.204 0 O-C-N 121.735 -0.603 . . . . 0.0 110.287 -177.012 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . 0.761 HD11 HG21 ' A' ' 52' ' ' ILE . 4.2 mp -132.93 153.64 51.21 Favored 'General case' 0 N--CA 1.497 1.893 0 O-C-N 121.74 -0.6 . . . . 0.0 110.411 178.227 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 20.1 ptp180 -151.87 146.39 25.63 Favored 'General case' 0 N--CA 1.496 1.863 0 O-C-N 121.719 -0.613 . . . . 0.0 109.964 175.549 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 57' ' ' ILE . . . . . 0.538 ' HA ' HG12 ' A' ' 11' ' ' VAL . 62.4 mt -85.54 133.32 29.78 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.956 0 O-C-N 121.559 -0.713 . . . . 0.0 109.87 173.732 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . 0.525 HD11 ' HB2' ' A' ' 12' ' ' GLU . 61.3 mt -83.03 146.87 52.76 Favored Pre-proline 0 N--CA 1.498 1.946 0 O-C-N 121.559 -0.713 . . . . 0.0 110.073 -177.971 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 36.9 Cg_endo -70.8 140.22 38.3 Favored 'Trans proline' 0 N--CA 1.487 1.121 0 O-C-N 123.49 1.258 . . . . 0.0 110.229 178.742 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 83.8 tttt -96.4 -63.56 1.13 Allowed 'General case' 0 N--CA 1.494 1.753 0 O-C-N 121.623 -0.673 . . . . 0.0 110.196 179.472 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 89.4 m-20 52.9 42.44 32.06 Favored 'General case' 0 N--CA 1.506 2.345 0 O-C-N 121.549 -0.72 . . . . 0.0 110.936 -179.65 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 76.2 mt-10 -108.49 162.63 13.94 Favored 'General case' 0 N--CA 1.496 1.827 0 O-C-N 121.625 -0.672 . . . . 0.0 110.297 179.695 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 82.9 mt -107.81 141.02 24.1 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.868 0 O-C-N 121.702 -0.624 . . . . 0.0 109.56 179.452 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 64' ' ' MET . . . . . . . . . . . . . 13.2 mmt 51.81 86.48 0.16 Allowed Pre-proline 0 N--CA 1.505 2.321 0 O-C-N 121.612 -0.68 . . . . 0.0 110.848 -178.671 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 26.7 Cg_endo -66.49 134.64 36.4 Favored 'Trans proline' 0 N--CA 1.49 1.273 0 O-C-N 123.628 1.33 . . . . 0.0 110.482 -178.438 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 55.4 mmtt -66.08 -35.39 80.4 Favored 'General case' 0 N--CA 1.5 2.056 0 O-C-N 121.625 -0.672 . . . . 0.0 110.201 179.167 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 15.7 t-20 -65.08 -34.01 77.39 Favored 'General case' 0 N--CA 1.5 2.035 0 O-C-N 121.634 -0.666 . . . . 0.0 110.429 179.724 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 89.36 -163.72 31.54 Favored Glycine 0 N--CA 1.493 2.489 0 N-CA-C 109.465 -1.454 . . . . 0.0 109.465 -179.456 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 24.4 m -115.77 139.78 49.84 Favored 'General case' 0 N--CA 1.496 1.835 0 O-C-N 121.642 -0.917 . . . . 0.0 110.16 -179.5 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 98.4 mttt -101.06 155.93 17.71 Favored 'General case' 0 N--CA 1.495 1.81 0 O-C-N 121.69 -0.631 . . . . 0.0 110.225 -179.674 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 92.7 p -80.87 159.65 68.23 Favored Pre-proline 0 N--CA 1.497 1.912 0 O-C-N 121.677 -0.64 . . . . 0.0 110.015 178.622 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 20.7 Cg_endo -65.53 -57.07 0.28 Allowed 'Trans proline' 0 N--CA 1.489 1.206 0 O-C-N 123.599 1.315 . . . . 0.0 110.507 -179.377 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 70.1 m -135.69 131.53 35.78 Favored 'General case' 0 N--CA 1.496 1.827 0 O-C-N 121.747 -0.596 . . . . 0.0 110.251 179.085 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 24.3 m -78.97 -34.64 44.05 Favored 'General case' 0 N--CA 1.498 1.97 0 O-C-N 121.683 -0.636 . . . . 0.0 110.078 178.34 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 30.6 m120 56.08 168.85 0.03 OUTLIER 'General case' 0 N--CA 1.507 2.399 0 CA-C-O 121.277 0.56 . . . . 0.0 111.249 -179.086 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 32.7 t -160.97 157.37 26.24 Favored 'General case' 0 N--CA 1.495 1.777 0 O-C-N 121.589 -0.695 . . . . 0.0 110.225 -179.877 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 38.9 p -120.23 145.64 46.83 Favored 'General case' 0 N--CA 1.496 1.86 0 O-C-N 121.703 -0.623 . . . . 0.0 110.111 179.18 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 59.1 mttm -140.62 155.86 46.43 Favored 'General case' 0 N--CA 1.496 1.837 0 O-C-N 121.724 -0.61 . . . . 0.0 110.264 -179.982 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 82.6 mt -67.17 -33.32 75.16 Favored 'General case' 0 N--CA 1.499 2.002 0 O-C-N 121.654 -0.654 . . . . 0.0 110.353 179.089 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 35.1 ttmt -64.01 -42.58 97.1 Favored 'General case' 0 N--CA 1.502 2.152 0 O-C-N 121.673 -0.642 . . . . 0.0 110.532 -179.392 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 89.5 p -148.05 157.53 43.57 Favored 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.705 -0.622 . . . . 0.0 110.344 -179.793 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -146.13 155.86 43.03 Favored 'General case' 0 N--CA 1.495 1.776 0 O-C-N 121.728 -0.607 . . . . 0.0 110.17 -179.946 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 30.4 tp10 -100.75 132.34 46.2 Favored 'General case' 0 N--CA 1.494 1.767 0 O-C-N 121.725 -0.61 . . . . 0.0 110.142 179.92 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 25.0 m -128.09 139.98 52.21 Favored 'General case' 0 N--CA 1.495 1.786 0 O-C-N 121.723 -0.611 . . . . 0.0 110.097 179.618 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 69.7 t80 -111.54 122.17 47.12 Favored 'General case' 0 N--CA 1.495 1.792 0 O-C-N 121.683 -0.636 . . . . 0.0 110.219 179.733 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 88.8 p -151.99 159.16 43.82 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.741 -0.599 . . . . 0.0 110.154 179.685 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 92.3 p -146.96 156.29 42.94 Favored 'General case' 0 N--CA 1.494 1.758 0 O-C-N 121.616 -0.677 . . . . 0.0 110.265 179.569 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 4.3 mmpt? -124.68 124.21 41.69 Favored 'General case' 0 N--CA 1.495 1.81 0 O-C-N 121.6 -0.688 . . . . 0.0 110.126 179.296 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 91.1 m-20 -67.8 -36.59 80.69 Favored 'General case' 0 N--CA 1.5 2.04 0 O-C-N 121.696 -0.627 . . . . 0.0 110.188 179.429 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 30.6 mtmm -66.44 -34.54 78.17 Favored 'General case' 0 N--CA 1.5 2.061 0 O-C-N 121.683 -0.636 . . . . 0.0 110.44 -179.956 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 91' ' ' TRP . . . . . . . . . . . . . 71.6 t-105 -64.03 -36.43 83.98 Favored 'General case' 0 N--CA 1.502 2.136 0 O-C-N 121.607 -0.683 . . . . 0.0 110.538 -178.386 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 96.9 p -108.42 155.21 20.82 Favored 'General case' 0 N--CA 1.496 1.829 0 O-C-N 121.686 -0.634 . . . . 0.0 110.274 -178.838 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 93' ' ' MET . . . . . . . . . . . . . 74.4 mtm -122.19 156.03 34.57 Favored 'General case' 0 N--CA 1.495 1.804 0 O-C-N 121.677 -0.639 . . . . 0.0 110.195 -179.988 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 26.3 t0 . . . . . 0 N--CA 1.495 1.812 0 CA-C-O 118.039 -0.982 . . . . 0.0 110.145 179.973 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' B' B ' 240' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.336 0 N-CA-C 109.502 -1.439 . . . . 0.0 109.502 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' B' B ' 241' ' ' ALA . . . . . . . . . . . . . . . 53.29 32.68 14.01 Favored 'General case' 0 N--CA 1.506 2.356 0 O-C-N 121.554 -0.968 . . . . 0.0 110.954 179.82 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 242' ' ' THR . . . . . . . . . . . . . 42.7 p -68.2 -34.0 75.46 Favored 'General case' 0 N--CA 1.499 2.0 0 O-C-N 121.565 -0.709 . . . . 0.0 110.215 -179.782 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 243' ' ' THR . . . . . . . . . . . . . 40.5 p -126.3 159.62 32.62 Favored 'General case' 0 N--CA 1.497 1.896 0 O-C-N 121.707 -0.621 . . . . 0.0 110.205 179.52 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 244' ' ' LYS . . . . . . . . . . . . . 47.6 pttt -67.2 140.86 57.46 Favored 'General case' 0 N--CA 1.499 2.007 0 O-C-N 121.683 -0.636 . . . . 0.0 110.426 179.354 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 245' ' ' GLU . . . . . . . . . . . . . 50.6 mt-10 -99.01 28.09 4.62 Favored 'General case' 0 N--CA 1.496 1.834 0 O-C-N 121.66 -0.65 . . . . 0.0 110.565 -179.9 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 246' ' ' LYS . . . . . . . . . . . . . 62.4 mttm -65.05 -33.31 75.73 Favored 'General case' 0 N--CA 1.501 2.075 0 O-C-N 121.511 -0.743 . . . . 0.0 110.427 -179.757 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 247' ' ' ASN . . . . . . . . . . . . . 65.7 t30 -92.98 153.74 18.57 Favored 'General case' 0 N--CA 1.495 1.784 0 O-C-N 121.726 -0.609 . . . . 0.0 110.17 179.99 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 248' ' ' ILE . . . . . . . . . . . . . 82.4 mt -76.6 -33.15 21.9 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.042 0 O-C-N 121.695 -0.628 . . . . 0.0 109.792 -179.204 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 249' ' ' SER . . . . . 0.417 ' C ' HG13 ' B' ' 250' ' ' VAL . 96.9 p -109.52 141.66 41.67 Favored 'General case' 0 N--CA 1.495 1.799 0 O-C-N 121.599 -0.688 . . . . 0.0 110.193 179.677 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 250' ' ' VAL . . . . . 0.417 HG13 ' C ' ' B' ' 249' ' ' SER . 30.6 m -150.48 159.74 4.63 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.958 0 O-C-N 121.66 -0.65 . . . . 0.0 109.977 -179.994 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 251' ' ' ASP . . . . . . . . . . . . . 74.3 m-20 56.55 -81.96 0.01 OUTLIER 'General case' 0 N--CA 1.507 2.386 0 O-C-N 121.972 -0.455 . . . . 0.0 111.332 -179.066 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 252' ' ' VAL . . . . . . . . . . . . . 51.4 t 53.46 95.99 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.508 2.446 0 O-C-N 121.149 -0.969 . . . . 0.0 110.512 -178.33 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 253' ' ' ASP . . . . . . . . . . . . . 12.5 p-10 -161.56 -168.45 1.99 Allowed 'General case' 0 N--CA 1.496 1.862 0 O-C-N 121.644 -0.66 . . . . 0.0 110.384 -179.01 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 254' ' ' ALA . . . . . . . . . . . . . . . -65.42 -29.74 70.46 Favored 'General case' 0 N--CA 1.5 2.069 0 O-C-N 121.778 -0.577 . . . . 0.0 110.827 -176.926 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 255' ' ' ASP . . . . . . . . . . . . . 74.5 m-20 -72.14 -32.35 66.83 Favored 'General case' 0 N--CA 1.499 2.024 0 O-C-N 121.626 -0.671 . . . . 0.0 110.22 -178.997 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 256' ' ' ALA . . . . . . . . . . . . . . . -64.67 -37.56 87.99 Favored 'General case' 0 N--CA 1.501 2.115 0 O-C-N 121.548 -0.72 . . . . 0.0 110.165 177.262 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 257' ' ' SER . . . . . . . . . . . . . 27.1 m -56.7 -38.14 71.87 Favored 'General case' 0 N--CA 1.503 2.195 0 O-C-N 121.748 -0.595 . . . . 0.0 110.643 179.713 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 258' ' ' SER . . . . . . . . . . . . . 60.2 p -69.32 -30.87 69.02 Favored 'General case' 0 N--CA 1.5 2.029 0 C-N-CA 120.366 -0.534 . . . . 0.0 110.4 -177.604 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 259' ' ' GLN . . . . . . . . . . . . . 47.4 tt0 -64.96 -40.1 94.48 Favored 'General case' 0 N--CA 1.5 2.051 0 O-C-N 121.623 -0.673 . . . . 0.0 110.395 -179.721 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 260' ' ' LEU . . . . . 0.461 ' HA ' HD12 ' B' ' 263' ' ' LEU . 83.7 mt -68.84 -38.98 80.19 Favored 'General case' 0 N--CA 1.499 1.993 0 O-C-N 121.686 -0.634 . . . . 0.0 110.243 179.882 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 261' ' ' LEU . . . . . 0.612 HD13 HD12 ' A' ' 55' ' ' LEU . 29.6 tp -67.91 -36.98 81.13 Favored 'General case' 0 N--CA 1.498 1.965 0 O-C-N 121.638 -0.664 . . . . 0.0 110.018 179.064 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 262' ' ' SER . . . . . . . . . . . . . 23.0 t -62.48 -38.54 90.25 Favored 'General case' 0 N--CA 1.501 2.101 0 O-C-N 121.754 -0.591 . . . . 0.0 110.465 177.587 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 263' ' ' LEU . . . . . 0.461 HD12 ' HA ' ' B' ' 260' ' ' LEU . 45.7 mt -65.01 -40.17 94.51 Favored 'General case' 0 N--CA 1.501 2.076 0 O-C-N 121.663 -0.648 . . . . 0.0 110.363 179.208 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 264' ' ' LEU . . . . . 0.585 ' CD1' HD13 ' A' ' 55' ' ' LEU . 84.2 mt -62.24 -35.55 79.28 Favored 'General case' 0 N--CA 1.502 2.143 0 O-C-N 121.736 -0.603 . . . . 0.0 110.564 178.517 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 265' ' ' LYS . . . . . . . . . . . . . 30.1 ttpt -75.81 -36.72 59.63 Favored 'General case' 0 N--CA 1.497 1.922 0 O-C-N 121.757 -0.59 . . . . 0.0 110.085 -179.511 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 266' ' ' SER . . . . . . . . . . . . . 86.3 p -162.95 171.04 17.16 Favored 'General case' 0 N--CA 1.495 1.805 0 O-C-N 121.682 -0.636 . . . . 0.0 110.178 -179.659 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 267' ' ' SER . . . . . . . . . . . . . 86.5 p -89.49 160.04 16.95 Favored 'General case' 0 N--CA 1.496 1.871 0 O-C-N 121.792 -0.567 . . . . 0.0 110.181 -179.949 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 268' ' ' THR . . . . . . . . . . . . . 24.1 m -65.74 -37.83 87.45 Favored 'General case' 0 N--CA 1.5 2.056 0 O-C-N 121.697 -0.627 . . . . 0.0 110.326 -179.65 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 269' ' ' ALA . . . . . . . . . . . . . . . 48.53 86.78 0.14 Allowed Pre-proline 0 N--CA 1.506 2.342 0 O-C-N 121.748 -0.595 . . . . 0.0 111.255 -178.37 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 270' ' ' PRO . . . . . . . . . . . . . 23.9 Cg_endo -65.87 -32.61 45.26 Favored 'Trans proline' 0 N--CA 1.489 1.225 0 O-C-N 123.54 1.284 . . . . 0.0 110.583 -179.506 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 271' ' ' SER . . . . . . . . . . . . . 50.2 m -123.41 146.64 47.84 Favored 'General case' 0 N--CA 1.496 1.842 0 O-C-N 121.682 -0.636 . . . . 0.0 110.226 179.952 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 272' ' ' ASP . . . . . . . . . . . . . 19.9 t70 -160.52 31.66 0.16 Allowed 'General case' 0 N--CA 1.495 1.804 0 O-C-N 121.659 -0.651 . . . . 0.0 110.356 179.307 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 273' ' ' LEU . . . . . 0.528 ' N ' HD12 ' B' ' 273' ' ' LEU . 7.3 mp 51.23 65.2 1.55 Allowed 'General case' 0 N--CA 1.505 2.322 0 O-C-N 121.636 -0.665 . . . . 0.0 111.077 -179.303 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 274' ' ' ALA . . . . . . . . . . . . . . . -166.51 170.45 12.8 Favored 'General case' 0 N--CA 1.497 1.895 0 O-C-N 121.492 -0.755 . . . . 0.0 110.036 -179.588 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 275' ' ' THR . . . . . . . . . . . . . 23.5 m -117.27 81.76 13.75 Favored Pre-proline 0 N--CA 1.494 1.759 0 O-C-N 121.67 -0.644 . . . . 0.0 110.109 179.899 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 276' ' ' PRO . . . . . . . . . . . . . 26.3 Cg_endo -66.5 -30.91 42.97 Favored 'Trans proline' 0 N--CA 1.487 1.146 0 O-C-N 123.551 1.29 . . . . 0.0 110.647 -179.668 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 277' ' ' GLN . . . . . . . . . . . . . 43.2 mt-30 -120.04 88.47 40.93 Favored Pre-proline 0 N--CA 1.495 1.806 0 O-C-N 121.618 -0.676 . . . . 0.0 110.25 -179.349 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 278' ' ' PRO . . . . . . . . . . . . . 18.6 Cg_exo -62.98 152.65 78.27 Favored 'Trans proline' 0 N--CA 1.489 1.264 0 O-C-N 123.481 1.253 . . . . 0.0 110.542 178.906 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 279' ' ' SER . . . . . . . . . . . . . 90.8 p -107.75 149.86 27.67 Favored 'General case' 0 N--CA 1.494 1.77 0 O-C-N 121.619 -0.676 . . . . 0.0 110.237 -179.819 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 280' ' ' THR . . . . . . . . . . . . . 20.6 m -152.58 -46.21 0.1 Allowed 'General case' 0 N--CA 1.495 1.777 0 O-C-N 121.687 -0.633 . . . . 0.0 110.298 -179.612 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 281' ' ' PHE . . . . . . . . . . . . . 1.7 m-85 -61.75 -48.51 89.37 Favored Pre-proline 0 N--CA 1.502 2.154 0 O-C-N 121.657 -0.652 . . . . 0.0 111.044 -179.348 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 282' ' ' PRO . . . . . . . . . . . . . 27.5 Cg_exo -57.83 150.94 59.79 Favored 'Trans proline' 0 N--CA 1.494 1.527 0 O-C-N 123.182 1.096 . . . . 0.0 110.838 177.216 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 283' ' ' GLN . . . . . . . . . . . . . 4.7 pt20 -64.1 158.07 65.73 Favored Pre-proline 0 N--CA 1.501 2.119 0 O-C-N 121.661 -0.649 . . . . 0.0 110.536 -179.672 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 284' ' ' PRO . . . . . . . . . . . . . 28.4 Cg_endo -67.38 155.59 69.74 Favored 'Trans proline' 0 N--CA 1.488 1.161 0 O-C-N 123.711 1.374 . . . . 0.0 110.399 -179.324 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 285' ' ' PRO . . . . . . . . . . . . . 26.5 Cg_endo -66.7 151.2 83.09 Favored 'Trans proline' 0 N--CA 1.488 1.172 0 O-C-N 123.662 1.348 . . . . 0.0 110.419 -179.669 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 286' ' ' VAL . . . . . . . . . . . . . 15.0 p -63.88 -32.78 58.44 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.086 0 O-C-N 121.709 -0.62 . . . . 0.0 110.417 179.887 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 287' ' ' GLU . . . . . . . . . . . . . 29.8 tp10 -99.11 137.63 37.36 Favored 'General case' 0 N--CA 1.494 1.764 0 O-C-N 121.698 -0.626 . . . . 0.0 110.167 179.915 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 288' ' ' SER . . . . . . . . . . . . . 26.6 t -136.23 153.73 51.13 Favored 'General case' 0 N--CA 1.495 1.782 0 O-C-N 121.66 -0.65 . . . . 0.0 110.093 -179.869 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 289' ' ' HIS . . . . . . . . . . . . . 98.4 m-70 -103.75 132.69 49.77 Favored 'General case' 0 N--CA 1.495 1.782 0 O-C-N 121.633 -0.667 . . . . 0.0 110.201 -179.725 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 290' ' ' SER . . . . . . . . . . . . . 27.5 t -135.37 147.64 49.13 Favored 'General case' 0 N--CA 1.494 1.76 0 O-C-N 121.671 -0.643 . . . . 0.0 110.176 -179.756 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 291' ' ' SER . . . . . . . . . . . . . 3.4 m . . . . . 0 N--CA 1.494 1.768 0 CA-C-O 118.034 -0.984 . . . . 0.0 110.228 179.931 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' -1' ' ' MET . . . . . . . . . . . . . 74.2 mtm . . . . . 0 N--CA 1.493 1.687 0 CA-C-O 120.979 0.419 . . . . 0.0 110.223 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 0' ' ' GLY . . . . . . . . . . . . . . . -71.16 134.84 23.51 Favored Glycine 0 N--CA 1.493 2.465 0 N-CA-C 109.549 -1.42 . . . . 0.0 109.549 -179.989 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 65.3 mtt -131.7 164.32 26.2 Favored 'General case' 0 N--CA 1.495 1.804 0 O-C-N 121.603 -0.939 . . . . 0.0 110.215 179.935 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 68.6 m -95.28 171.93 8.42 Favored 'General case' 0 N--CA 1.496 1.858 0 O-C-N 121.738 -0.601 . . . . 0.0 110.047 179.488 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 3' ' ' VAL . . . . . 0.422 HG12 ' CE1' ' A' ' 7' ' ' TYR . 78.5 t -66.64 -27.75 41.09 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.06 0 O-C-N 121.699 -0.626 . . . . 0.0 110.303 -178.543 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -55.33 -31.53 61.77 Favored 'General case' 0 N--CA 1.504 2.272 0 O-C-N 121.375 -0.828 . . . . 0.0 110.399 -178.828 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 74.4 m-20 -69.04 -30.64 69.04 Favored 'General case' 0 N--CA 1.499 2.0 0 O-C-N 121.85 -0.531 . . . . 0.0 110.283 174.845 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 91.0 m-85 -95.4 10.02 37.86 Favored 'General case' 0 N--CA 1.497 1.917 0 O-C-N 121.59 -0.694 . . . . 0.0 111.536 -178.08 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' TYR . . . . . 0.422 ' CE1' HG12 ' A' ' 3' ' ' VAL . 2.9 m-30 -67.2 134.57 51.95 Favored 'General case' 0 N--CA 1.502 2.163 0 O-C-N 121.072 -1.017 . . . . 0.0 109.941 173.953 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' GLY . . . . . 0.435 ' O ' HG13 ' A' ' 24' ' ' VAL . . . 83.49 -1.05 89.3 Favored Glycine 0 N--CA 1.496 2.676 0 N-CA-C 110.84 -0.904 . . . . 0.0 110.84 -178.046 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . 0.634 ' OG ' HD12 ' A' ' 25' ' ' ILE . 83.1 p -77.82 137.59 38.5 Favored 'General case' 0 N--CA 1.499 2.01 0 O-C-N 121.064 -1.257 . . . . 0.0 110.516 176.855 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 27.0 t-20 -85.17 119.28 25.38 Favored 'General case' 0 N--CA 1.498 1.952 0 O-C-N 121.592 -0.692 . . . . 0.0 109.925 174.102 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . 0.517 HG12 ' HA ' ' A' ' 57' ' ' ILE . 35.2 m -142.5 163.02 18.37 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.729 0 N-CA-C 109.448 -0.575 . . . . 0.0 109.448 -179.837 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . 0.527 ' HB2' HD11 ' A' ' 58' ' ' LEU . 41.8 tt0 -109.34 127.4 54.3 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.489 -0.757 . . . . 0.0 110.072 178.236 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . 0.61 HG22 ' CD2' ' A' ' 55' ' ' LEU . 55.5 t -106.83 124.78 62.7 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.744 0 O-C-N 121.619 -0.675 . . . . 0.0 109.913 -177.848 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 22.2 tp -96.02 126.73 41.46 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.687 -0.633 . . . . 0.0 109.456 174.31 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 86.3 mt -97.46 166.37 11.56 Favored 'General case' 0 N--CA 1.495 1.819 0 O-C-N 121.588 -0.695 . . . . 0.0 111.167 -171.38 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 16.7 p30 -58.09 -22.62 51.33 Favored 'General case' 0 N--CA 1.506 2.333 0 O-C-N 121.746 -0.596 . . . . 0.0 111.535 -177.277 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 40.3 p-10 -93.0 23.56 4.18 Favored 'General case' 0 N--CA 1.497 1.918 0 O-C-N 121.571 -0.705 . . . . 0.0 110.847 -176.551 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 74.3 m-20 59.1 27.7 16.75 Favored 'General case' 0 N--CA 1.505 2.292 0 O-C-N 121.398 -0.814 . . . . 0.0 110.671 175.838 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 50.5 m -104.62 133.98 48.55 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.502 -0.749 . . . . 0.0 109.63 172.339 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 30.2 ttmt -109.66 138.76 45.56 Favored 'General case' 0 N--CA 1.495 1.793 0 O-C-N 121.715 -0.616 . . . . 0.0 110.413 -176.008 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -153.02 160.54 43.0 Favored 'General case' 0 N--CA 1.496 1.845 0 O-C-N 121.718 -0.614 . . . . 0.0 110.278 179.438 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 6.8 ptp85 -140.69 154.44 46.37 Favored 'General case' 0 N--CA 1.496 1.831 0 O-C-N 121.665 -0.647 . . . . 0.0 110.355 -179.914 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . 0.515 ' HA2' HD13 ' A' ' 39' ' ' LEU . . . -171.85 171.13 43.95 Favored Glycine 0 N--CA 1.494 2.527 0 N-CA-C 109.059 -1.616 . . . . 0.0 109.059 179.429 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . 0.435 HG13 ' O ' ' A' ' 8' ' ' GLY . 40.9 t -94.7 123.05 46.67 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.983 0 O-C-N 121.66 -0.906 . . . . 0.0 109.259 176.3 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 25' ' ' ILE . . . . . 0.634 HD12 ' OG ' ' A' ' 9' ' ' SER . 96.0 mt -63.18 141.43 18.14 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.182 0 O-C-N 121.62 -0.675 . . . . 0.0 110.499 -171.953 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . 0.641 HG21 ' HB2' ' A' ' 38' ' ' ARG . 12.2 p -121.15 -25.41 5.3 Favored 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.818 -0.551 . . . . 0.0 111.229 -179.545 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 27' ' ' ASN . . . . . 0.488 ' O ' HD12 ' A' ' 35' ' ' LEU . 2.0 t-20 -163.38 161.42 24.44 Favored 'General case' 0 N--CA 1.5 2.075 0 O-C-N 120.901 -1.124 . . . . 0.0 111.849 178.864 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 28' ' ' PHE . . . . . 0.453 ' HE1' HG21 ' A' ' 49' ' ' THR . 84.5 t80 -150.03 129.0 12.59 Favored 'General case' 0 N--CA 1.498 1.963 0 N-CA-C 109.23 -0.655 . . . . 0.0 109.23 169.032 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 21.2 t70 -98.77 131.23 45.06 Favored 'General case' 0 N--CA 1.492 1.625 0 N-CA-C 109.031 -0.729 . . . . 0.0 109.031 -178.359 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 87.4 p -69.81 -50.64 41.01 Favored 'General case' 0 N--CA 1.498 1.953 0 C-N-CA 120.032 -0.667 . . . . 0.0 110.616 -175.35 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 5.2 t -59.63 -42.61 93.1 Favored 'General case' 0 N--CA 1.502 2.131 0 O-C-N 121.567 -0.708 . . . . 0.0 110.782 -174.632 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 28.6 m120 -103.79 -10.06 18.56 Favored 'General case' 0 N--CA 1.496 1.875 0 O-C-N 121.663 -0.648 . . . . 0.0 111.518 -177.266 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 2.1 m 49.94 67.31 0.92 Allowed 'General case' 0 N--CA 1.508 2.452 0 O-C-N 121.027 -1.046 . . . . 0.0 110.876 -174.153 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 34' ' ' ILE . . . . . 1.125 HD12 HG22 ' A' ' 48' ' ' VAL . 45.8 mm -123.51 125.86 72.18 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.043 0 O-C-N 121.519 -0.738 . . . . 0.0 109.333 -175.698 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.488 HD12 ' O ' ' A' ' 27' ' ' ASN . 9.5 tp -115.7 122.73 46.42 Favored 'General case' 0 N--CA 1.495 1.792 0 O-C-N 121.701 -0.624 . . . . 0.0 110.628 -168.639 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 78.4 mt-30 -91.03 133.22 35.49 Favored 'General case' 0 N--CA 1.49 1.562 0 N-CA-C 109.445 -0.576 . . . . 0.0 109.445 172.318 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 13.7 mt -117.83 123.54 46.16 Favored 'General case' 0 N--CA 1.494 1.772 0 C-N-CA 120.224 -0.59 . . . . 0.0 110.036 174.676 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 38' ' ' ARG . . . . . 0.641 ' HB2' HG21 ' A' ' 26' ' ' THR . 63.3 ttt180 -104.5 105.01 14.96 Favored 'General case' 0 N--CA 1.495 1.811 0 O-C-N 121.761 -0.587 . . . . 0.0 110.132 174.62 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.515 HD13 ' HA2' ' A' ' 23' ' ' GLY . 62.9 tp -83.65 155.45 23.18 Favored 'General case' 0 N--CA 1.499 1.977 0 O-C-N 121.535 -0.728 . . . . 0.0 110.679 -176.086 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -67.19 -3.1 6.8 Favored 'General case' 0 N--CA 1.503 2.22 0 O-C-N 121.806 -0.559 . . . . 0.0 112.154 -170.497 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 35.4 p-10 -85.75 28.99 0.73 Allowed 'General case' 0 N--CA 1.499 1.993 0 O-C-N 121.044 -1.035 . . . . 0.0 110.937 173.166 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 74.1 m-20 59.05 29.28 18.8 Favored 'General case' 0 N--CA 1.505 2.298 0 O-C-N 121.26 -0.9 . . . . 0.0 110.357 177.138 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 68.9 m -121.5 141.93 50.55 Favored 'General case' 0 N--CA 1.494 1.758 0 O-C-N 121.502 -0.748 . . . . 0.0 109.99 177.112 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 9.0 t -128.16 147.37 50.55 Favored 'General case' 0 N--CA 1.495 1.816 0 O-C-N 121.621 -0.674 . . . . 0.0 109.966 179.903 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 77.1 tttt -150.76 134.11 16.26 Favored 'General case' 0 N--CA 1.495 1.798 0 C-N-CA 120.157 -0.617 . . . . 0.0 110.595 -177.325 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 88.4 p -94.72 123.04 37.94 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.817 -0.552 . . . . 0.0 110.105 177.93 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 82.2 mt -129.25 137.92 55.76 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.857 0 N-CA-C 109.252 -0.648 . . . . 0.0 109.252 179.683 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 48' ' ' VAL . . . . . 1.125 HG22 HD12 ' A' ' 34' ' ' ILE . 58.7 t -82.41 127.61 39.48 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.874 0 O-C-N 121.598 -0.689 . . . . 0.0 109.297 179.638 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 49' ' ' THR . . . . . 0.453 HG21 ' HE1' ' A' ' 28' ' ' PHE . 34.2 p -59.88 -24.89 64.64 Favored 'General case' 0 N--CA 1.504 2.269 0 O-C-N 121.552 -0.717 . . . . 0.0 112.052 -170.727 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 51.4 mttm -57.14 -25.23 58.55 Favored 'General case' 0 N--CA 1.503 2.224 0 O-C-N 121.474 -0.766 . . . . 0.0 110.96 -176.289 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 6.4 p30 -84.35 4.85 29.39 Favored 'General case' 0 N--CA 1.499 1.998 0 C-N-CA 119.659 -0.817 . . . . 0.0 111.381 176.295 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 98.9 mt -75.59 127.72 37.1 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.13 0 O-C-N 121.119 -0.988 . . . . 0.0 109.831 175.953 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 85.3 tttt -92.9 -29.62 15.82 Favored 'General case' 0 N--CA 1.493 1.697 0 O-C-N 121.853 -0.53 . . . . 0.0 109.738 170.844 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 5.3 m-20 -164.09 155.18 15.77 Favored 'General case' 0 N--CA 1.5 2.048 0 O-C-N 121.821 -0.549 . . . . 0.0 110.091 -177.715 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . 0.61 ' CD2' HG22 ' A' ' 13' ' ' VAL . 80.0 mt -132.95 148.97 52.28 Favored 'General case' 0 N--CA 1.496 1.861 0 O-C-N 121.675 -0.641 . . . . 0.0 110.4 -179.346 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 19.7 ptp180 -150.8 146.46 26.39 Favored 'General case' 0 N--CA 1.496 1.874 0 O-C-N 121.75 -0.594 . . . . 0.0 109.933 174.937 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 57' ' ' ILE . . . . . 0.517 ' HA ' HG12 ' A' ' 11' ' ' VAL . 59.2 mt -86.98 133.24 30.45 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.866 0 O-C-N 121.497 -0.752 . . . . 0.0 109.97 173.455 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . 0.527 HD11 ' HB2' ' A' ' 12' ' ' GLU . 73.0 mt -83.47 153.25 65.14 Favored Pre-proline 0 N--CA 1.498 1.955 0 O-C-N 121.628 -0.67 . . . . 0.0 110.153 -179.205 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 32.4 Cg_endo -69.05 145.43 61.25 Favored 'Trans proline' 0 N--CA 1.488 1.154 0 O-C-N 123.671 1.353 . . . . 0.0 110.311 -179.968 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 61.2 mttm -95.34 -39.32 10.09 Favored 'General case' 0 N--CA 1.495 1.803 0 O-C-N 121.715 -0.615 . . . . 0.0 110.261 179.197 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 18.0 t-20 -109.82 124.97 52.24 Favored 'General case' 0 N--CA 1.495 1.816 0 O-C-N 121.651 -0.655 . . . . 0.0 110.17 179.652 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 34.2 tt0 -154.17 -46.82 0.09 Allowed 'General case' 0 N--CA 1.495 1.801 0 O-C-N 121.735 -0.603 . . . . 0.0 110.433 -179.244 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 49.4 mm -112.44 141.23 28.63 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.916 0 O-C-N 121.656 -0.652 . . . . 0.0 109.987 -177.864 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 64' ' ' MET . . . . . . . . . . . . . 2.7 tpt 52.44 62.31 10.54 Favored Pre-proline 0 N--CA 1.506 2.338 0 O-C-N 121.709 -0.619 . . . . 0.0 111.038 179.609 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 29.6 Cg_endo -67.98 134.46 32.05 Favored 'Trans proline' 0 N--CA 1.488 1.171 0 O-C-N 123.552 1.291 . . . . 0.0 110.295 178.66 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 57.5 mtpt -108.64 136.86 47.52 Favored 'General case' 0 N--CA 1.494 1.765 0 O-C-N 121.621 -0.674 . . . . 0.0 110.228 179.821 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 25.8 t30 -91.09 -61.12 1.73 Allowed 'General case' 0 N--CA 1.495 1.817 0 O-C-N 121.664 -0.648 . . . . 0.0 110.226 179.533 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 67.75 -122.42 16.88 Favored Glycine 0 N--CA 1.496 2.643 0 N-CA-C 109.692 -1.363 . . . . 0.0 109.692 -179.907 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 40.9 p -97.12 165.14 12.2 Favored 'General case' 0 N--CA 1.494 1.766 0 O-C-N 121.75 -0.853 . . . . 0.0 110.058 178.741 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 28.7 tptt -99.43 31.59 3.08 Favored 'General case' 0 N--CA 1.495 1.811 0 O-C-N 121.671 -0.643 . . . . 0.0 110.379 -179.338 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 15.2 m -137.1 156.99 75.32 Favored Pre-proline 0 N--CA 1.495 1.81 0 O-C-N 121.617 -0.677 . . . . 0.0 110.196 179.927 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 29.0 Cg_endo -67.58 151.09 80.01 Favored 'Trans proline' 0 N--CA 1.489 1.235 0 O-C-N 123.603 1.318 . . . . 0.0 110.434 179.998 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 25.4 t -115.16 135.29 54.34 Favored 'General case' 0 N--CA 1.495 1.81 0 O-C-N 121.687 -0.633 . . . . 0.0 110.174 179.054 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 24.4 m -68.63 -42.9 77.38 Favored 'General case' 0 N--CA 1.498 1.938 0 O-C-N 121.653 -0.655 . . . . 0.0 110.35 -178.962 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 16.4 t-20 -114.55 120.86 41.64 Favored 'General case' 0 N--CA 1.496 1.859 0 O-C-N 121.65 -0.656 . . . . 0.0 110.218 -178.681 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 85.7 p -108.43 30.55 6.34 Favored 'General case' 0 N--CA 1.495 1.784 0 O-C-N 121.636 -0.665 . . . . 0.0 110.443 179.129 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 24.9 m -116.3 138.69 51.11 Favored 'General case' 0 N--CA 1.496 1.825 0 O-C-N 121.608 -0.682 . . . . 0.0 110.183 -179.198 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 44.8 pttt -136.6 153.52 50.93 Favored 'General case' 0 N--CA 1.497 1.915 0 O-C-N 121.72 -0.612 . . . . 0.0 110.272 -179.755 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . 0.543 ' N ' HD12 ' A' ' 79' ' ' LEU . 6.1 mp -98.6 138.65 35.47 Favored 'General case' 0 N--CA 1.495 1.776 0 O-C-N 121.664 -0.647 . . . . 0.0 110.184 179.669 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 98.7 mttt -109.47 127.1 54.17 Favored 'General case' 0 N--CA 1.496 1.829 0 O-C-N 121.694 -0.629 . . . . 0.0 110.221 -179.611 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 24.6 m -67.09 -39.76 86.83 Favored 'General case' 0 N--CA 1.5 2.031 0 O-C-N 121.668 -0.645 . . . . 0.0 110.274 179.761 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -160.87 147.46 15.11 Favored 'General case' 0 N--CA 1.495 1.809 0 O-C-N 121.688 -0.632 . . . . 0.0 110.149 179.278 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 46.5 mt-10 -104.24 -57.8 1.98 Allowed 'General case' 0 N--CA 1.496 1.826 0 O-C-N 121.677 -0.639 . . . . 0.0 110.164 179.3 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 39.3 p -127.77 173.71 9.73 Favored 'General case' 0 N--CA 1.496 1.859 0 O-C-N 121.722 -0.612 . . . . 0.0 110.057 179.989 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 98.8 m-85 -103.87 130.51 51.46 Favored 'General case' 0 N--CA 1.494 1.768 0 O-C-N 121.728 -0.607 . . . . 0.0 110.207 179.66 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 44.0 m -127.73 157.14 41.14 Favored 'General case' 0 N--CA 1.495 1.812 0 O-C-N 121.769 -0.582 . . . . 0.0 110.145 -179.458 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 23.0 t -62.25 -34.55 76.75 Favored 'General case' 0 N--CA 1.501 2.118 0 O-C-N 121.543 -0.723 . . . . 0.0 110.391 179.768 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 53.2 mttp -102.36 129.93 48.96 Favored 'General case' 0 N--CA 1.495 1.809 0 O-C-N 121.649 -0.657 . . . . 0.0 110.028 178.368 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 90.7 m-20 -66.44 -36.57 83.13 Favored 'General case' 0 N--CA 1.5 2.041 0 O-C-N 121.671 -0.643 . . . . 0.0 110.33 -178.676 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 63.1 mttm -103.51 28.56 6.38 Favored 'General case' 0 N--CA 1.496 1.865 0 O-C-N 121.674 -0.641 . . . . 0.0 110.651 -179.072 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 91' ' ' TRP . . . . . . . . . . . . . 27.0 t90 55.62 -84.79 0.01 OUTLIER 'General case' 0 N--CA 1.506 2.348 0 O-C-N 121.787 -0.57 . . . . 0.0 111.229 -178.99 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 27.2 t -127.59 141.36 51.65 Favored 'General case' 0 N--CA 1.495 1.818 0 O-C-N 121.174 -0.954 . . . . 0.0 110.229 -178.952 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 93' ' ' MET . . . . . . . . . . . . . 13.3 mmt -66.0 -35.23 80.02 Favored 'General case' 0 N--CA 1.501 2.09 0 O-C-N 121.701 -0.624 . . . . 0.0 110.31 179.859 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 17.1 t70 . . . . . 0 N--CA 1.495 1.796 0 CA-C-O 118.021 -0.99 . . . . 0.0 110.148 -179.864 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' B' B ' 240' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.239 0 N-CA-C 109.566 -1.414 . . . . 0.0 109.566 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' B' B ' 241' ' ' ALA . . . . . . . . . . . . . . . -67.27 -32.67 73.84 Favored 'General case' 0 N--CA 1.501 2.076 0 O-C-N 121.684 -0.892 . . . . 0.0 110.355 179.866 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 242' ' ' THR . . . . . . . . . . . . . 23.2 m -119.79 144.84 47.09 Favored 'General case' 0 N--CA 1.495 1.791 0 O-C-N 121.66 -0.65 . . . . 0.0 110.165 179.971 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 243' ' ' THR . . . . . . . . . . . . . 42.8 p -82.18 154.34 25.52 Favored 'General case' 0 N--CA 1.497 1.92 0 O-C-N 121.663 -0.648 . . . . 0.0 110.164 -179.665 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 244' ' ' LYS . . . . . . . . . . . . . 53.2 mtmt -89.65 -30.33 18.19 Favored 'General case' 0 N--CA 1.496 1.85 0 O-C-N 121.684 -0.635 . . . . 0.0 110.571 -179.404 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 245' ' ' GLU . . . . . . . . . . . . . 46.3 tt0 -94.1 132.36 38.7 Favored 'General case' 0 N--CA 1.496 1.85 0 O-C-N 121.571 -0.705 . . . . 0.0 110.171 -178.931 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 246' ' ' LYS . . . . . . . . . . . . . 53.8 mttp -132.72 160.92 35.38 Favored 'General case' 0 N--CA 1.495 1.789 0 O-C-N 121.671 -0.643 . . . . 0.0 110.211 179.989 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 247' ' ' ASN . . . . . . . . . . . . . 89.9 m-20 -74.01 171.16 13.99 Favored 'General case' 0 N--CA 1.498 1.957 0 O-C-N 121.743 -0.598 . . . . 0.0 110.155 -179.797 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 248' ' ' ILE . . . . . 0.429 HG22 ' N ' ' B' ' 249' ' ' SER . 46.5 mm 58.36 164.54 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.508 2.464 0 O-C-N 121.764 -0.585 . . . . 0.0 110.719 -179.564 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 249' ' ' SER . . . . . 0.446 ' OG ' HG21 ' B' ' 252' ' ' VAL . 91.5 p -110.83 156.87 20.5 Favored 'General case' 0 N--CA 1.495 1.813 0 O-C-N 121.581 -0.699 . . . . 0.0 110.22 179.653 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 250' ' ' VAL . . . . . 0.43 ' O ' HG23 ' B' ' 252' ' ' VAL . 34.4 m -87.57 129.02 39.62 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.014 0 O-C-N 121.71 -0.619 . . . . 0.0 110.463 -178.908 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 251' ' ' ASP . . . . . . . . . . . . . 74.5 m-20 54.72 -86.61 0.02 OUTLIER 'General case' 0 N--CA 1.506 2.34 0 O-C-N 121.829 -0.544 . . . . 0.0 111.455 179.916 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 252' ' ' VAL . . . . . 0.446 HG21 ' OG ' ' B' ' 249' ' ' SER . 96.2 t 54.89 -87.07 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.507 2.389 0 O-C-N 121.212 -0.93 . . . . 0.0 110.783 -176.72 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 253' ' ' ASP . . . . . . . . . . . . . 74.6 m-20 52.03 48.34 22.94 Favored 'General case' 0 N--CA 1.506 2.352 0 O-C-N 121.091 -1.006 . . . . 0.0 111.055 -179.275 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 254' ' ' ALA . . . . . . . . . . . . . . . -67.92 -38.47 82.93 Favored 'General case' 0 N--CA 1.5 2.026 0 O-C-N 121.728 -0.608 . . . . 0.0 110.233 179.586 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 255' ' ' ASP . . . . . . . . . . . . . 9.6 m-20 -74.35 -26.01 59.87 Favored 'General case' 0 N--CA 1.499 1.985 0 O-C-N 121.724 -0.61 . . . . 0.0 110.759 -179.782 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 256' ' ' ALA . . . . . . . . . . . . . . . -63.0 -34.7 78.11 Favored 'General case' 0 N--CA 1.5 2.052 0 O-C-N 121.4 -0.813 . . . . 0.0 110.441 -179.959 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 257' ' ' SER . . . . . . . . . . . . . 23.6 m -56.73 -40.5 75.82 Favored 'General case' 0 N--CA 1.502 2.139 0 O-C-N 121.656 -0.652 . . . . 0.0 110.546 179.236 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 258' ' ' SER . . . . . . . . . . . . . 62.4 p -70.3 -31.79 69.27 Favored 'General case' 0 N--CA 1.498 1.973 0 C-N-CA 120.306 -0.558 . . . . 0.0 110.373 -179.265 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 259' ' ' GLN . . . . . . . . . . . . . 77.7 mt-30 -65.39 -34.87 79.32 Favored 'General case' 0 N--CA 1.501 2.085 0 O-C-N 121.597 -0.69 . . . . 0.0 110.361 -179.986 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 260' ' ' LEU . . . . . 0.419 ' HA ' HD12 ' B' ' 263' ' ' LEU . 82.7 mt -68.48 -40.93 80.75 Favored 'General case' 0 N--CA 1.499 2.018 0 O-C-N 121.661 -0.649 . . . . 0.0 110.19 179.878 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 261' ' ' LEU . . . . . . . . . . . . . 24.6 tp -69.81 -40.77 75.75 Favored 'General case' 0 N--CA 1.498 1.967 0 O-C-N 121.671 -0.643 . . . . 0.0 109.972 177.678 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 262' ' ' SER . . . . . . . . . . . . . 83.5 p -63.07 -33.85 76.34 Favored 'General case' 0 N--CA 1.501 2.081 0 O-C-N 121.678 -0.639 . . . . 0.0 110.462 177.64 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 263' ' ' LEU . . . . . 0.419 HD12 ' HA ' ' B' ' 260' ' ' LEU . 25.3 mt -65.3 -43.48 90.97 Favored 'General case' 0 N--CA 1.501 2.118 0 O-C-N 121.606 -0.684 . . . . 0.0 110.204 178.682 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 264' ' ' LEU . . . . . 0.421 ' CD1' HD11 ' A' ' 55' ' ' LEU . 81.4 mt -62.52 -35.12 78.4 Favored 'General case' 0 N--CA 1.502 2.137 0 O-C-N 121.673 -0.642 . . . . 0.0 110.467 178.564 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 265' ' ' LYS . . . . . . . . . . . . . 56.0 tttm -75.62 -38.12 59.2 Favored 'General case' 0 N--CA 1.498 1.967 0 O-C-N 121.786 -0.571 . . . . 0.0 110.239 -178.602 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 266' ' ' SER . . . . . . . . . . . . . 27.3 t -163.31 161.66 24.74 Favored 'General case' 0 N--CA 1.497 1.904 0 O-C-N 121.686 -0.634 . . . . 0.0 110.255 -178.674 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 267' ' ' SER . . . . . . . . . . . . . 93.3 p -118.87 157.48 27.56 Favored 'General case' 0 N--CA 1.495 1.798 0 O-C-N 121.702 -0.624 . . . . 0.0 110.145 179.703 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 268' ' ' THR . . . . . . . . . . . . . 23.6 m -65.53 -39.24 91.55 Favored 'General case' 0 N--CA 1.502 2.165 0 O-C-N 121.678 -0.639 . . . . 0.0 110.379 -179.498 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 269' ' ' ALA . . . . . . . . . . . . . . . 48.84 72.49 1.25 Allowed Pre-proline 0 N--CA 1.506 2.344 0 O-C-N 121.688 -0.633 . . . . 0.0 111.281 -178.934 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 270' ' ' PRO . . . . . . . . . . . . . 19.1 Cg_exo -62.48 151.89 80.44 Favored 'Trans proline' 0 N--CA 1.489 1.26 0 O-C-N 123.435 1.229 . . . . 0.0 110.639 179.585 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 271' ' ' SER . . . . . . . . . . . . . 88.7 p -65.92 -29.63 70.09 Favored 'General case' 0 N--CA 1.5 2.061 0 O-C-N 121.635 -0.665 . . . . 0.0 110.6 -179.942 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 272' ' ' ASP . . . . . . . . . . . . . 74.5 m-20 -67.8 150.3 48.8 Favored 'General case' 0 N--CA 1.5 2.048 0 O-C-N 121.601 -0.687 . . . . 0.0 110.203 -179.981 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 273' ' ' LEU . . . . . . . . . . . . . 21.3 tp -78.54 -33.63 47.71 Favored 'General case' 0 N--CA 1.498 1.953 0 O-C-N 121.659 -0.651 . . . . 0.0 110.096 -179.124 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 274' ' ' ALA . . . . . . . . . . . . . . . -165.58 149.48 8.23 Favored 'General case' 0 N--CA 1.497 1.894 0 O-C-N 121.55 -0.719 . . . . 0.0 110.134 -179.957 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 275' ' ' THR . . . . . 0.58 HG23 ' O ' ' B' ' 275' ' ' THR . 6.2 t -156.94 102.49 1.94 Allowed Pre-proline 0 N--CA 1.497 1.887 0 O-C-N 121.683 -0.636 . . . . 0.0 110.26 -179.676 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 276' ' ' PRO . . . . . . . . . . . . . 21.3 Cg_endo -65.52 138.06 53.14 Favored 'Trans proline' 0 N--CA 1.49 1.317 0 O-C-N 123.174 1.091 . . . . 0.0 110.52 -179.243 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 277' ' ' GLN . . . . . . . . . . . . . 29.4 mt-30 52.28 83.04 0.23 Allowed Pre-proline 0 N--CA 1.506 2.346 0 O-C-N 121.622 -0.674 . . . . 0.0 111.011 -179.842 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 278' ' ' PRO . . . . . . . . . . . . . 25.8 Cg_endo -66.44 -32.57 39.95 Favored 'Trans proline' 0 N--CA 1.489 1.207 0 O-C-N 123.528 1.278 . . . . 0.0 110.494 179.685 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 279' ' ' SER . . . . . . . . . . . . . 97.6 p -135.7 158.47 44.3 Favored 'General case' 0 N--CA 1.495 1.776 0 O-C-N 121.616 -0.678 . . . . 0.0 110.143 179.307 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 280' ' ' THR . . . . . . . . . . . . . 54.1 p -128.08 160.65 31.32 Favored 'General case' 0 N--CA 1.497 1.891 0 O-C-N 121.666 -0.646 . . . . 0.0 110.177 -179.673 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 281' ' ' PHE . . . . . . . . . . . . . 51.4 p90 -132.01 157.49 78.09 Favored Pre-proline 0 N--CA 1.495 1.795 0 O-C-N 121.639 -0.663 . . . . 0.0 110.199 179.649 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 282' ' ' PRO . . . . . . . . . . . . . 27.5 Cg_endo -67.08 142.02 59.93 Favored 'Trans proline' 0 N--CA 1.49 1.268 0 O-C-N 123.724 1.381 . . . . 0.0 110.33 179.92 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 283' ' ' GLN . . . . . . . . . . . . . 36.8 mt-30 -122.52 168.43 11.83 Favored Pre-proline 0 N--CA 1.495 1.802 0 O-C-N 121.656 -0.653 . . . . 0.0 110.197 -179.752 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 284' ' ' PRO . . . . . . . . . . . . . 17.8 Cg_exo -62.98 155.55 59.91 Favored 'Trans proline' 0 N--CA 1.489 1.25 0 O-C-N 123.636 1.334 . . . . 0.0 110.532 -179.965 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 285' ' ' PRO . . . . . . . . . . . . . 23.5 Cg_endo -65.95 -41.45 13.65 Favored 'Trans proline' 0 N--CA 1.488 1.189 0 O-C-N 123.561 1.295 . . . . 0.0 110.427 -179.227 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 286' ' ' VAL . . . . . 0.53 HG12 ' HG3' ' B' ' 287' ' ' GLU . 77.6 t -144.0 -67.52 0.1 Allowed 'Isoleucine or valine' 0 N--CA 1.497 1.879 0 O-C-N 121.713 -0.617 . . . . 0.0 109.694 179.369 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 287' ' ' GLU . . . . . 0.53 ' HG3' HG12 ' B' ' 286' ' ' VAL . 75.3 mt-10 -142.69 167.28 22.44 Favored 'General case' 0 N--CA 1.494 1.768 0 O-C-N 121.622 -0.674 . . . . 0.0 110.245 179.66 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 288' ' ' SER . . . . . . . . . . . . . 30.4 t -111.98 144.66 40.95 Favored 'General case' 0 N--CA 1.496 1.839 0 O-C-N 121.663 -0.648 . . . . 0.0 110.135 179.733 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 289' ' ' HIS . . . . . . . . . . . . . 59.1 t-80 -118.38 131.54 56.29 Favored 'General case' 0 N--CA 1.496 1.826 0 O-C-N 121.654 -0.654 . . . . 0.0 110.238 -179.509 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 290' ' ' SER . . . . . . . . . . . . . 50.4 m -121.83 148.09 45.13 Favored 'General case' 0 N--CA 1.497 1.898 0 O-C-N 121.767 -0.583 . . . . 0.0 110.209 179.625 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 291' ' ' SER . . . . . . . . . . . . . 57.6 p . . . . . 0 N--CA 1.495 1.776 0 CA-C-O 118.098 -0.953 . . . . 0.0 110.23 179.975 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' -1' ' ' MET . . . . . . . . . . . . . 61.2 mtt . . . . . 0 N--CA 1.493 1.684 0 CA-C-O 120.977 0.418 . . . . 0.0 110.151 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 0' ' ' GLY . . . . . . . . . . . . . . . -140.73 57.41 0.59 Allowed Glycine 0 N--CA 1.494 2.54 0 N-CA-C 109.5 -1.44 . . . . 0.0 109.5 -179.777 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 44.9 ttm -94.04 119.13 32.48 Favored 'General case' 0 N--CA 1.495 1.791 0 O-C-N 121.639 -0.918 . . . . 0.0 110.066 179.937 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 73.9 m -101.03 -178.97 3.91 Favored 'General case' 0 N--CA 1.496 1.87 0 O-C-N 121.709 -0.619 . . . . 0.0 110.435 -177.212 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 3' ' ' VAL . . . . . 0.453 HG21 ' CE1' ' A' ' 28' ' ' PHE . 55.9 t -64.97 -27.95 43.63 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.165 0 O-C-N 121.707 -0.621 . . . . 0.0 110.408 -179.298 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -55.45 -31.39 61.91 Favored 'General case' 0 N--CA 1.504 2.234 0 O-C-N 121.418 -0.801 . . . . 0.0 110.515 -178.664 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 74.4 m-20 -68.5 -34.24 75.54 Favored 'General case' 0 N--CA 1.499 1.984 0 O-C-N 121.793 -0.567 . . . . 0.0 109.973 174.787 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 6' ' ' PHE . . . . . 0.411 ' CD1' HD21 ' B' ' 260' ' ' LEU . 96.6 m-85 -97.5 10.12 40.64 Favored 'General case' 0 N--CA 1.496 1.867 0 O-C-N 121.732 -0.605 . . . . 0.0 111.246 178.931 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -67.41 127.95 34.61 Favored 'General case' 0 N--CA 1.501 2.09 0 O-C-N 121.223 -0.923 . . . . 0.0 110.162 -178.661 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' GLY . . . . . 0.456 ' O ' HG13 ' A' ' 24' ' ' VAL . . . 83.24 -2.11 87.58 Favored Glycine 0 N--CA 1.498 2.77 0 N-CA-C 110.851 -0.899 . . . . 0.0 110.851 -177.51 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 57.0 p -76.85 145.05 38.61 Favored 'General case' 0 N--CA 1.498 1.949 0 O-C-N 120.969 -1.312 . . . . 0.0 110.168 177.499 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' ASN . . . . . 0.78 ' CG ' HG22 ' A' ' 24' ' ' VAL . 2.3 m-20 -85.21 119.27 25.41 Favored 'General case' 0 N--CA 1.496 1.87 0 O-C-N 121.644 -0.66 . . . . 0.0 109.598 174.785 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . 0.479 HG12 ' HA ' ' A' ' 57' ' ' ILE . 32.9 m -142.44 159.84 19.42 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.846 0 O-C-N 121.69 -0.631 . . . . 0.0 109.754 179.885 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . 0.577 ' HB2' HD11 ' A' ' 58' ' ' LEU . 46.5 tt0 -109.4 128.94 55.52 Favored 'General case' 0 N--CA 1.494 1.731 0 C-N-CA 119.912 -0.715 . . . . 0.0 110.169 179.023 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . 0.562 HG22 ' CD2' ' A' ' 55' ' ' LEU . 60.4 t -106.78 127.69 62.1 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.766 0 O-C-N 121.728 -0.608 . . . . 0.0 109.957 -179.289 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.533 HD13 ' HG2' ' A' ' 20' ' ' LYS . 29.0 tp -95.74 127.73 42.02 Favored 'General case' 0 N--CA 1.494 1.733 0 N-CA-C 109.125 -0.695 . . . . 0.0 109.125 173.776 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 83.8 mt -96.05 168.27 10.72 Favored 'General case' 0 N--CA 1.495 1.821 0 O-C-N 121.653 -0.654 . . . . 0.0 111.097 -172.846 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 24.2 p30 -57.89 -22.06 46.48 Favored 'General case' 0 N--CA 1.506 2.333 0 O-C-N 121.815 -0.553 . . . . 0.0 111.484 -178.537 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 25.1 p30 -91.29 22.36 3.91 Favored 'General case' 0 N--CA 1.499 1.996 0 O-C-N 121.586 -0.696 . . . . 0.0 111.078 -177.364 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 74.4 m-20 59.79 28.53 18.01 Favored 'General case' 0 N--CA 1.506 2.361 0 O-C-N 121.393 -0.817 . . . . 0.0 110.813 172.805 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 17.9 m -111.49 147.32 35.58 Favored 'General case' 0 N--CA 1.494 1.743 0 O-C-N 121.474 -0.766 . . . . 0.0 109.573 171.229 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . 0.533 ' HG2' HD13 ' A' ' 14' ' ' LEU . 97.1 mttt -109.59 150.29 28.43 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.616 -0.677 . . . . 0.0 110.608 -177.248 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -153.01 154.15 34.35 Favored 'General case' 0 N--CA 1.496 1.867 0 O-C-N 121.824 -0.548 . . . . 0.0 109.999 176.188 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . 0.405 ' O ' HD22 ' A' ' 39' ' ' LEU . 7.7 ptp85 -138.22 150.41 46.71 Favored 'General case' 0 N--CA 1.494 1.765 0 O-C-N 121.569 -0.707 . . . . 0.0 110.494 179.75 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . 0.425 ' HA2' HD13 ' A' ' 39' ' ' LEU . . . -171.83 171.16 43.96 Favored Glycine 0 N--CA 1.492 2.383 0 N-CA-C 109.069 -1.613 . . . . 0.0 109.069 -178.958 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . 0.78 HG22 ' CG ' ' A' ' 10' ' ' ASN . 40.6 t -94.48 125.39 47.1 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.912 0 O-C-N 121.676 -0.896 . . . . 0.0 109.082 176.156 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 25' ' ' ILE . . . . . 0.498 ' HA ' HD23 ' A' ' 37' ' ' LEU . 45.7 mt -61.23 137.03 24.13 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.259 0 O-C-N 121.568 -0.707 . . . . 0.0 110.824 -171.554 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . 0.709 HG21 ' HB2' ' A' ' 38' ' ' ARG . 10.0 p -121.15 -19.81 6.99 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.921 -0.487 . . . . 0.0 111.581 -178.25 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 11.2 t30 -165.74 158.14 14.97 Favored 'General case' 0 N--CA 1.504 2.268 0 O-C-N 120.886 -1.134 . . . . 0.0 111.937 176.517 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 28' ' ' PHE . . . . . 0.453 ' CE1' HG21 ' A' ' 3' ' ' VAL . 77.2 t80 -150.34 119.99 7.0 Favored 'General case' 0 N--CA 1.496 1.853 0 N-CA-C 109.101 -0.703 . . . . 0.0 109.101 172.618 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 21.2 t70 -98.21 128.28 44.59 Favored 'General case' 0 N--CA 1.492 1.641 0 N-CA-C 109.248 -0.649 . . . . 0.0 109.248 -176.949 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 22.7 m -67.48 -47.97 68.51 Favored 'General case' 0 N--CA 1.498 1.956 0 O-C-N 121.578 -0.701 . . . . 0.0 110.661 -175.856 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 22.2 m -59.32 -45.49 91.2 Favored 'General case' 0 N--CA 1.502 2.164 0 O-C-N 121.591 -0.693 . . . . 0.0 110.897 -174.058 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 91.4 m-20 -105.53 -5.63 20.05 Favored 'General case' 0 N--CA 1.496 1.861 0 O-C-N 121.63 -0.669 . . . . 0.0 111.743 -177.973 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 58.7 m 49.42 67.18 0.93 Allowed 'General case' 0 N--CA 1.508 2.461 0 O-C-N 121.023 -1.048 . . . . 0.0 110.925 -174.277 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 34' ' ' ILE . . . . . 1.09 HD12 HG22 ' A' ' 48' ' ' VAL . 44.5 mm -117.7 125.9 74.4 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.974 0 O-C-N 121.537 -0.727 . . . . 0.0 109.236 -175.407 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 11.0 tp -115.93 118.97 34.44 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.687 -0.633 . . . . 0.0 110.477 -170.539 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 78.2 mt-30 -91.51 133.34 35.59 Favored 'General case' 0 N--CA 1.49 1.537 0 N-CA-C 109.333 -0.617 . . . . 0.0 109.333 171.872 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 0.498 HD23 ' HA ' ' A' ' 25' ' ' ILE . 52.0 mt -117.84 123.55 46.17 Favored 'General case' 0 N--CA 1.493 1.684 0 C-N-CA 120.222 -0.591 . . . . 0.0 110.009 174.535 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 38' ' ' ARG . . . . . 0.709 ' HB2' HG21 ' A' ' 26' ' ' THR . 40.7 ttp180 -105.65 104.97 14.8 Favored 'General case' 0 N--CA 1.496 1.826 0 O-C-N 121.758 -0.589 . . . . 0.0 110.126 174.137 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.425 HD13 ' HA2' ' A' ' 23' ' ' GLY . 64.5 tp -83.59 156.53 22.7 Favored 'General case' 0 N--CA 1.499 1.982 0 O-C-N 121.64 -0.663 . . . . 0.0 110.616 -175.977 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -68.05 -3.03 8.88 Favored 'General case' 0 N--CA 1.502 2.166 0 O-C-N 121.898 -0.501 . . . . 0.0 112.208 -170.582 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 30.1 m120 -86.75 29.13 0.82 Allowed 'General case' 0 N--CA 1.499 1.986 0 O-C-N 121.104 -0.997 . . . . 0.0 110.782 173.734 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 73.1 m-20 60.76 31.54 20.1 Favored 'General case' 0 N--CA 1.506 2.332 0 O-C-N 121.213 -0.929 . . . . 0.0 110.278 175.728 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 67.0 m -125.76 138.62 53.86 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.447 -0.783 . . . . 0.0 109.981 177.33 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 9.1 t -128.21 147.26 50.57 Favored 'General case' 0 N--CA 1.496 1.85 0 O-C-N 121.652 -0.655 . . . . 0.0 109.988 179.511 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 7.6 tmtm? -150.63 135.93 17.84 Favored 'General case' 0 N--CA 1.495 1.794 0 O-C-N 121.666 -0.646 . . . . 0.0 110.439 -177.959 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 88.5 p -94.67 124.51 38.75 Favored 'General case' 0 N--CA 1.495 1.813 0 O-C-N 121.745 -0.597 . . . . 0.0 110.208 178.372 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 82.8 mt -129.32 133.92 64.69 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.894 0 O-C-N 121.687 -0.633 . . . . 0.0 109.356 179.238 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 48' ' ' VAL . . . . . 1.09 HG22 HD12 ' A' ' 34' ' ' ILE . 63.6 t -81.88 127.74 39.33 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.925 0 C-N-CA 119.999 -0.68 . . . . 0.0 109.182 179.214 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 49' ' ' THR . . . . . 0.405 ' HB ' HD12 ' A' ' 52' ' ' ILE . 80.8 p -57.37 -25.06 58.87 Favored 'General case' 0 N--CA 1.506 2.37 0 O-C-N 121.474 -0.766 . . . . 0.0 111.927 -168.197 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 16.0 ttpp -56.8 -26.36 57.7 Favored 'General case' 0 N--CA 1.501 2.116 0 O-C-N 121.464 -0.773 . . . . 0.0 111.022 -177.126 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 5.0 p30 -84.83 6.13 25.88 Favored 'General case' 0 N--CA 1.498 1.946 0 C-N-CA 119.729 -0.788 . . . . 0.0 111.389 176.709 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 52' ' ' ILE . . . . . 0.46 HD12 HD13 ' B' ' 264' ' ' LEU . 97.7 mt -75.67 126.73 36.74 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.144 0 O-C-N 121.151 -0.968 . . . . 0.0 109.909 176.095 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 76.3 tttt -93.13 -29.17 15.9 Favored 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.802 -0.561 . . . . 0.0 109.929 170.727 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 5.0 m-20 -163.71 154.86 16.32 Favored 'General case' 0 N--CA 1.501 2.075 0 O-C-N 121.723 -0.611 . . . . 0.0 110.112 -177.836 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . 0.562 ' CD2' HG22 ' A' ' 13' ' ' VAL . 86.7 mt -132.99 148.22 52.27 Favored 'General case' 0 N--CA 1.497 1.886 0 O-C-N 121.667 -0.645 . . . . 0.0 110.507 -179.248 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 4.7 ptm180 -152.19 142.33 22.3 Favored 'General case' 0 N--CA 1.495 1.793 0 O-C-N 121.757 -0.589 . . . . 0.0 109.959 175.934 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 57' ' ' ILE . . . . . 0.479 ' HA ' HG12 ' A' ' 11' ' ' VAL . 69.9 mt -85.07 133.14 30.04 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.86 0 O-C-N 121.495 -0.753 . . . . 0.0 109.678 172.575 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . 0.577 HD11 ' HB2' ' A' ' 12' ' ' GLU . 40.6 mt -83.39 116.88 66.73 Favored Pre-proline 0 N--CA 1.497 1.905 0 O-C-N 121.496 -0.752 . . . . 0.0 110.204 -177.975 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 12.9 Cg_exo -66.7 159.46 51.04 Favored 'Trans proline' 0 N--CA 1.489 1.237 0 O-C-N 123.332 1.175 . . . . 0.0 110.207 177.001 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 77.6 tttt -63.22 -37.71 88.32 Favored 'General case' 0 N--CA 1.5 2.074 0 O-C-N 121.679 -0.638 . . . . 0.0 110.325 179.111 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 36.4 t30 -109.94 120.82 43.67 Favored 'General case' 0 N--CA 1.495 1.782 0 O-C-N 121.721 -0.612 . . . . 0.0 110.128 178.956 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 12.2 pt-20 -134.98 37.98 3.01 Favored 'General case' 0 N--CA 1.496 1.838 0 O-C-N 121.629 -0.669 . . . . 0.0 110.326 -179.614 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 18.6 tt -64.24 -30.56 50.44 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.07 0 O-C-N 121.633 -0.667 . . . . 0.0 110.602 -179.521 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 64' ' ' MET . . . . . . . . . . . . . 3.9 mtt -159.88 170.45 8.68 Favored Pre-proline 0 N--CA 1.495 1.8 0 O-C-N 121.618 -0.676 . . . . 0.0 110.12 -178.724 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 22.8 Cg_exo -60.87 -28.27 86.11 Favored 'Trans proline' 0 N--CA 1.491 1.363 0 O-C-N 123.677 1.356 . . . . 0.0 111.061 -179.772 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 92.6 mttt -81.88 145.25 30.46 Favored 'General case' 0 N--CA 1.498 1.931 0 O-C-N 121.569 -0.707 . . . . 0.0 110.212 -179.901 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 90.6 m-20 -64.38 -34.18 77.56 Favored 'General case' 0 N--CA 1.5 2.06 0 O-C-N 121.705 -0.622 . . . . 0.0 110.513 -179.183 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . -175.41 -175.17 42.62 Favored Glycine 0 N--CA 1.494 2.535 0 N-CA-C 109.577 -1.409 . . . . 0.0 109.577 -179.961 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 9.5 t -135.87 171.43 14.47 Favored 'General case' 0 N--CA 1.498 1.932 0 O-C-N 121.754 -0.85 . . . . 0.0 110.231 -179.813 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 39.0 ttpt -61.94 -35.64 79.03 Favored 'General case' 0 N--CA 1.501 2.121 0 O-C-N 121.645 -0.659 . . . . 0.0 110.429 179.855 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 98.8 p -123.81 79.55 56.69 Favored Pre-proline 0 N--CA 1.496 1.842 0 O-C-N 121.717 -0.614 . . . . 0.0 110.061 178.86 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 28.1 Cg_endo -67.12 143.57 65.73 Favored 'Trans proline' 0 N--CA 1.488 1.179 0 O-C-N 123.496 1.261 . . . . 0.0 110.437 -179.288 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 86.1 p -99.67 29.0 4.31 Favored 'General case' 0 N--CA 1.495 1.787 0 O-C-N 121.732 -0.605 . . . . 0.0 110.561 179.394 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 38.4 p -105.22 30.64 5.45 Favored 'General case' 0 N--CA 1.496 1.843 0 O-C-N 121.583 -0.698 . . . . 0.0 110.462 -179.004 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 89.4 m-20 53.32 44.27 30.32 Favored 'General case' 0 N--CA 1.505 2.311 0 O-C-N 121.493 -0.755 . . . . 0.0 110.865 179.597 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 22.8 t -64.02 -33.45 75.76 Favored 'General case' 0 N--CA 1.5 2.052 0 O-C-N 121.495 -0.753 . . . . 0.0 110.475 -179.941 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 24.2 m -66.0 -35.09 79.64 Favored 'General case' 0 N--CA 1.501 2.09 0 O-C-N 121.727 -0.608 . . . . 0.0 110.269 179.598 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 60.8 tttt -86.16 138.52 31.84 Favored 'General case' 0 N--CA 1.496 1.873 0 O-C-N 121.734 -0.604 . . . . 0.0 110.25 179.97 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 82.4 mt -90.67 151.05 21.42 Favored 'General case' 0 N--CA 1.498 1.926 0 O-C-N 121.63 -0.669 . . . . 0.0 110.136 -179.511 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 39.4 tttp -62.27 -33.29 74.35 Favored 'General case' 0 N--CA 1.502 2.163 0 O-C-N 121.73 -0.606 . . . . 0.0 110.464 -179.803 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 28.9 t -97.9 143.0 28.95 Favored 'General case' 0 N--CA 1.495 1.785 0 O-C-N 121.679 -0.638 . . . . 0.0 110.186 179.759 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -132.75 -167.95 1.99 Allowed 'General case' 0 N--CA 1.495 1.821 0 O-C-N 121.611 -0.681 . . . . 0.0 110.212 -179.168 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 74.8 mm-40 -94.51 158.49 15.52 Favored 'General case' 0 N--CA 1.495 1.797 0 O-C-N 121.738 -0.601 . . . . 0.0 110.22 -179.722 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 24.2 m -64.64 -35.81 82.23 Favored 'General case' 0 N--CA 1.501 2.096 0 O-C-N 121.653 -0.654 . . . . 0.0 110.355 -179.197 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 99.4 m-85 -113.36 133.68 55.02 Favored 'General case' 0 N--CA 1.495 1.798 0 O-C-N 121.625 -0.672 . . . . 0.0 110.232 -179.739 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 28.9 t -140.85 145.99 36.93 Favored 'General case' 0 N--CA 1.495 1.777 0 O-C-N 121.639 -0.663 . . . . 0.0 110.18 179.552 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 98.3 p -122.1 150.73 41.76 Favored 'General case' 0 N--CA 1.494 1.766 0 O-C-N 121.628 -0.67 . . . . 0.0 110.296 -179.92 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 98.6 mttt -126.79 147.21 50.02 Favored 'General case' 0 N--CA 1.496 1.828 0 O-C-N 121.7 -0.625 . . . . 0.0 110.078 179.418 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 29.9 m120 -104.38 103.51 13.25 Favored 'General case' 0 N--CA 1.494 1.766 0 O-C-N 121.628 -0.67 . . . . 0.0 110.248 -179.744 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 94.9 mttt -133.02 132.32 41.72 Favored 'General case' 0 N--CA 1.495 1.789 0 O-C-N 121.622 -0.674 . . . . 0.0 110.133 179.104 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 91' ' ' TRP . . . . . . . . . . . . . 87.3 t90 -126.78 125.04 41.05 Favored 'General case' 0 N--CA 1.495 1.798 0 O-C-N 121.662 -0.648 . . . . 0.0 110.233 179.678 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 29.0 t -146.1 137.48 24.73 Favored 'General case' 0 N--CA 1.495 1.814 0 O-C-N 121.704 -0.623 . . . . 0.0 110.224 179.271 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 93' ' ' MET . . . . . . . . . . . . . 74.4 mtm -66.86 -35.77 80.79 Favored 'General case' 0 N--CA 1.5 2.039 0 O-C-N 121.651 -0.656 . . . . 0.0 110.302 179.541 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 74.4 m-20 . . . . . 0 N--CA 1.505 2.308 0 CA-C-O 118.012 -0.994 . . . . 0.0 111.043 -179.91 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' B' B ' 240' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.326 0 N-CA-C 109.495 -1.442 . . . . 0.0 109.495 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' B' B ' 241' ' ' ALA . . . . . . . . . . . . . . . -142.26 151.35 41.98 Favored 'General case' 0 N--CA 1.495 1.79 0 O-C-N 121.66 -0.906 . . . . 0.0 110.201 179.841 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 242' ' ' THR . . . . . . . . . . . . . 9.8 t -137.56 156.41 48.13 Favored 'General case' 0 N--CA 1.496 1.865 0 O-C-N 121.698 -0.626 . . . . 0.0 110.452 -179.832 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 243' ' ' THR . . . . . . . . . . . . . 23.0 m -152.25 -61.16 0.16 Allowed 'General case' 0 N--CA 1.495 1.803 0 O-C-N 121.677 -0.639 . . . . 0.0 110.056 179.255 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 244' ' ' LYS . . . . . . . . . . . . . 54.1 mttp -104.24 29.03 6.3 Favored 'General case' 0 N--CA 1.496 1.826 0 O-C-N 121.705 -0.622 . . . . 0.0 110.477 179.312 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 245' ' ' GLU . . . . . . . . . . . . . 46.4 mt-10 -111.42 166.4 11.16 Favored 'General case' 0 N--CA 1.496 1.848 0 O-C-N 121.656 -0.652 . . . . 0.0 110.077 -179.453 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 246' ' ' LYS . . . . . . . . . . . . . 58.8 mttm 53.48 70.58 0.58 Allowed 'General case' 0 N--CA 1.504 2.246 0 O-C-N 121.587 -0.695 . . . . 0.0 110.841 179.809 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 247' ' ' ASN . . . . . . . . . . . . . 34.6 t30 -61.55 -32.32 72.39 Favored 'General case' 0 N--CA 1.503 2.175 0 O-C-N 121.544 -0.723 . . . . 0.0 110.611 -179.371 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 248' ' ' ILE . . . . . . . . . . . . . 80.6 mt 53.76 94.6 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.508 2.452 0 O-C-N 121.552 -0.717 . . . . 0.0 110.432 -179.87 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 249' ' ' SER . . . . . . . . . . . . . 66.5 m -79.79 -174.83 4.57 Favored 'General case' 0 N--CA 1.498 1.932 0 O-C-N 121.723 -0.61 . . . . 0.0 110.162 -179.759 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 250' ' ' VAL . . . . . . . . . . . . . 11.9 p -87.08 152.12 3.48 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.897 0 O-C-N 121.7 -0.625 . . . . 0.0 110.135 -179.623 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 251' ' ' ASP . . . . . 0.534 ' OD2' ' HB3' ' B' ' 254' ' ' ALA . 25.9 t0 53.18 35.13 19.08 Favored 'General case' 0 N--CA 1.506 2.335 0 O-C-N 121.674 -0.642 . . . . 0.0 110.921 -178.464 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 252' ' ' VAL . . . . . 0.437 HG22 ' C ' ' B' ' 251' ' ' ASP . 32.8 m 36.73 36.45 0.15 Allowed 'Isoleucine or valine' 0 N--CA 1.514 2.768 0 N-CA-C 112.52 0.563 . . . . 0.0 112.52 179.325 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 253' ' ' ASP . . . . . . . . . . . . . 74.6 m-20 52.64 50.68 17.63 Favored 'General case' 0 N--CA 1.506 2.346 0 O-C-N 121.615 -0.678 . . . . 0.0 110.858 -179.878 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 254' ' ' ALA . . . . . 0.534 ' HB3' ' OD2' ' B' ' 251' ' ' ASP . . . -66.44 -29.62 69.79 Favored 'General case' 0 N--CA 1.5 2.042 0 O-C-N 121.635 -0.665 . . . . 0.0 110.616 -179.27 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 255' ' ' ASP . . . . . . . . . . . . . 74.5 m-20 -72.09 -31.47 66.1 Favored 'General case' 0 N--CA 1.498 1.958 0 O-C-N 121.575 -0.703 . . . . 0.0 110.289 -179.171 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 256' ' ' ALA . . . . . . . . . . . . . . . -64.67 -40.51 95.53 Favored 'General case' 0 N--CA 1.5 2.074 0 O-C-N 121.498 -0.751 . . . . 0.0 110.279 177.687 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 257' ' ' SER . . . . . . . . . . . . . 36.8 m -56.65 -38.43 72.17 Favored 'General case' 0 N--CA 1.503 2.195 0 O-C-N 121.683 -0.635 . . . . 0.0 110.659 179.92 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 258' ' ' SER . . . . . . . . . . . . . 59.8 p -69.85 -29.63 66.92 Favored 'General case' 0 N--CA 1.5 2.039 0 C-N-CA 120.268 -0.573 . . . . 0.0 110.468 -178.225 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 259' ' ' GLN . . . . . . . . . . . . . 98.8 mt-30 -64.0 -38.77 92.28 Favored 'General case' 0 N--CA 1.502 2.126 0 O-C-N 121.547 -0.721 . . . . 0.0 110.487 -179.698 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 260' ' ' LEU . . . . . 0.485 ' HA ' HD12 ' B' ' 263' ' ' LEU . 81.3 mt -67.77 -44.29 77.8 Favored 'General case' 0 N--CA 1.501 2.076 0 O-C-N 121.608 -0.682 . . . . 0.0 110.246 179.713 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 261' ' ' LEU . . . . . . . . . . . . . 22.8 tp -68.61 -35.94 78.0 Favored 'General case' 0 N--CA 1.497 1.899 0 O-C-N 121.652 -0.655 . . . . 0.0 109.799 176.778 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 262' ' ' SER . . . . . . . . . . . . . 23.0 t -62.3 -36.72 83.02 Favored 'General case' 0 N--CA 1.5 2.064 0 O-C-N 121.753 -0.592 . . . . 0.0 110.457 177.521 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 263' ' ' LEU . . . . . 0.485 HD12 ' HA ' ' B' ' 260' ' ' LEU . 23.2 mt -65.37 -46.05 81.68 Favored 'General case' 0 N--CA 1.501 2.109 0 O-C-N 121.703 -0.623 . . . . 0.0 110.099 179.582 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 264' ' ' LEU . . . . . 0.46 HD13 HD12 ' A' ' 52' ' ' ILE . 81.8 mt -63.53 -37.33 86.91 Favored 'General case' 0 N--CA 1.502 2.127 0 O-C-N 121.775 -0.578 . . . . 0.0 110.585 178.571 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 265' ' ' LYS . . . . . . . . . . . . . 51.3 tttm -76.42 -44.97 33.62 Favored 'General case' 0 N--CA 1.498 1.928 0 O-C-N 121.701 -0.624 . . . . 0.0 110.211 -177.683 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 266' ' ' SER . . . . . . . . . . . . . 85.6 p -79.82 149.66 30.95 Favored 'General case' 0 N--CA 1.496 1.849 0 O-C-N 121.676 -0.64 . . . . 0.0 110.26 -179.625 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 267' ' ' SER . . . . . . . . . . . . . 85.2 p -156.58 135.66 11.97 Favored 'General case' 0 N--CA 1.495 1.784 0 O-C-N 121.605 -0.684 . . . . 0.0 110.258 179.079 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 268' ' ' THR . . . . . . . . . . . . . 7.9 t -164.21 31.2 0.08 Allowed 'General case' 0 N--CA 1.498 1.957 0 O-C-N 121.699 -0.625 . . . . 0.0 110.222 178.76 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 269' ' ' ALA . . . . . . . . . . . . . . . 47.7 56.64 17.69 Favored Pre-proline 0 N--CA 1.505 2.325 0 O-C-N 121.774 -0.579 . . . . 0.0 111.179 -177.283 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 270' ' ' PRO . . . . . . . . . . . . . 28.7 Cg_endo -67.53 125.16 12.93 Favored 'Trans proline' 0 N--CA 1.487 1.145 0 O-C-N 123.532 1.28 . . . . 0.0 110.383 -178.789 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 271' ' ' SER . . . . . . . . . . . . . 49.5 m -130.31 144.7 51.54 Favored 'General case' 0 N--CA 1.495 1.777 0 O-C-N 121.677 -0.64 . . . . 0.0 110.213 179.05 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 272' ' ' ASP . . . . . . . . . . . . . 26.4 t0 -143.71 137.16 27.96 Favored 'General case' 0 N--CA 1.494 1.772 0 O-C-N 121.641 -0.662 . . . . 0.0 110.134 179.37 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 273' ' ' LEU . . . . . . . . . . . . . 82.8 mt 51.79 94.22 0.02 OUTLIER 'General case' 0 N--CA 1.506 2.342 0 O-C-N 121.61 -0.681 . . . . 0.0 111.092 -179.338 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 274' ' ' ALA . . . . . . . . . . . . . . . 50.76 -172.19 0.02 OUTLIER 'General case' 0 N--CA 1.505 2.313 0 O-C-N 121.604 -0.685 . . . . 0.0 111.186 -178.389 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 275' ' ' THR . . . . . . . . . . . . . 31.0 p -131.58 165.56 34.62 Favored Pre-proline 0 N--CA 1.496 1.837 0 O-C-N 121.747 -0.596 . . . . 0.0 110.252 -179.655 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 276' ' ' PRO . . . . . . . . . . . . . 20.3 Cg_exo -62.3 148.54 93.08 Favored 'Trans proline' 0 N--CA 1.49 1.275 0 O-C-N 123.656 1.345 . . . . 0.0 110.607 179.811 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 277' ' ' GLN . . . . . . . . . . . . . 22.7 mt-30 -97.48 158.92 32.3 Favored Pre-proline 0 N--CA 1.494 1.742 0 O-C-N 121.612 -0.68 . . . . 0.0 110.319 -179.845 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 278' ' ' PRO . . . . . . . . . . . . . 27.3 Cg_endo -66.8 151.1 83.08 Favored 'Trans proline' 0 N--CA 1.488 1.157 0 O-C-N 123.679 1.357 . . . . 0.0 110.424 -179.962 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 279' ' ' SER . . . . . . . . . . . . . 22.7 t -64.46 -32.98 74.83 Favored 'General case' 0 N--CA 1.501 2.092 0 O-C-N 121.691 -0.631 . . . . 0.0 110.436 179.898 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 280' ' ' THR . . . . . . . . . . . . . 24.6 m -114.47 139.59 49.41 Favored 'General case' 0 N--CA 1.496 1.845 0 O-C-N 121.699 -0.625 . . . . 0.0 110.029 179.824 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 281' ' ' PHE . . . . . . . . . . . . . 16.1 p90 -129.75 154.89 81.07 Favored Pre-proline 0 N--CA 1.496 1.872 0 O-C-N 121.731 -0.605 . . . . 0.0 110.249 -179.384 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 282' ' ' PRO . . . . . . . . . . . . . 36.3 Cg_endo -70.39 -50.76 0.37 Allowed 'Trans proline' 0 N--CA 1.487 1.116 0 O-C-N 123.728 1.383 . . . . 0.0 110.363 179.367 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 283' ' ' GLN . . . . . . . . . . . . . 16.2 mm100 -125.74 161.54 50.33 Favored Pre-proline 0 N--CA 1.496 1.858 0 O-C-N 121.732 -0.605 . . . . 0.0 110.163 -179.62 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 284' ' ' PRO . . . . . . . . . . . . . 27.5 Cg_endo -66.78 153.83 76.6 Favored 'Trans proline' 0 N--CA 1.488 1.186 0 O-C-N 123.682 1.359 . . . . 0.0 110.42 -178.878 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 285' ' ' PRO . . . . . . . . . . . . . 29.3 Cg_endo -67.67 150.28 79.37 Favored 'Trans proline' 0 N--CA 1.488 1.201 0 O-C-N 123.623 1.328 . . . . 0.0 110.421 -179.213 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 286' ' ' VAL . . . . . . . . . . . . . 61.0 t -111.9 135.04 52.43 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.925 0 O-C-N 121.634 -0.666 . . . . 0.0 109.608 179.098 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 287' ' ' GLU . . . . . . . . . . . . . 41.3 tt0 -66.31 -40.38 89.92 Favored 'General case' 0 N--CA 1.5 2.048 0 O-C-N 121.709 -0.619 . . . . 0.0 110.253 -178.786 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 288' ' ' SER . . . . . . . . . . . . . 49.0 m -130.4 142.29 50.52 Favored 'General case' 0 N--CA 1.496 1.862 0 O-C-N 121.647 -0.658 . . . . 0.0 110.206 179.486 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 289' ' ' HIS . . . . . . . . . . . . . 77.6 m80 -104.59 -33.28 8.57 Favored 'General case' 0 N--CA 1.495 1.777 0 O-C-N 121.76 -0.587 . . . . 0.0 110.278 179.004 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 290' ' ' SER . . . . . . . . . . . . . 23.4 m -66.02 -34.68 78.65 Favored 'General case' 0 N--CA 1.498 1.972 0 O-C-N 121.672 -0.642 . . . . 0.0 110.397 179.839 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 291' ' ' SER . . . . . . . . . . . . . 39.1 m . . . . . 0 N--CA 1.495 1.796 0 CA-C-O 118.031 -0.985 . . . . 0.0 110.217 -179.849 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' -1' ' ' MET . . . . . . . . . . . . . 74.0 mtm . . . . . 0 N--CA 1.493 1.696 0 CA-C-O 120.952 0.405 . . . . 0.0 110.219 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 0' ' ' GLY . . . . . . . . . . . . . . . -151.46 -176.13 23.95 Favored Glycine 0 N--CA 1.494 2.512 0 N-CA-C 109.608 -1.397 . . . . 0.0 109.608 -179.784 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 14.2 ptm -144.14 68.77 1.27 Allowed 'General case' 0 N--CA 1.496 1.845 0 O-C-N 121.717 -0.872 . . . . 0.0 110.232 -179.821 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 69.8 m -92.18 172.94 8.09 Favored 'General case' 0 N--CA 1.495 1.81 0 O-C-N 121.413 -0.805 . . . . 0.0 110.167 -179.033 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 3' ' ' VAL . . . . . 0.449 HG12 ' CE1' ' A' ' 7' ' ' TYR . 65.7 t -66.45 -27.8 41.46 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.054 0 O-C-N 121.761 -0.587 . . . . 0.0 110.274 -179.368 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -55.3 -31.11 61.37 Favored 'General case' 0 N--CA 1.504 2.231 0 O-C-N 121.376 -0.828 . . . . 0.0 110.388 -179.033 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 9.7 m-20 -68.66 -31.13 70.04 Favored 'General case' 0 N--CA 1.499 1.985 0 O-C-N 121.821 -0.549 . . . . 0.0 110.222 174.647 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 96.4 m-85 -95.67 10.07 38.1 Favored 'General case' 0 N--CA 1.497 1.908 0 O-C-N 121.585 -0.697 . . . . 0.0 111.531 -178.955 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' TYR . . . . . 0.449 ' CE1' HG12 ' A' ' 3' ' ' VAL . 3.3 m-30 -67.24 139.05 57.33 Favored 'General case' 0 N--CA 1.502 2.17 0 O-C-N 121.196 -0.94 . . . . 0.0 109.961 174.783 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 82.84 -0.32 89.68 Favored Glycine 0 N--CA 1.497 2.762 0 N-CA-C 110.602 -0.999 . . . . 0.0 110.602 -175.541 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 29.0 t -76.57 137.66 39.68 Favored 'General case' 0 N--CA 1.498 1.935 0 O-C-N 121.154 -1.204 . . . . 0.0 110.509 -179.991 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' ASN . . . . . 0.667 ' CG ' HG22 ' A' ' 24' ' ' VAL . 2.4 m120 -84.14 115.59 22.48 Favored 'General case' 0 N--CA 1.498 1.97 0 O-C-N 121.684 -0.635 . . . . 0.0 109.418 174.143 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . 0.646 HG21 HD11 ' A' ' 25' ' ' ILE . 35.7 m -141.89 162.45 20.11 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.725 0 O-C-N 121.699 -0.626 . . . . 0.0 109.769 -178.443 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . 0.569 ' HB2' HD11 ' A' ' 58' ' ' LEU . 47.0 tt0 -109.48 129.11 55.58 Favored 'General case' 0 N--CA 1.492 1.675 0 C-N-CA 119.914 -0.714 . . . . 0.0 110.012 177.933 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . 0.56 HG22 ' CD2' ' A' ' 55' ' ' LEU . 61.7 t -106.66 126.53 62.5 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.655 0 O-C-N 121.614 -0.679 . . . . 0.0 109.838 -179.439 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.413 HD13 ' HG2' ' A' ' 20' ' ' LYS . 28.5 tp -95.86 126.63 41.25 Favored 'General case' 0 N--CA 1.493 1.703 0 N-CA-C 109.155 -0.683 . . . . 0.0 109.155 175.14 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 86.8 mt -96.39 167.11 11.37 Favored 'General case' 0 N--CA 1.496 1.836 0 O-C-N 121.587 -0.696 . . . . 0.0 111.076 -172.822 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 24.3 p30 -58.54 -21.81 53.6 Favored 'General case' 0 N--CA 1.504 2.263 0 O-C-N 121.82 -0.55 . . . . 0.0 111.685 -176.96 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 41.8 p-10 -92.76 23.51 4.09 Favored 'General case' 0 N--CA 1.497 1.924 0 O-C-N 121.531 -0.731 . . . . 0.0 110.899 -176.191 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 74.3 m-20 58.73 27.57 16.13 Favored 'General case' 0 N--CA 1.505 2.307 0 O-C-N 121.472 -0.767 . . . . 0.0 110.606 176.06 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 50.6 m -106.37 144.57 32.87 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.527 -0.733 . . . . 0.0 109.485 172.741 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . 0.413 ' HG2' HD13 ' A' ' 14' ' ' LEU . 74.4 mttt -109.64 148.83 30.64 Favored 'General case' 0 N--CA 1.496 1.836 0 O-C-N 121.582 -0.699 . . . . 0.0 110.557 -176.305 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -153.05 153.56 33.1 Favored 'General case' 0 N--CA 1.496 1.869 0 O-C-N 121.717 -0.614 . . . . 0.0 110.248 176.123 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . 0.503 ' O ' HD13 ' A' ' 39' ' ' LEU . 31.1 ptt180 -144.0 143.25 31.12 Favored 'General case' 0 N--CA 1.498 1.951 0 O-C-N 121.663 -0.648 . . . . 0.0 110.533 178.265 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -171.78 171.45 44.11 Favored Glycine 0 N--CA 1.494 2.51 0 N-CA-C 108.878 -1.689 . . . . 0.0 108.878 -174.986 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . 0.667 HG22 ' CG ' ' A' ' 10' ' ' ASN . 39.5 t -94.54 118.37 40.42 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.916 0 O-C-N 121.468 -1.019 . . . . 0.0 109.382 -176.461 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 25' ' ' ILE . . . . . 0.646 HD11 HG21 ' A' ' 11' ' ' VAL . 76.5 mt -63.72 143.27 15.81 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.122 0 O-C-N 121.657 -0.652 . . . . 0.0 110.442 -172.064 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . 0.623 HG21 ' HB2' ' A' ' 38' ' ' ARG . 7.0 p -121.2 -27.76 4.83 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.733 -0.604 . . . . 0.0 111.283 -179.664 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 7.3 t-20 -161.94 158.25 24.98 Favored 'General case' 0 N--CA 1.499 2.012 0 C-N-CA 119.004 -1.078 . . . . 0.0 111.594 -177.622 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 28' ' ' PHE . . . . . 0.512 ' CE1' HG21 ' A' ' 49' ' ' THR . 77.1 t80 -150.1 126.71 10.92 Favored 'General case' 0 N--CA 1.498 1.936 0 N-CA-C 109.235 -0.654 . . . . 0.0 109.235 170.17 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 17.8 t70 -100.31 130.98 46.49 Favored 'General case' 0 N--CA 1.491 1.594 0 N-CA-C 109.095 -0.705 . . . . 0.0 109.095 -177.711 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 19.5 m -68.55 -48.69 63.62 Favored 'General case' 0 N--CA 1.498 1.975 0 C-N-CA 120.031 -0.668 . . . . 0.0 110.629 -175.703 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 25.2 m -59.49 -44.16 93.15 Favored 'General case' 0 N--CA 1.503 2.206 0 O-C-N 121.57 -0.706 . . . . 0.0 110.859 -174.078 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 29.6 m120 -103.88 -8.84 19.4 Favored 'General case' 0 N--CA 1.497 1.882 0 O-C-N 121.622 -0.674 . . . . 0.0 111.52 -178.164 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 16.1 m 49.46 67.22 0.92 Allowed 'General case' 0 N--CA 1.507 2.387 0 O-C-N 121.141 -0.974 . . . . 0.0 110.928 -174.381 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 34' ' ' ILE . . . . . 1.076 HD12 HG22 ' A' ' 48' ' ' VAL . 45.8 mm -121.96 125.91 73.78 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.071 0 O-C-N 121.629 -0.669 . . . . 0.0 109.407 -175.679 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 7.3 tp -115.81 119.69 36.83 Favored 'General case' 0 N--CA 1.494 1.767 0 O-C-N 121.648 -0.658 . . . . 0.0 110.429 -168.847 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 98.9 mt-30 -90.98 134.25 34.63 Favored 'General case' 0 N--CA 1.49 1.544 0 C-N-CA 120.315 -0.554 . . . . 0.0 109.576 174.72 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 0.421 HD23 ' HA ' ' A' ' 25' ' ' ILE . 15.8 mt -117.79 123.83 46.91 Favored 'General case' 0 N--CA 1.495 1.787 0 O-C-N 121.939 -0.476 . . . . 0.0 109.966 174.72 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 38' ' ' ARG . . . . . 0.623 ' HB2' HG21 ' A' ' 26' ' ' THR . 74.4 ttt-85 -97.27 106.2 18.48 Favored 'General case' 0 N--CA 1.497 1.897 0 O-C-N 121.741 -0.6 . . . . 0.0 109.779 175.746 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.503 HD13 ' O ' ' A' ' 22' ' ' ARG . 18.8 tp -84.72 152.06 23.98 Favored 'General case' 0 N--CA 1.495 1.777 0 O-C-N 121.678 -0.639 . . . . 0.0 110.877 -174.227 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -68.14 -3.55 10.84 Favored 'General case' 0 N--CA 1.502 2.146 0 O-C-N 121.928 -0.482 . . . . 0.0 111.982 -172.455 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 23.2 m120 -87.05 27.56 1.01 Allowed 'General case' 0 N--CA 1.498 1.941 0 O-C-N 121.07 -1.019 . . . . 0.0 110.923 173.545 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 14.8 t0 63.11 29.31 16.2 Favored 'General case' 0 N--CA 1.505 2.279 0 O-C-N 121.042 -1.036 . . . . 0.0 110.523 176.088 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 50.7 m -125.08 137.8 54.19 Favored 'General case' 0 N--CA 1.495 1.81 0 O-C-N 121.313 -0.867 . . . . 0.0 110.568 -179.267 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 9.8 t -98.11 151.04 20.8 Favored 'General case' 0 N--CA 1.496 1.845 0 O-C-N 121.817 -0.552 . . . . 0.0 110.208 175.362 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 33.6 ttmt -150.2 119.17 6.68 Favored 'General case' 0 N--CA 1.495 1.817 0 O-C-N 121.525 -0.734 . . . . 0.0 110.362 178.577 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 89.7 p -96.2 123.81 39.96 Favored 'General case' 0 N--CA 1.495 1.797 0 O-C-N 121.675 -0.64 . . . . 0.0 110.249 179.079 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 82.5 mt -129.4 135.89 60.62 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.887 0 N-CA-C 109.309 -0.626 . . . . 0.0 109.309 179.203 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 48' ' ' VAL . . . . . 1.076 HG22 HD12 ' A' ' 34' ' ' ILE . 64.0 t -81.87 127.6 39.46 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.895 0 C-N-CA 120.032 -0.667 . . . . 0.0 109.265 179.358 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 49' ' ' THR . . . . . 0.512 HG21 ' CE1' ' A' ' 28' ' ' PHE . 39.0 p -59.17 -24.85 63.42 Favored 'General case' 0 N--CA 1.504 2.239 0 O-C-N 121.668 -0.645 . . . . 0.0 112.071 -169.744 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 63.4 tttt -56.46 -24.1 43.33 Favored 'General case' 0 N--CA 1.504 2.227 0 O-C-N 121.46 -0.775 . . . . 0.0 110.981 -176.824 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 46.5 p30 -83.91 2.52 38.22 Favored 'General case' 0 N--CA 1.499 1.987 0 O-C-N 121.468 -0.77 . . . . 0.0 111.281 176.598 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 98.8 mt -75.47 127.34 36.95 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.113 0 O-C-N 121.195 -0.941 . . . . 0.0 109.987 177.978 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 50.4 tttm -92.45 -29.79 16.07 Favored 'General case' 0 N--CA 1.494 1.739 0 O-C-N 121.871 -0.518 . . . . 0.0 109.652 170.506 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . 0.411 ' HA ' HD22 ' B' ' 261' ' ' LEU . 5.3 m-20 -163.95 156.89 17.94 Favored 'General case' 0 N--CA 1.499 2.022 0 O-C-N 121.795 -0.566 . . . . 0.0 110.053 -178.141 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . 0.56 ' CD2' HG22 ' A' ' 13' ' ' VAL . 84.3 mt -133.01 148.54 52.25 Favored 'General case' 0 N--CA 1.496 1.858 0 O-C-N 121.675 -0.641 . . . . 0.0 110.513 -179.376 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 6.5 ptm180 -151.94 143.04 23.2 Favored 'General case' 0 N--CA 1.495 1.812 0 O-C-N 121.673 -0.642 . . . . 0.0 110.046 176.006 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 57' ' ' ILE . . . . . 0.504 ' HA ' HG12 ' A' ' 11' ' ' VAL . 68.7 mt -85.33 133.2 29.98 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.843 0 O-C-N 121.443 -0.786 . . . . 0.0 109.718 173.218 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . 0.569 HD11 ' HB2' ' A' ' 12' ' ' GLU . 59.2 mt -83.84 146.72 49.9 Favored Pre-proline 0 N--CA 1.497 1.915 0 O-C-N 121.583 -0.698 . . . . 0.0 110.164 -179.021 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 42.3 Cg_endo -73.24 102.29 1.45 Allowed 'Trans proline' 0 N--CA 1.486 1.086 0 O-C-N 123.55 1.29 . . . . 0.0 110.3 179.805 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 72.5 mttt -133.36 131.28 39.88 Favored 'General case' 0 N--CA 1.496 1.846 0 O-C-N 121.667 -0.646 . . . . 0.0 110.206 179.531 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 16.5 t-20 -117.57 125.7 51.27 Favored 'General case' 0 N--CA 1.495 1.791 0 O-C-N 121.717 -0.615 . . . . 0.0 110.273 -179.666 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 27.7 tt0 -152.34 37.08 0.53 Allowed 'General case' 0 N--CA 1.495 1.817 0 O-C-N 121.7 -0.625 . . . . 0.0 109.967 179.516 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 51.0 mm -68.99 -34.92 66.55 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.064 0 O-C-N 121.62 -0.675 . . . . 0.0 109.811 -179.4 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 64' ' ' MET . . . . . . . . . . . . . 11.6 ttm 52.22 58.85 15.1 Favored Pre-proline 0 N--CA 1.505 2.324 0 O-C-N 121.606 -0.684 . . . . 0.0 110.797 -179.292 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 28.4 Cg_endo -67.07 -28.02 41.61 Favored 'Trans proline' 0 N--CA 1.489 1.253 0 O-C-N 123.564 1.297 . . . . 0.0 110.855 -178.657 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 79.0 mttt -61.62 -45.31 94.61 Favored 'General case' 0 N--CA 1.502 2.169 0 O-C-N 121.53 -0.731 . . . . 0.0 110.763 -177.208 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 24.9 m120 -68.66 -40.64 80.11 Favored 'General case' 0 N--CA 1.499 1.978 0 O-C-N 121.594 -0.691 . . . . 0.0 110.217 179.534 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 67.89 -138.67 33.52 Favored Glycine 0 N--CA 1.495 2.602 0 N-CA-C 109.739 -1.344 . . . . 0.0 109.739 179.431 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 8.6 t -136.62 32.74 2.74 Favored 'General case' 0 N--CA 1.498 1.967 0 O-C-N 121.69 -0.888 . . . . 0.0 110.252 179.16 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 40.9 tttm -93.41 123.46 36.73 Favored 'General case' 0 N--CA 1.495 1.82 0 O-C-N 121.7 -0.625 . . . . 0.0 110.18 -179.256 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . 0.402 ' N ' ' HD2' ' A' ' 72' ' ' PRO . 1.9 t -68.39 -56.79 9.73 Favored Pre-proline 0 N--CA 1.498 1.948 0 O-C-N 121.656 -0.652 . . . . 0.0 110.398 -179.534 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 72' ' ' PRO . . . . . 0.402 ' HD2' ' N ' ' A' ' 71' ' ' SER . 30.3 Cg_endo -68.64 143.66 57.37 Favored 'Trans proline' 0 N--CA 1.489 1.222 0 O-C-N 123.171 1.09 . . . . 0.0 110.237 178.709 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 89.3 p -125.21 156.64 38.15 Favored 'General case' 0 N--CA 1.496 1.852 0 O-C-N 121.657 -0.652 . . . . 0.0 110.21 -179.594 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 24.0 m -82.77 137.92 34.19 Favored 'General case' 0 N--CA 1.496 1.856 0 O-C-N 121.591 -0.693 . . . . 0.0 110.02 179.294 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 29.9 m120 -101.57 115.35 30.32 Favored 'General case' 0 N--CA 1.496 1.839 0 O-C-N 121.679 -0.638 . . . . 0.0 110.234 -178.718 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 4.5 t -92.37 -31.47 15.32 Favored 'General case' 0 N--CA 1.496 1.852 0 O-C-N 121.678 -0.639 . . . . 0.0 110.289 178.854 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 47.1 p -66.82 -29.67 69.66 Favored 'General case' 0 N--CA 1.5 2.073 0 O-C-N 121.591 -0.693 . . . . 0.0 110.558 179.883 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 61.3 mttm -73.15 165.95 24.05 Favored 'General case' 0 N--CA 1.498 1.944 0 O-C-N 121.551 -0.718 . . . . 0.0 110.214 -179.865 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . 0.523 HD21 ' O ' ' A' ' 81' ' ' SER . 8.5 tt -92.06 131.52 37.27 Favored 'General case' 0 N--CA 1.496 1.854 0 O-C-N 121.75 -0.594 . . . . 0.0 110.149 -178.449 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 38.1 ttpt -85.77 -62.62 1.48 Allowed 'General case' 0 N--CA 1.497 1.916 0 O-C-N 121.694 -0.629 . . . . 0.0 110.139 -179.336 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 81' ' ' SER . . . . . 0.523 ' O ' HD21 ' A' ' 79' ' ' LEU . 48.1 m -122.6 142.35 50.74 Favored 'General case' 0 N--CA 1.496 1.841 0 O-C-N 121.684 -0.635 . . . . 0.0 110.088 179.916 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -106.27 130.22 54.16 Favored 'General case' 0 N--CA 1.494 1.725 0 O-C-N 121.675 -0.64 . . . . 0.0 110.333 -179.419 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 13.5 mm-40 -68.39 -33.45 74.26 Favored 'General case' 0 N--CA 1.499 2.0 0 O-C-N 121.69 -0.631 . . . . 0.0 110.121 178.697 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 40.7 p -121.43 168.86 11.22 Favored 'General case' 0 N--CA 1.496 1.85 0 O-C-N 121.711 -0.618 . . . . 0.0 110.066 179.484 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 53.0 p90 -114.9 141.02 48.5 Favored 'General case' 0 N--CA 1.497 1.886 0 O-C-N 121.686 -0.634 . . . . 0.0 110.276 -179.541 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 29.9 t -150.61 157.29 42.82 Favored 'General case' 0 N--CA 1.494 1.765 0 O-C-N 121.713 -0.617 . . . . 0.0 110.269 -179.833 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 48.6 m -117.53 144.77 44.76 Favored 'General case' 0 N--CA 1.496 1.857 0 O-C-N 121.703 -0.623 . . . . 0.0 110.205 179.747 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 52.7 mttp -125.59 147.68 49.2 Favored 'General case' 0 N--CA 1.496 1.832 0 O-C-N 121.683 -0.636 . . . . 0.0 110.255 179.781 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 29.6 m120 -101.25 29.0 4.97 Favored 'General case' 0 N--CA 1.496 1.86 0 O-C-N 121.667 -0.646 . . . . 0.0 110.549 179.816 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 23.3 tptp -130.84 129.4 42.29 Favored 'General case' 0 N--CA 1.496 1.865 0 O-C-N 121.605 -0.685 . . . . 0.0 110.005 -179.819 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 91' ' ' TRP . . . . . . . . . . . . . 98.7 m95 -111.04 134.31 52.74 Favored 'General case' 0 N--CA 1.495 1.811 0 O-C-N 121.738 -0.601 . . . . 0.0 110.313 -178.909 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 23.2 t -66.94 -37.39 84.23 Favored 'General case' 0 N--CA 1.499 2.017 0 O-C-N 121.66 -0.65 . . . . 0.0 110.25 179.512 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 93' ' ' MET . . . . . . . . . . . . . 49.9 ttm -131.72 148.43 52.58 Favored 'General case' 0 N--CA 1.495 1.79 0 O-C-N 121.672 -0.643 . . . . 0.0 110.183 -179.989 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 75.1 m-20 . . . . . 0 N--CA 1.495 1.775 0 CA-C-O 117.97 -1.014 . . . . 0.0 110.218 179.976 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' B' B ' 240' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.493 2.437 0 N-CA-C 109.478 -1.449 . . . . 0.0 109.478 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' B' B ' 241' ' ' ALA . . . . . . . . . . . . . . . -67.26 -33.88 76.24 Favored 'General case' 0 N--CA 1.5 2.067 0 O-C-N 121.687 -0.89 . . . . 0.0 110.247 -179.883 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 242' ' ' THR . . . . . . . . . . . . . 42.1 p -68.91 -42.62 76.61 Favored 'General case' 0 N--CA 1.499 2.023 0 O-C-N 121.686 -0.634 . . . . 0.0 110.182 -179.952 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 243' ' ' THR . . . . . . . . . . . . . 9.8 t -152.23 151.75 31.36 Favored 'General case' 0 N--CA 1.496 1.861 0 O-C-N 121.682 -0.636 . . . . 0.0 110.428 179.37 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 244' ' ' LYS . . . . . . . . . . . . . 21.7 pttm -141.35 175.81 9.36 Favored 'General case' 0 N--CA 1.497 1.881 0 O-C-N 121.724 -0.61 . . . . 0.0 110.285 178.534 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 245' ' ' GLU . . . . . . . . . . . . . 74.8 mm-40 -65.38 -32.25 73.79 Favored 'General case' 0 N--CA 1.5 2.053 0 O-C-N 121.71 -0.618 . . . . 0.0 110.515 -179.265 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 246' ' ' LYS . . . . . . . . . . . . . 56.2 mttm -90.06 166.91 13.15 Favored 'General case' 0 N--CA 1.496 1.853 0 O-C-N 121.654 -0.654 . . . . 0.0 110.224 -179.907 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 247' ' ' ASN . . . . . . . . . . . . . 56.6 t30 54.14 58.49 4.96 Favored 'General case' 0 N--CA 1.504 2.258 0 O-C-N 121.51 -0.744 . . . . 0.0 110.862 179.453 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 248' ' ' ILE . . . . . . . . . . . . . 82.0 mt -75.59 -33.01 25.77 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.02 0 O-C-N 121.436 -0.79 . . . . 0.0 109.664 -179.766 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 249' ' ' SER . . . . . 0.411 ' C ' HG13 ' B' ' 250' ' ' VAL . 28.2 t -109.73 141.96 41.6 Favored 'General case' 0 N--CA 1.495 1.81 0 O-C-N 121.661 -0.65 . . . . 0.0 110.099 178.302 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 250' ' ' VAL . . . . . 0.411 HG13 ' C ' ' B' ' 249' ' ' SER . 29.4 m -149.64 156.65 7.04 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.011 0 O-C-N 121.687 -0.633 . . . . 0.0 110.084 -179.027 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 251' ' ' ASP . . . . . . . . . . . . . 74.5 m-20 52.27 39.2 26.64 Favored 'General case' 0 N--CA 1.506 2.342 0 O-C-N 121.716 -0.615 . . . . 0.0 110.97 -179.733 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 252' ' ' VAL . . . . . 0.427 ' O ' HG13 ' B' ' 252' ' ' VAL . 14.3 p -80.54 127.22 39.58 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.917 0 O-C-N 121.618 -0.677 . . . . 0.0 110.213 179.361 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 253' ' ' ASP . . . . . . . . . . . . . 74.5 m-20 52.43 50.13 18.95 Favored 'General case' 0 N--CA 1.506 2.336 0 O-C-N 121.588 -0.695 . . . . 0.0 110.896 -179.996 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 254' ' ' ALA . . . . . . . . . . . . . . . -66.77 -35.99 81.37 Favored 'General case' 0 N--CA 1.499 2.003 0 O-C-N 121.563 -0.711 . . . . 0.0 110.276 -179.199 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 255' ' ' ASP . . . . . . . . . . . . . 19.3 t70 -73.42 -32.93 64.68 Favored 'General case' 0 N--CA 1.498 1.935 0 O-C-N 121.757 -0.589 . . . . 0.0 110.198 179.257 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 256' ' ' ALA . . . . . . . . . . . . . . . -63.93 -39.09 93.35 Favored 'General case' 0 N--CA 1.501 2.09 0 O-C-N 121.699 -0.626 . . . . 0.0 110.316 179.523 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 257' ' ' SER . . . . . . . . . . . . . 40.5 m -55.65 -35.98 66.55 Favored 'General case' 0 N--CA 1.504 2.248 0 O-C-N 121.656 -0.652 . . . . 0.0 110.373 177.908 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 258' ' ' SER . . . . . . . . . . . . . 25.3 m -69.29 -33.23 72.87 Favored 'General case' 0 N--CA 1.499 1.983 0 C-N-CA 120.423 -0.511 . . . . 0.0 110.272 179.855 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 259' ' ' GLN . . . . . . . . . . . . . 78.2 mt-30 -63.79 -36.99 85.7 Favored 'General case' 0 N--CA 1.501 2.084 0 O-C-N 121.628 -0.67 . . . . 0.0 110.43 -179.433 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 260' ' ' LEU . . . . . 0.458 ' HA ' HD12 ' B' ' 263' ' ' LEU . 82.7 mt -66.59 -42.66 86.63 Favored 'General case' 0 N--CA 1.5 2.072 0 O-C-N 121.639 -0.663 . . . . 0.0 110.231 179.556 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 261' ' ' LEU . . . . . 0.411 HD22 ' HA ' ' A' ' 54' ' ' ASP . 22.5 tp -70.43 -37.49 74.39 Favored 'General case' 0 N--CA 1.498 1.928 0 O-C-N 121.719 -0.613 . . . . 0.0 109.749 176.511 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 262' ' ' SER . . . . . . . . . . . . . 22.8 t -62.53 -36.92 84.14 Favored 'General case' 0 N--CA 1.5 2.051 0 O-C-N 121.771 -0.581 . . . . 0.0 110.443 176.896 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 263' ' ' LEU . . . . . 0.458 HD12 ' HA ' ' B' ' 260' ' ' LEU . 24.1 mt -64.6 -40.65 95.89 Favored 'General case' 0 N--CA 1.5 2.074 0 O-C-N 121.681 -0.637 . . . . 0.0 110.28 179.691 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 264' ' ' LEU . . . . . 0.471 ' CD1' HD11 ' A' ' 55' ' ' LEU . 86.7 mt -62.42 -38.62 90.4 Favored 'General case' 0 N--CA 1.502 2.168 0 O-C-N 121.68 -0.637 . . . . 0.0 110.418 178.474 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 265' ' ' LYS . . . . . . . . . . . . . 80.3 mttt -76.37 -39.16 54.53 Favored 'General case' 0 N--CA 1.498 1.928 0 C-N-CA 120.292 -0.563 . . . . 0.0 110.156 179.576 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 266' ' ' SER . . . . . . . . . . . . . 85.6 p -80.03 158.91 26.38 Favored 'General case' 0 N--CA 1.498 1.942 0 O-C-N 121.771 -0.581 . . . . 0.0 110.251 179.894 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 267' ' ' SER . . . . . . . . . . . . . 12.0 t -91.43 -33.86 15.07 Favored 'General case' 0 N--CA 1.496 1.862 0 O-C-N 121.687 -0.633 . . . . 0.0 110.26 178.906 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 268' ' ' THR . . . . . 0.406 ' O ' ' HB3' ' B' ' 269' ' ' ALA . 66.1 p 46.01 -167.96 0.01 OUTLIER 'General case' 0 N--CA 1.509 2.511 0 CA-C-O 121.094 0.474 . . . . 0.0 111.732 179.431 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 269' ' ' ALA . . . . . 0.475 ' HB1' ' HD2' ' B' ' 270' ' ' PRO . . . 59.03 165.32 0.08 OUTLIER Pre-proline 0 N--CA 1.506 2.326 0 O-C-N 121.559 -0.713 . . . . 0.0 110.972 -178.867 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 270' ' ' PRO . . . . . 0.475 ' HD2' ' HB1' ' B' ' 269' ' ' ALA . 29.1 Cg_endo -69.33 -55.42 0.19 Allowed 'Trans proline' 0 N--CA 1.486 1.04 0 O-C-N 123.476 1.251 . . . . 0.0 110.356 179.045 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 271' ' ' SER . . . . . . . . . . . . . 87.0 p -156.64 166.13 34.29 Favored 'General case' 0 N--CA 1.495 1.777 0 O-C-N 121.665 -0.647 . . . . 0.0 110.199 179.873 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 272' ' ' ASP . . . . . . . . . . . . . 20.2 t0 -139.78 84.76 2.0 Allowed 'General case' 0 N--CA 1.495 1.775 0 O-C-N 121.716 -0.615 . . . . 0.0 110.127 178.972 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 273' ' ' LEU . . . . . 0.6 ' CD1' HG23 ' B' ' 275' ' ' THR . 3.3 pp -162.89 -39.7 0.04 OUTLIER 'General case' 0 N--CA 1.498 1.947 0 O-C-N 121.531 -0.73 . . . . 0.0 110.896 -179.839 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 274' ' ' ALA . . . . . 0.591 ' N ' HD12 ' B' ' 273' ' ' LEU . . . 51.37 94.68 0.02 OUTLIER 'General case' 0 N--CA 1.507 2.408 0 O-C-N 121.396 -0.815 . . . . 0.0 111.192 -179.221 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 275' ' ' THR . . . . . 0.6 HG23 ' CD1' ' B' ' 273' ' ' LEU . 28.2 p -76.71 161.26 74.73 Favored Pre-proline 0 N--CA 1.497 1.91 0 O-C-N 121.654 -0.654 . . . . 0.0 110.221 179.614 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 276' ' ' PRO . . . . . . . . . . . . . 25.8 Cg_endo -66.74 164.76 28.06 Favored 'Trans proline' 0 N--CA 1.488 1.148 0 O-C-N 123.571 1.301 . . . . 0.0 110.345 179.023 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 277' ' ' GLN . . . . . . . . . . . . . 27.4 mt-30 -89.17 108.85 26.78 Favored Pre-proline 0 N--CA 1.497 1.879 0 O-C-N 121.715 -0.615 . . . . 0.0 110.097 -179.775 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 278' ' ' PRO . . . . . . . . . . . . . 23.0 Cg_endo -65.61 141.99 69.06 Favored 'Trans proline' 0 N--CA 1.49 1.297 0 O-C-N 123.377 1.198 . . . . 0.0 110.466 -179.306 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 279' ' ' SER . . . . . . . . . . . . . 23.7 m -66.17 -32.72 74.32 Favored 'General case' 0 N--CA 1.5 2.052 0 O-C-N 121.731 -0.605 . . . . 0.0 110.448 179.803 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 280' ' ' THR . . . . . . . . . . . . . 24.3 m -64.11 -39.5 94.17 Favored 'General case' 0 N--CA 1.502 2.148 0 O-C-N 121.683 -0.636 . . . . 0.0 110.427 -178.899 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 281' ' ' PHE . . . . . . . . . . . . . 31.4 t80 -132.07 74.85 76.08 Favored Pre-proline 0 N--CA 1.495 1.807 0 O-C-N 121.615 -0.678 . . . . 0.0 110.208 -179.925 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 282' ' ' PRO . . . . . . . . . . . . . 16.5 Cg_exo -64.43 150.15 88.77 Favored 'Trans proline' 0 N--CA 1.489 1.256 0 O-C-N 123.49 1.258 . . . . 0.0 110.484 178.635 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 283' ' ' GLN . . . . . . . . . . . . . 1.5 mp0 -95.33 156.01 38.16 Favored Pre-proline 0 N--CA 1.495 1.803 0 O-C-N 121.709 -0.619 . . . . 0.0 110.234 179.539 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 284' ' ' PRO . . . . . . . . . . . . . 32.2 Cg_endo -69.21 115.1 3.85 Favored 'Trans proline' 0 N--CA 1.488 1.168 0 O-C-N 123.656 1.346 . . . . 0.0 110.155 179.745 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 285' ' ' PRO . . . . . . . . . . . . . 26.2 Cg_endo -66.17 149.96 85.25 Favored 'Trans proline' 0 N--CA 1.489 1.255 0 O-C-N 123.371 1.195 . . . . 0.0 110.478 179.206 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 286' ' ' VAL . . . . . . . . . . . . . 57.8 t -66.71 -39.34 83.49 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.114 0 O-C-N 121.709 -0.62 . . . . 0.0 109.83 -179.557 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 287' ' ' GLU . . . . . . . . . . . . . 78.4 mt-10 -111.27 155.84 22.4 Favored 'General case' 0 N--CA 1.496 1.862 0 O-C-N 121.684 -0.635 . . . . 0.0 110.115 179.683 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 288' ' ' SER . . . . . . . . . . . . . 49.1 m -117.57 146.42 43.62 Favored 'General case' 0 N--CA 1.494 1.763 0 O-C-N 121.669 -0.644 . . . . 0.0 110.185 -179.777 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 289' ' ' HIS . . . . . . . . . . . . . 56.7 t-80 -160.02 33.52 0.18 Allowed 'General case' 0 N--CA 1.494 1.761 0 O-C-N 121.723 -0.61 . . . . 0.0 110.236 -179.962 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 290' ' ' SER . . . . . . . . . . . . . 51.1 m -120.28 148.38 43.78 Favored 'General case' 0 N--CA 1.495 1.794 0 O-C-N 121.714 -0.616 . . . . 0.0 110.211 -179.791 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 291' ' ' SER . . . . . . . . . . . . . 27.3 t . . . . . 0 N--CA 1.494 1.767 0 CA-C-O 117.947 -1.025 . . . . 0.0 110.231 179.921 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' -1' ' ' MET . . . . . . . . . . . . . 73.9 mtm . . . . . 0 N--CA 1.493 1.7 0 CA-C-O 121.03 0.443 . . . . 0.0 110.154 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 0' ' ' GLY . . . . . . . . . . . . . . . -83.63 -171.09 47.28 Favored Glycine 0 N--CA 1.495 2.587 0 N-CA-C 109.447 -1.461 . . . . 0.0 109.447 179.87 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.6 mpp? -88.85 128.68 35.66 Favored 'General case' 0 N--CA 1.496 1.866 0 O-C-N 121.651 -0.911 . . . . 0.0 110.166 -179.98 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 69.5 m -101.03 165.84 11.11 Favored 'General case' 0 N--CA 1.495 1.791 0 O-C-N 121.71 -0.619 . . . . 0.0 110.263 -179.13 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 57.3 t -65.2 -27.99 43.48 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.164 0 O-C-N 121.702 -0.624 . . . . 0.0 110.194 179.192 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -55.19 -31.76 61.67 Favored 'General case' 0 N--CA 1.505 2.283 0 O-C-N 121.518 -0.739 . . . . 0.0 110.349 179.902 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 74.5 m-20 -68.64 -35.9 77.9 Favored 'General case' 0 N--CA 1.499 1.994 0 O-C-N 121.818 -0.551 . . . . 0.0 109.942 175.444 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 97.7 m-85 -97.67 10.0 41.12 Favored 'General case' 0 N--CA 1.497 1.892 0 O-C-N 121.708 -0.62 . . . . 0.0 111.217 178.877 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -67.41 128.63 37.15 Favored 'General case' 0 N--CA 1.501 2.082 0 O-C-N 121.257 -0.902 . . . . 0.0 110.061 179.048 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' GLY . . . . . 0.469 ' O ' HG13 ' A' ' 24' ' ' VAL . . . 82.24 -0.73 88.56 Favored Glycine 0 N--CA 1.497 2.716 0 N-CA-C 110.693 -0.963 . . . . 0.0 110.693 -175.794 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 30.4 t -76.61 136.67 39.21 Favored 'General case' 0 N--CA 1.497 1.883 0 O-C-N 120.989 -1.301 . . . . 0.0 110.4 177.794 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 14.3 t-20 -83.36 120.09 25.44 Favored 'General case' 0 N--CA 1.497 1.896 0 O-C-N 121.608 -0.683 . . . . 0.0 109.669 174.722 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . 0.529 HG12 ' HA ' ' A' ' 57' ' ' ILE . 35.0 m -142.83 164.52 16.66 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.733 0 O-C-N 121.794 -0.567 . . . . 0.0 109.505 -178.824 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . 0.44 ' HB2' HD11 ' A' ' 58' ' ' LEU . 36.8 tt0 -109.36 128.85 55.43 Favored 'General case' 0 N--CA 1.493 1.697 0 C-N-CA 119.87 -0.732 . . . . 0.0 109.894 176.412 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 60.4 t -106.83 126.6 62.76 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.741 0 O-C-N 121.659 -0.65 . . . . 0.0 109.857 -179.285 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.405 HD13 ' HG2' ' A' ' 20' ' ' LYS . 24.1 tp -95.84 127.92 42.29 Favored 'General case' 0 N--CA 1.494 1.74 0 N-CA-C 109.263 -0.643 . . . . 0.0 109.263 175.483 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 83.6 mt -96.1 161.87 13.78 Favored 'General case' 0 N--CA 1.496 1.864 0 O-C-N 121.609 -0.682 . . . . 0.0 110.923 -173.466 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 24.2 p30 -57.81 -21.76 43.79 Favored 'General case' 0 N--CA 1.506 2.327 0 O-C-N 121.855 -0.528 . . . . 0.0 111.418 179.886 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 24.8 p30 -90.91 22.49 3.61 Favored 'General case' 0 N--CA 1.5 2.073 0 O-C-N 121.618 -0.676 . . . . 0.0 111.067 -177.717 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 74.3 m-20 60.26 29.01 18.65 Favored 'General case' 0 N--CA 1.506 2.346 0 O-C-N 121.356 -0.84 . . . . 0.0 110.807 172.561 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 23.8 m -110.79 143.8 40.76 Favored 'General case' 0 N--CA 1.495 1.798 0 O-C-N 121.472 -0.767 . . . . 0.0 109.551 170.838 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . 0.405 ' HG2' HD13 ' A' ' 14' ' ' LEU . 34.2 mtpt -109.67 144.89 37.4 Favored 'General case' 0 N--CA 1.494 1.743 0 O-C-N 121.574 -0.704 . . . . 0.0 110.467 -176.69 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -153.09 157.93 41.14 Favored 'General case' 0 N--CA 1.497 1.905 0 O-C-N 121.8 -0.562 . . . . 0.0 110.145 177.081 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 30.7 ptt180 -143.97 152.61 41.28 Favored 'General case' 0 N--CA 1.496 1.846 0 O-C-N 121.578 -0.701 . . . . 0.0 110.441 178.081 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . 0.435 ' HA2' HD13 ' A' ' 39' ' ' LEU . . . -171.81 171.26 44.01 Favored Glycine 0 N--CA 1.494 2.503 0 N-CA-C 109.128 -1.589 . . . . 0.0 109.128 -179.075 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . 0.469 HG13 ' O ' ' A' ' 8' ' ' GLY . 43.9 t -94.64 126.06 47.14 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.918 0 O-C-N 121.59 -0.947 . . . . 0.0 109.288 176.619 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 25' ' ' ILE . . . . . 0.493 ' HA ' HD23 ' A' ' 37' ' ' LEU . 50.9 mt -61.66 137.99 22.91 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.253 0 O-C-N 121.64 -0.663 . . . . 0.0 110.896 -170.805 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . 0.666 HG21 ' HB2' ' A' ' 38' ' ' ARG . 13.7 p -121.19 -19.06 7.23 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.922 -0.486 . . . . 0.0 111.465 -179.82 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 9.9 t30 -166.15 158.8 14.65 Favored 'General case' 0 N--CA 1.503 2.222 0 O-C-N 120.917 -1.115 . . . . 0.0 111.751 176.046 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 65.0 t80 -150.32 124.96 9.69 Favored 'General case' 0 N--CA 1.495 1.818 0 N-CA-C 109.244 -0.651 . . . . 0.0 109.244 173.314 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 20.2 t70 -98.18 130.86 44.92 Favored 'General case' 0 N--CA 1.492 1.64 0 N-CA-C 109.004 -0.739 . . . . 0.0 109.004 -179.741 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 23.1 t -71.56 -53.76 12.71 Favored 'General case' 0 N--CA 1.498 1.956 0 C-N-CA 120.007 -0.677 . . . . 0.0 110.633 -175.845 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 22.9 m -61.93 -37.9 86.41 Favored 'General case' 0 N--CA 1.5 2.061 0 O-C-N 121.591 -0.693 . . . . 0.0 110.699 -175.819 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 91.5 m-20 -103.77 -9.85 18.74 Favored 'General case' 0 N--CA 1.498 1.942 0 O-C-N 121.746 -0.596 . . . . 0.0 111.66 -176.909 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 27.8 p 47.11 67.05 0.86 Allowed 'General case' 0 N--CA 1.508 2.434 0 O-C-N 121.408 -0.807 . . . . 0.0 111.202 -175.13 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 34' ' ' ILE . . . . . 1.055 HD12 HG22 ' A' ' 48' ' ' VAL . 46.8 mm -121.36 125.8 74.15 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.964 0 O-C-N 121.642 -0.661 . . . . 0.0 109.236 -176.433 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 11.0 tp -116.57 120.47 38.81 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.746 -0.596 . . . . 0.0 110.468 -170.3 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 57.6 mt-30 -91.02 131.94 36.31 Favored 'General case' 0 N--CA 1.49 1.551 0 N-CA-C 109.061 -0.718 . . . . 0.0 109.061 170.659 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 0.493 HD23 ' HA ' ' A' ' 25' ' ' ILE . 50.6 mt -117.82 123.56 46.23 Favored 'General case' 0 N--CA 1.494 1.761 0 C-N-CA 120.121 -0.632 . . . . 0.0 110.007 175.723 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 38' ' ' ARG . . . . . 0.666 ' HB2' HG21 ' A' ' 26' ' ' THR . 70.3 ttt180 -105.63 105.08 14.95 Favored 'General case' 0 N--CA 1.495 1.788 0 O-C-N 121.821 -0.549 . . . . 0.0 110.144 173.928 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.435 HD13 ' HA2' ' A' ' 23' ' ' GLY . 65.2 tp -83.19 157.36 22.76 Favored 'General case' 0 N--CA 1.499 1.979 0 O-C-N 121.623 -0.673 . . . . 0.0 110.518 -176.657 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -67.57 -2.97 7.5 Favored 'General case' 0 N--CA 1.503 2.179 0 O-C-N 121.857 -0.527 . . . . 0.0 112.156 -170.822 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 30.1 m120 -86.25 29.06 0.78 Allowed 'General case' 0 N--CA 1.499 1.983 0 O-C-N 120.987 -1.07 . . . . 0.0 110.822 173.503 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 73.9 m-20 60.39 31.47 20.37 Favored 'General case' 0 N--CA 1.505 2.277 0 O-C-N 121.225 -0.922 . . . . 0.0 110.326 175.468 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 69.9 m -125.91 140.77 52.36 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.483 -0.761 . . . . 0.0 110.05 177.736 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 9.8 t -128.27 147.79 50.61 Favored 'General case' 0 N--CA 1.495 1.809 0 O-C-N 121.681 -0.637 . . . . 0.0 110.018 179.785 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 81.3 tttt -150.19 135.18 17.77 Favored 'General case' 0 N--CA 1.495 1.797 0 O-C-N 121.709 -0.619 . . . . 0.0 110.545 -178.106 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 89.5 p -94.78 121.03 35.95 Favored 'General case' 0 N--CA 1.495 1.806 0 O-C-N 121.798 -0.563 . . . . 0.0 110.142 177.85 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 81.3 mt -129.25 137.29 57.4 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.868 0 O-C-N 121.671 -0.643 . . . . 0.0 109.325 -179.956 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 48' ' ' VAL . . . . . 1.055 HG22 HD12 ' A' ' 34' ' ' ILE . 60.5 t -81.53 127.78 39.28 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.846 0 O-C-N 121.566 -0.709 . . . . 0.0 109.219 179.117 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 49' ' ' THR . . . . . 0.405 ' HA ' ' CD1' ' A' ' 52' ' ' ILE . 44.3 p -58.33 -29.7 66.14 Favored 'General case' 0 N--CA 1.503 2.2 0 O-C-N 121.459 -0.776 . . . . 0.0 111.672 -170.504 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -58.56 -27.23 64.37 Favored 'General case' 0 N--CA 1.5 2.045 0 O-C-N 121.562 -0.711 . . . . 0.0 111.315 -173.261 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 4.6 p30 -82.41 0.86 40.1 Favored 'General case' 0 N--CA 1.497 1.884 0 C-N-CA 119.502 -0.879 . . . . 0.0 111.113 176.932 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 52' ' ' ILE . . . . . 0.564 HG21 HD11 ' A' ' 55' ' ' LEU . 76.1 mt -79.45 132.18 32.6 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.096 0 O-C-N 121.167 -0.958 . . . . 0.0 109.923 175.649 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 23.5 ttmt -92.42 -24.32 18.89 Favored 'General case' 0 N--CA 1.494 1.746 0 C-N-CA 120.427 -0.509 . . . . 0.0 110.22 173.278 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . 0.503 ' HA ' HD13 ' B' ' 261' ' ' LEU . 1.6 m-20 -164.08 152.43 13.06 Favored 'General case' 0 N--CA 1.501 2.125 0 O-C-N 121.502 -0.749 . . . . 0.0 110.489 -175.949 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . 0.564 HD11 HG21 ' A' ' 52' ' ' ILE . 4.7 mp -132.92 152.35 51.91 Favored 'General case' 0 N--CA 1.495 1.818 0 O-C-N 121.725 -0.609 . . . . 0.0 110.364 178.494 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 19.8 ptp180 -151.84 146.15 25.47 Favored 'General case' 0 N--CA 1.496 1.842 0 O-C-N 121.636 -0.665 . . . . 0.0 109.926 175.081 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 57' ' ' ILE . . . . . 0.529 ' HA ' HG12 ' A' ' 11' ' ' VAL . 57.5 mt -87.09 133.23 30.54 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.871 0 O-C-N 121.483 -0.761 . . . . 0.0 110.0 174.092 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . 0.44 HD11 ' HB2' ' A' ' 12' ' ' GLU . 78.1 mt -83.94 137.41 40.65 Favored Pre-proline 0 N--CA 1.497 1.886 0 O-C-N 121.537 -0.727 . . . . 0.0 110.018 -179.785 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 46.0 Cg_endo -74.34 99.21 1.18 Allowed 'Trans proline' 0 N--CA 1.486 1.069 0 O-C-N 123.434 1.228 . . . . 0.0 110.259 179.211 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 42.6 tptt -137.38 126.32 24.2 Favored 'General case' 0 N--CA 1.495 1.81 0 O-C-N 121.723 -0.611 . . . . 0.0 110.234 -179.466 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 89.6 m-20 53.36 41.75 32.09 Favored 'General case' 0 N--CA 1.506 2.34 0 O-C-N 121.628 -0.67 . . . . 0.0 110.973 178.235 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 45.9 tt0 -66.78 -38.26 86.2 Favored 'General case' 0 N--CA 1.501 2.08 0 O-C-N 121.563 -0.711 . . . . 0.0 110.223 179.943 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 51.6 mm -71.15 -39.28 73.54 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.033 0 O-C-N 121.581 -0.699 . . . . 0.0 109.71 179.785 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 64' ' ' MET . . . . . . . . . . . . . 8.6 tpt 51.57 57.72 16.39 Favored Pre-proline 0 N--CA 1.505 2.292 0 O-C-N 121.627 -0.671 . . . . 0.0 110.989 -179.284 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 28.6 Cg_endo -67.42 141.51 56.3 Favored 'Trans proline' 0 N--CA 1.488 1.181 0 O-C-N 123.503 1.265 . . . . 0.0 110.418 -179.664 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 97.3 mttt -127.08 143.96 51.15 Favored 'General case' 0 N--CA 1.495 1.802 0 O-C-N 121.727 -0.608 . . . . 0.0 110.151 179.131 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 38.7 p-10 -122.37 31.98 5.95 Favored 'General case' 0 N--CA 1.497 1.878 0 O-C-N 121.705 -0.622 . . . . 0.0 110.518 -179.539 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . -156.38 91.96 0.12 Allowed Glycine 0 N--CA 1.494 2.553 0 N-CA-C 109.572 -1.411 . . . . 0.0 109.572 -179.854 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 24.7 m -125.92 137.86 53.74 Favored 'General case' 0 N--CA 1.495 1.789 0 O-C-N 121.648 -0.913 . . . . 0.0 110.114 179.358 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 93.4 mttt -112.97 142.14 46.0 Favored 'General case' 0 N--CA 1.497 1.876 0 O-C-N 121.669 -0.644 . . . . 0.0 110.207 179.856 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 2.3 t -128.34 80.66 72.0 Favored Pre-proline 0 N--CA 1.495 1.798 0 O-C-N 121.748 -0.595 . . . . 0.0 110.074 179.468 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 27.5 Cg_endo -66.7 -33.08 36.24 Favored 'Trans proline' 0 N--CA 1.488 1.187 0 O-C-N 123.513 1.27 . . . . 0.0 110.517 -179.602 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 49.6 m -122.52 147.24 46.6 Favored 'General case' 0 N--CA 1.496 1.853 0 O-C-N 121.695 -0.628 . . . . 0.0 110.204 -179.911 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 24.2 m -66.52 -38.75 87.86 Favored 'General case' 0 N--CA 1.499 2.019 0 O-C-N 121.649 -0.657 . . . . 0.0 110.277 179.818 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 29.8 m120 -108.7 125.04 51.46 Favored 'General case' 0 N--CA 1.496 1.835 0 O-C-N 121.622 -0.674 . . . . 0.0 110.112 179.728 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 3.0 m -138.65 33.53 2.23 Favored 'General case' 0 N--CA 1.494 1.773 0 O-C-N 121.683 -0.636 . . . . 0.0 110.258 179.853 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 24.4 m -120.24 138.66 53.53 Favored 'General case' 0 N--CA 1.495 1.813 0 O-C-N 121.657 -0.652 . . . . 0.0 110.183 -179.709 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 98.0 mttt -122.72 149.16 44.45 Favored 'General case' 0 N--CA 1.495 1.815 0 O-C-N 121.687 -0.633 . . . . 0.0 110.241 -179.933 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 83.4 mt -92.41 150.55 20.74 Favored 'General case' 0 N--CA 1.497 1.914 0 O-C-N 121.746 -0.596 . . . . 0.0 110.103 179.518 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 17.3 ttmm -62.61 -39.19 93.0 Favored 'General case' 0 N--CA 1.503 2.176 0 O-C-N 121.673 -0.642 . . . . 0.0 110.586 -178.747 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 89.3 p -130.12 142.56 50.58 Favored 'General case' 0 N--CA 1.495 1.813 0 O-C-N 121.639 -0.663 . . . . 0.0 110.33 179.756 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -162.47 149.2 13.22 Favored 'General case' 0 N--CA 1.495 1.821 0 O-C-N 121.691 -0.631 . . . . 0.0 110.061 178.821 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 42.3 tt0 -160.28 -63.97 0.07 Allowed 'General case' 0 N--CA 1.495 1.776 0 O-C-N 121.688 -0.633 . . . . 0.0 110.258 179.269 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 9.9 t -147.03 163.87 34.83 Favored 'General case' 0 N--CA 1.496 1.855 0 O-C-N 121.599 -0.688 . . . . 0.0 110.462 -178.494 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 36.8 t80 57.74 167.22 0.04 OUTLIER 'General case' 0 N--CA 1.507 2.38 0 O-C-N 121.712 -0.618 . . . . 0.0 111.045 -179.864 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 9.6 t -119.5 145.86 45.95 Favored 'General case' 0 N--CA 1.495 1.797 0 O-C-N 121.539 -0.726 . . . . 0.0 110.222 179.82 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 24.2 t -93.24 169.44 10.39 Favored 'General case' 0 N--CA 1.496 1.826 0 O-C-N 121.75 -0.594 . . . . 0.0 110.33 -178.717 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 49.5 mttp 54.53 39.71 31.31 Favored 'General case' 0 N--CA 1.505 2.297 0 O-C-N 121.682 -0.636 . . . . 0.0 110.961 178.937 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 55.1 m-20 -130.37 34.36 4.19 Favored 'General case' 0 N--CA 1.494 1.764 0 O-C-N 121.655 -0.653 . . . . 0.0 110.191 178.81 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 88.1 mttt -87.14 142.21 28.08 Favored 'General case' 0 N--CA 1.497 1.903 0 O-C-N 121.652 -0.655 . . . . 0.0 110.166 -179.368 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 91' ' ' TRP . . . . . . . . . . . . . 60.6 t-105 -64.63 -35.04 79.72 Favored 'General case' 0 N--CA 1.501 2.089 0 O-C-N 121.721 -0.612 . . . . 0.0 110.455 -179.857 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 27.7 m -63.56 -33.81 76.41 Favored 'General case' 0 N--CA 1.503 2.181 0 O-C-N 121.715 -0.615 . . . . 0.0 110.474 -179.237 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 93' ' ' MET . . . . . . . . . . . . . 88.7 mmm -103.27 148.28 26.02 Favored 'General case' 0 N--CA 1.495 1.81 0 O-C-N 121.736 -0.602 . . . . 0.0 110.156 -179.977 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 20.4 t70 . . . . . 0 N--CA 1.495 1.784 0 CA-C-O 118.027 -0.987 . . . . 0.0 110.129 -179.567 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' B' B ' 240' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.343 0 N-CA-C 109.599 -1.4 . . . . 0.0 109.599 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' B' B ' 241' ' ' ALA . . . . . . . . . . . . . . . -105.48 148.31 27.35 Favored 'General case' 0 N--CA 1.494 1.757 0 O-C-N 121.63 -0.923 . . . . 0.0 110.265 -179.937 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 242' ' ' THR . . . . . . . . . . . . . 24.8 m -114.35 132.43 56.2 Favored 'General case' 0 N--CA 1.495 1.807 0 O-C-N 121.642 -0.661 . . . . 0.0 110.081 179.834 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 243' ' ' THR . . . . . . . . . . . . . 23.5 m -68.79 -42.15 77.75 Favored 'General case' 0 N--CA 1.498 1.933 0 O-C-N 121.604 -0.685 . . . . 0.0 110.246 -179.757 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 244' ' ' LYS . . . . . . . . . . . . . 72.5 mttt -133.04 145.12 50.53 Favored 'General case' 0 N--CA 1.496 1.86 0 O-C-N 121.639 -0.663 . . . . 0.0 110.223 -179.395 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 245' ' ' GLU . . . . . . . . . . . . . 51.0 mt-10 -112.87 133.89 54.64 Favored 'General case' 0 N--CA 1.496 1.836 0 O-C-N 121.667 -0.645 . . . . 0.0 110.119 178.992 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 246' ' ' LYS . . . . . . . . . . . . . 58.8 mttm -89.08 -32.92 17.31 Favored 'General case' 0 N--CA 1.497 1.919 0 O-C-N 121.672 -0.643 . . . . 0.0 110.287 179.86 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 247' ' ' ASN . . . . . . . . . . . . . 90.6 m-20 -66.48 -34.54 78.15 Favored 'General case' 0 N--CA 1.5 2.066 0 O-C-N 121.588 -0.695 . . . . 0.0 110.307 179.822 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 248' ' ' ILE . . . . . 0.42 HG22 ' N ' ' B' ' 249' ' ' SER . 47.5 mm 57.87 164.33 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.509 2.518 0 O-C-N 121.777 -0.577 . . . . 0.0 110.773 -178.729 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 249' ' ' SER . . . . . 0.682 ' OG ' ' HB1' ' B' ' 254' ' ' ALA . 54.6 p -121.8 148.98 43.98 Favored 'General case' 0 N--CA 1.495 1.801 0 O-C-N 121.499 -0.751 . . . . 0.0 110.236 -179.963 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 250' ' ' VAL . . . . . 0.606 HG23 ' OD1' ' B' ' 251' ' ' ASP . 26.1 m -151.58 -169.5 0.12 Allowed 'Isoleucine or valine' 0 N--CA 1.5 2.061 0 O-C-N 121.687 -0.633 . . . . 0.0 110.118 -178.631 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 251' ' ' ASP . . . . . 0.606 ' OD1' HG23 ' B' ' 250' ' ' VAL . 9.9 m-20 54.08 43.99 29.91 Favored 'General case' 0 N--CA 1.505 2.278 0 O-C-N 121.609 -0.682 . . . . 0.0 111.178 178.063 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 252' ' ' VAL . . . . . 0.448 HG12 ' N ' ' B' ' 253' ' ' ASP . 43.0 t 58.64 165.84 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.51 2.54 0 O-C-N 121.66 -0.65 . . . . 0.0 110.747 177.593 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 253' ' ' ASP . . . . . 0.448 ' N ' HG12 ' B' ' 252' ' ' VAL . 74.5 m-20 53.26 48.59 21.73 Favored 'General case' 0 N--CA 1.506 2.347 0 O-C-N 121.534 -0.729 . . . . 0.0 110.812 178.9 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 254' ' ' ALA . . . . . 0.682 ' HB1' ' OG ' ' B' ' 249' ' ' SER . . . -67.66 -47.4 69.62 Favored 'General case' 0 N--CA 1.498 1.958 0 O-C-N 121.698 -0.626 . . . . 0.0 110.36 -178.635 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 255' ' ' ASP . . . . . . . . . . . . . 74.4 m-20 -74.04 -35.39 64.32 Favored 'General case' 0 N--CA 1.499 1.993 0 O-C-N 121.7 -0.625 . . . . 0.0 110.293 -178.564 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 256' ' ' ALA . . . . . . . . . . . . . . . -63.88 -45.06 91.09 Favored 'General case' 0 N--CA 1.5 2.046 0 O-C-N 121.665 -0.647 . . . . 0.0 110.355 -179.35 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 257' ' ' SER . . . . . . . . . . . . . 33.7 m -55.68 -35.31 65.89 Favored 'General case' 0 N--CA 1.502 2.17 0 O-C-N 121.586 -0.696 . . . . 0.0 110.487 177.745 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 258' ' ' SER . . . . . . . . . . . . . 22.6 t -69.67 -32.82 71.69 Favored 'General case' 0 N--CA 1.498 1.932 0 O-C-N 121.862 -0.524 . . . . 0.0 110.419 -179.401 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 259' ' ' GLN . . . . . . . . . . . . . 99.5 mt-30 -63.22 -37.96 89.29 Favored 'General case' 0 N--CA 1.501 2.082 0 O-C-N 121.57 -0.706 . . . . 0.0 110.634 -178.442 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 260' ' ' LEU . . . . . . . . . . . . . 84.1 mt -69.43 -41.72 75.94 Favored 'General case' 0 N--CA 1.499 1.981 0 O-C-N 121.535 -0.728 . . . . 0.0 110.296 179.915 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 261' ' ' LEU . . . . . 0.503 HD13 ' HA ' ' A' ' 54' ' ' ASP . 32.8 tp -70.26 -40.21 74.53 Favored 'General case' 0 N--CA 1.496 1.872 0 O-C-N 121.572 -0.705 . . . . 0.0 109.915 177.83 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 262' ' ' SER . . . . . . . . . . . . . 86.8 p -63.18 -35.9 81.85 Favored 'General case' 0 N--CA 1.5 2.06 0 O-C-N 121.675 -0.64 . . . . 0.0 110.484 177.374 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 263' ' ' LEU . . . . . . . . . . . . . 25.2 mt -65.7 -41.39 92.42 Favored 'General case' 0 N--CA 1.499 2.005 0 O-C-N 121.631 -0.668 . . . . 0.0 110.456 179.214 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 264' ' ' LEU . . . . . 0.425 HD12 ' HA ' ' B' ' 261' ' ' LEU . 49.5 mt -62.44 -35.87 80.62 Favored 'General case' 0 N--CA 1.502 2.127 0 O-C-N 121.71 -0.618 . . . . 0.0 110.515 178.841 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 265' ' ' LYS . . . . . . . . . . . . . 84.7 tttt -75.88 -45.06 37.47 Favored 'General case' 0 N--CA 1.498 1.947 0 O-C-N 121.642 -0.662 . . . . 0.0 109.988 179.753 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 266' ' ' SER . . . . . . . . . . . . . 85.1 p -82.4 59.16 4.44 Favored 'General case' 0 N--CA 1.497 1.914 0 O-C-N 121.672 -0.642 . . . . 0.0 110.338 178.536 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 267' ' ' SER . . . . . . . . . . . . . 36.2 m -96.73 -65.05 0.99 Allowed 'General case' 0 N--CA 1.495 1.812 0 O-C-N 121.446 -0.784 . . . . 0.0 110.328 -178.555 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 268' ' ' THR . . . . . . . . . . . . . 38.1 p -88.97 -33.15 17.32 Favored 'General case' 0 N--CA 1.497 1.883 0 O-C-N 121.751 -0.593 . . . . 0.0 110.419 -179.269 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 269' ' ' ALA . . . . . . . . . . . . . . . 48.7 62.96 11.2 Favored Pre-proline 0 N--CA 1.507 2.381 0 O-C-N 121.696 -0.627 . . . . 0.0 111.166 -178.348 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 270' ' ' PRO . . . . . . . . . . . . . 29.6 Cg_endo -67.73 148.76 78.13 Favored 'Trans proline' 0 N--CA 1.487 1.143 0 O-C-N 123.555 1.292 . . . . 0.0 110.423 -179.141 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 271' ' ' SER . . . . . . . . . . . . . 73.5 m -94.37 18.74 10.6 Favored 'General case' 0 N--CA 1.497 1.881 0 O-C-N 121.73 -0.606 . . . . 0.0 111.066 179.073 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 272' ' ' ASP . . . . . . . . . . . . . 74.6 m-20 -101.06 31.31 3.68 Favored 'General case' 0 N--CA 1.495 1.819 0 O-C-N 121.306 -0.871 . . . . 0.0 110.317 -179.893 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 273' ' ' LEU . . . . . . . . . . . . . 22.5 tp 59.65 -79.86 0.02 OUTLIER 'General case' 0 N--CA 1.506 2.339 0 O-C-N 121.918 -0.489 . . . . 0.0 111.076 -177.966 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 274' ' ' ALA . . . . . . . . . . . . . . . -166.66 159.74 14.34 Favored 'General case' 0 N--CA 1.498 1.974 0 O-C-N 121.17 -0.956 . . . . 0.0 110.14 -178.509 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 275' ' ' THR . . . . . . . . . . . . . 20.9 m -121.9 81.96 42.61 Favored Pre-proline 0 N--CA 1.496 1.834 0 O-C-N 121.738 -0.601 . . . . 0.0 110.06 178.841 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 276' ' ' PRO . . . . . . . . . . . . . 27.6 Cg_endo -67.05 146.22 76.26 Favored 'Trans proline' 0 N--CA 1.488 1.153 0 O-C-N 123.481 1.253 . . . . 0.0 110.482 -178.509 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 277' ' ' GLN . . . . . . . . . . . . . 13.7 tt0 52.56 57.82 15.04 Favored Pre-proline 0 N--CA 1.505 2.314 0 O-C-N 121.699 -0.626 . . . . 0.0 111.041 179.151 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 278' ' ' PRO . . . . . . . . . . . . . 36.0 Cg_endo -70.4 107.45 1.98 Allowed 'Trans proline' 0 N--CA 1.487 1.093 0 O-C-N 123.475 1.25 . . . . 0.0 110.169 178.175 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 279' ' ' SER . . . . . . . . . . . . . 50.5 m -126.31 141.43 51.91 Favored 'General case' 0 N--CA 1.495 1.781 0 O-C-N 121.631 -0.668 . . . . 0.0 110.318 -179.727 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 280' ' ' THR . . . . . . . . . . . . . 25.0 m -133.67 136.26 44.62 Favored 'General case' 0 N--CA 1.495 1.798 0 O-C-N 121.743 -0.598 . . . . 0.0 110.157 178.651 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 281' ' ' PHE . . . . . . . . . . . . . 51.1 m-85 -145.18 154.15 53.7 Favored Pre-proline 0 N--CA 1.495 1.779 0 O-C-N 121.617 -0.677 . . . . 0.0 110.254 179.856 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 282' ' ' PRO . . . . . . . . . . . . . 32.6 Cg_endo -68.96 151.5 73.57 Favored 'Trans proline' 0 N--CA 1.488 1.199 0 O-C-N 123.662 1.348 . . . . 0.0 110.325 179.244 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 283' ' ' GLN . . . . . . . . . . . . . 51.7 mt-30 -95.95 126.93 42.86 Favored Pre-proline 0 N--CA 1.495 1.795 0 O-C-N 121.594 -0.691 . . . . 0.0 110.047 179.195 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 284' ' ' PRO . . . . . . . . . . . . . 31.8 Cg_endo -68.65 153.16 73.93 Favored 'Trans proline' 0 N--CA 1.488 1.175 0 O-C-N 123.369 1.194 . . . . 0.0 110.292 -179.003 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 285' ' ' PRO . . . . . . . . . . . . . 30.5 Cg_endo -68.34 147.98 72.93 Favored 'Trans proline' 0 N--CA 1.487 1.13 0 O-C-N 123.672 1.354 . . . . 0.0 110.366 179.804 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 286' ' ' VAL . . . . . . . . . . . . . 12.5 p -131.1 138.24 53.86 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.864 0 O-C-N 121.725 -0.609 . . . . 0.0 110.076 179.3 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 287' ' ' GLU . . . . . . . . . . . . . 41.7 tt0 -90.51 -53.11 4.58 Favored 'General case' 0 N--CA 1.495 1.823 0 O-C-N 121.718 -0.614 . . . . 0.0 110.172 -179.873 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 288' ' ' SER . . . . . . . . . . . . . 50.5 m -126.53 151.41 47.92 Favored 'General case' 0 N--CA 1.495 1.792 0 O-C-N 121.674 -0.641 . . . . 0.0 110.294 -179.506 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 289' ' ' HIS . . . . . . . . . . . . . 99.2 m-70 -64.92 -33.49 76.16 Favored 'General case' 0 N--CA 1.5 2.041 0 O-C-N 121.589 -0.695 . . . . 0.0 110.337 179.59 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 290' ' ' SER . . . . . . . . . . . . . 93.2 p -120.72 155.15 34.52 Favored 'General case' 0 N--CA 1.495 1.816 0 O-C-N 121.715 -0.616 . . . . 0.0 110.232 179.871 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 291' ' ' SER . . . . . . . . . . . . . 46.5 m . . . . . 0 N--CA 1.496 1.833 0 CA-C-O 117.994 -1.003 . . . . 0.0 110.169 -179.934 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' -1' ' ' MET . . . . . . . . . . . . . 67.7 mmm . . . . . 0 N--CA 1.491 1.611 0 CA-C-O 121.048 0.451 . . . . 0.0 110.18 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 0' ' ' GLY . . . . . . . . . . . . . . . -174.26 102.62 0.17 Allowed Glycine 0 N--CA 1.493 2.496 0 N-CA-C 109.548 -1.421 . . . . 0.0 109.548 179.829 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 44.7 ttm -101.07 122.23 43.21 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.63 -0.923 . . . . 0.0 109.986 179.607 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 74.3 m -100.99 178.76 4.58 Favored 'General case' 0 N--CA 1.494 1.768 0 O-C-N 121.635 -0.666 . . . . 0.0 110.533 -176.945 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 56.7 t -64.67 -27.97 43.76 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.24 0 O-C-N 121.699 -0.626 . . . . 0.0 110.279 179.716 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -55.06 -30.96 60.72 Favored 'General case' 0 N--CA 1.504 2.235 0 O-C-N 121.452 -0.78 . . . . 0.0 110.393 -179.669 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 74.5 m-20 -68.73 -35.26 76.89 Favored 'General case' 0 N--CA 1.498 1.95 0 C-N-CA 120.413 -0.515 . . . . 0.0 109.968 174.658 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 6' ' ' PHE . . . . . 0.509 ' CE1' HD21 ' B' ' 260' ' ' LEU . 95.0 m-85 -98.05 9.86 41.81 Favored 'General case' 0 N--CA 1.498 1.931 0 O-C-N 121.782 -0.574 . . . . 0.0 111.263 179.072 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -67.48 128.48 36.6 Favored 'General case' 0 N--CA 1.5 2.071 0 O-C-N 121.198 -0.939 . . . . 0.0 110.046 179.533 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 8' ' ' GLY . . . . . 0.471 ' O ' HG13 ' A' ' 24' ' ' VAL . . . 81.98 -0.59 88.35 Favored Glycine 0 N--CA 1.495 2.623 0 N-CA-C 110.757 -0.937 . . . . 0.0 110.757 -175.594 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 49.1 m -76.3 137.34 39.82 Favored 'General case' 0 N--CA 1.497 1.904 0 O-C-N 120.958 -1.319 . . . . 0.0 110.469 178.042 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 14.0 t-20 -84.51 119.12 24.8 Favored 'General case' 0 N--CA 1.497 1.886 0 O-C-N 121.683 -0.636 . . . . 0.0 109.774 174.567 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . 0.503 HG12 ' HA ' ' A' ' 57' ' ' ILE . 35.8 m -142.12 162.46 19.53 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.808 0 O-C-N 121.847 -0.533 . . . . 0.0 109.636 -179.872 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . 0.454 ' HB2' HD11 ' A' ' 58' ' ' LEU . 48.4 tt0 -109.42 128.45 55.14 Favored 'General case' 0 N--CA 1.494 1.765 0 C-N-CA 119.914 -0.714 . . . . 0.0 110.01 178.05 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . 0.582 HG22 ' CD2' ' A' ' 55' ' ' LEU . 60.8 t -106.74 127.71 62.04 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.765 0 O-C-N 121.642 -0.661 . . . . 0.0 109.893 -178.882 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.422 HD13 ' HG2' ' A' ' 20' ' ' LYS . 27.0 tp -95.83 125.87 40.7 Favored 'General case' 0 N--CA 1.493 1.7 0 N-CA-C 109.14 -0.689 . . . . 0.0 109.14 174.327 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 86.6 mt -95.08 167.33 11.45 Favored 'General case' 0 N--CA 1.496 1.828 0 O-C-N 121.6 -0.687 . . . . 0.0 111.102 -172.561 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 24.2 p30 -58.54 -21.9 53.91 Favored 'General case' 0 N--CA 1.507 2.4 0 O-C-N 121.933 -0.479 . . . . 0.0 111.575 -176.786 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 39.2 p-10 -93.06 23.76 4.12 Favored 'General case' 0 N--CA 1.498 1.936 0 O-C-N 121.6 -0.688 . . . . 0.0 110.878 -176.354 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 10.4 m-20 59.09 27.66 16.7 Favored 'General case' 0 N--CA 1.506 2.367 0 O-C-N 121.483 -0.76 . . . . 0.0 110.611 175.579 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 50.9 m -106.52 142.57 35.96 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.492 -0.755 . . . . 0.0 109.61 172.975 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . 0.422 ' HG2' HD13 ' A' ' 14' ' ' LEU . 95.0 mttt -109.66 143.68 39.07 Favored 'General case' 0 N--CA 1.494 1.748 0 O-C-N 121.594 -0.691 . . . . 0.0 110.731 -176.668 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -153.1 156.06 37.96 Favored 'General case' 0 N--CA 1.497 1.907 0 O-C-N 121.752 -0.593 . . . . 0.0 110.018 175.96 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . 0.436 ' NH1' HD11 ' A' ' 39' ' ' LEU . 40.5 ptt85 -142.64 153.51 43.51 Favored 'General case' 0 N--CA 1.496 1.862 0 O-C-N 121.515 -0.74 . . . . 0.0 110.482 178.545 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . 0.438 ' HA2' HD13 ' A' ' 39' ' ' LEU . . . -171.81 171.17 43.96 Favored Glycine 0 N--CA 1.494 2.517 0 N-CA-C 109.051 -1.62 . . . . 0.0 109.051 -178.965 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . 0.471 HG13 ' O ' ' A' ' 8' ' ' GLY . 44.6 t -94.65 127.12 46.88 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.898 0 O-C-N 121.604 -0.939 . . . . 0.0 109.305 176.943 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 25' ' ' ILE . . . . . 0.485 ' HA ' HD23 ' A' ' 37' ' ' LEU . 49.2 mt -61.5 138.31 22.32 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.227 0 O-C-N 121.632 -0.668 . . . . 0.0 110.864 -171.01 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . 0.673 HG21 ' HB2' ' A' ' 38' ' ' ARG . 12.5 p -121.16 -20.53 6.73 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.875 -0.515 . . . . 0.0 111.485 -179.699 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 30.9 t30 -165.77 158.58 15.32 Favored 'General case' 0 N--CA 1.504 2.262 0 O-C-N 120.902 -1.124 . . . . 0.0 111.798 176.764 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 66.8 t80 -150.27 123.08 8.68 Favored 'General case' 0 N--CA 1.494 1.761 0 N-CA-C 109.177 -0.675 . . . . 0.0 109.177 173.217 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 17.9 t70 -98.05 130.16 44.87 Favored 'General case' 0 N--CA 1.493 1.689 0 N-CA-C 109.106 -0.702 . . . . 0.0 109.106 -177.849 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 23.2 t -69.63 -51.82 31.5 Favored 'General case' 0 N--CA 1.498 1.963 0 C-N-CA 119.981 -0.688 . . . . 0.0 110.648 -175.985 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 22.1 t -59.94 -41.58 92.13 Favored 'General case' 0 N--CA 1.501 2.099 0 O-C-N 121.624 -0.672 . . . . 0.0 110.938 -174.652 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 91.6 m-20 -104.17 -9.88 18.35 Favored 'General case' 0 N--CA 1.497 1.894 0 O-C-N 121.668 -0.645 . . . . 0.0 111.663 -177.453 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 3.7 m 50.13 67.35 0.93 Allowed 'General case' 0 N--CA 1.508 2.431 0 O-C-N 120.971 -1.08 . . . . 0.0 110.85 -174.43 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 34' ' ' ILE . . . . . 1.103 HD12 HG22 ' A' ' 48' ' ' VAL . 44.6 mm -120.67 125.8 74.5 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.024 0 O-C-N 121.598 -0.688 . . . . 0.0 109.332 -175.827 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 10.8 tp -115.9 119.47 36.05 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.691 -0.631 . . . . 0.0 110.548 -169.699 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 56.9 mt-30 -91.0 132.51 35.94 Favored 'General case' 0 N--CA 1.489 1.504 0 N-CA-C 109.304 -0.628 . . . . 0.0 109.304 171.441 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 0.485 HD23 ' HA ' ' A' ' 25' ' ' ILE . 51.4 mt -117.79 123.54 46.21 Favored 'General case' 0 N--CA 1.495 1.789 0 C-N-CA 120.129 -0.628 . . . . 0.0 110.001 175.81 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 38' ' ' ARG . . . . . 0.673 ' HB2' HG21 ' A' ' 26' ' ' THR . 57.1 ttt85 -105.86 106.18 16.57 Favored 'General case' 0 N--CA 1.496 1.85 0 O-C-N 121.753 -0.592 . . . . 0.0 110.191 173.885 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.438 HD13 ' HA2' ' A' ' 23' ' ' GLY . 65.4 tp -83.78 156.76 22.36 Favored 'General case' 0 N--CA 1.499 1.978 0 O-C-N 121.678 -0.639 . . . . 0.0 110.587 -177.138 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -68.19 -3.02 9.23 Favored 'General case' 0 N--CA 1.504 2.226 0 O-C-N 121.903 -0.498 . . . . 0.0 112.178 -170.804 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 91.7 m-20 -86.96 29.1 0.84 Allowed 'General case' 0 N--CA 1.498 1.963 0 O-C-N 121.04 -1.038 . . . . 0.0 110.682 173.84 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 73.1 m-20 60.74 31.67 20.14 Favored 'General case' 0 N--CA 1.505 2.316 0 O-C-N 121.242 -0.911 . . . . 0.0 110.271 175.82 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 73.5 m -125.78 138.33 53.84 Favored 'General case' 0 N--CA 1.494 1.739 0 O-C-N 121.457 -0.777 . . . . 0.0 110.006 177.212 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 9.3 t -128.18 148.88 50.63 Favored 'General case' 0 N--CA 1.497 1.881 0 O-C-N 121.659 -0.651 . . . . 0.0 110.042 179.955 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . 0.445 ' HD3' HD11 ' A' ' 47' ' ' ILE . 79.2 tttt -150.37 136.09 18.28 Favored 'General case' 0 N--CA 1.495 1.822 0 O-C-N 121.718 -0.614 . . . . 0.0 110.584 -178.32 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 89.8 p -94.39 121.49 35.98 Favored 'General case' 0 N--CA 1.494 1.769 0 O-C-N 121.718 -0.614 . . . . 0.0 110.073 176.935 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 47' ' ' ILE . . . . . 0.445 HD11 ' HD3' ' A' ' 45' ' ' LYS . 79.7 mt -129.2 135.09 62.71 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.837 0 O-C-N 121.602 -0.686 . . . . 0.0 109.44 -179.424 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 48' ' ' VAL . . . . . 1.103 HG22 HD12 ' A' ' 34' ' ' ILE . 62.1 t -82.31 127.63 39.46 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.929 0 N-CA-C 109.265 -0.643 . . . . 0.0 109.265 179.032 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 57.7 p -58.36 -25.0 61.51 Favored 'General case' 0 N--CA 1.507 2.382 0 O-C-N 121.533 -0.729 . . . . 0.0 111.814 -169.148 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 49.0 tptt -56.87 -26.1 57.98 Favored 'General case' 0 N--CA 1.5 2.061 0 O-C-N 121.414 -0.804 . . . . 0.0 111.069 -177.049 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 5.3 p30 -84.64 5.88 26.27 Favored 'General case' 0 N--CA 1.499 2.009 0 C-N-CA 119.676 -0.809 . . . . 0.0 111.33 176.501 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 98.7 mt -75.32 126.46 36.11 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.107 0 O-C-N 121.184 -0.948 . . . . 0.0 109.988 175.726 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 77.0 tttt -92.91 -29.35 15.96 Favored 'General case' 0 N--CA 1.494 1.768 0 O-C-N 121.803 -0.561 . . . . 0.0 109.887 170.708 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . 0.408 ' HA ' HD22 ' B' ' 261' ' ' LEU . 5.4 m-20 -163.63 154.6 16.24 Favored 'General case' 0 N--CA 1.5 2.075 0 O-C-N 121.76 -0.587 . . . . 0.0 110.168 -177.926 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . 0.582 ' CD2' HG22 ' A' ' 13' ' ' VAL . 83.9 mt -132.98 150.5 52.16 Favored 'General case' 0 N--CA 1.497 1.899 0 O-C-N 121.71 -0.619 . . . . 0.0 110.424 -179.163 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 4.5 ptm180 -152.66 141.91 21.48 Favored 'General case' 0 N--CA 1.495 1.791 0 O-C-N 121.757 -0.589 . . . . 0.0 109.869 174.83 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 57' ' ' ILE . . . . . 0.503 ' HA ' HG12 ' A' ' 11' ' ' VAL . 69.4 mt -85.19 133.34 29.61 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.883 0 O-C-N 121.453 -0.779 . . . . 0.0 109.864 174.472 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . 0.454 HD11 ' HB2' ' A' ' 12' ' ' GLU . 63.9 mt -82.27 163.03 54.55 Favored Pre-proline 0 N--CA 1.497 1.923 0 O-C-N 121.591 -0.693 . . . . 0.0 110.113 -179.031 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 21.4 Cg_exo -61.35 -62.38 0.13 Allowed 'Trans proline' 0 N--CA 1.49 1.285 0 O-C-N 123.635 1.334 . . . . 0.0 110.882 -176.992 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 82.7 tttt 58.66 -78.26 0.02 OUTLIER 'General case' 0 N--CA 1.507 2.401 0 O-C-N 122.012 -0.43 . . . . 0.0 111.098 -177.048 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 15.4 t-20 53.73 47.48 23.65 Favored 'General case' 0 N--CA 1.505 2.276 0 O-C-N 121.083 -1.011 . . . . 0.0 110.965 179.98 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 41.9 tt0 -92.02 128.53 37.9 Favored 'General case' 0 N--CA 1.496 1.837 0 O-C-N 121.555 -0.715 . . . . 0.0 110.023 179.751 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 84.0 mt -69.53 -34.14 60.35 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.033 0 O-C-N 121.744 -0.598 . . . . 0.0 109.9 -179.477 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 64' ' ' MET . . . . . . . . . . . . . 41.3 mtp 57.87 160.75 0.09 OUTLIER Pre-proline 0 N--CA 1.508 2.447 0 O-C-N 121.866 -0.521 . . . . 0.0 111.161 -178.322 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 38.3 Cg_endo -71.91 66.86 3.22 Favored 'Trans proline' 0 N--CA 1.487 1.122 0 O-C-N 123.34 1.179 . . . . 0.0 110.398 179.482 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 59.2 tttt -149.33 125.67 10.85 Favored 'General case' 0 N--CA 1.496 1.826 0 O-C-N 121.499 -0.75 . . . . 0.0 110.046 179.441 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 91.7 m-20 -134.23 -63.71 0.71 Allowed 'General case' 0 N--CA 1.495 1.805 0 O-C-N 121.725 -0.61 . . . . 0.0 110.09 178.991 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . -156.93 -49.49 0.01 OUTLIER Glycine 0 N--CA 1.493 2.477 0 N-CA-C 109.343 -1.503 . . . . 0.0 109.343 179.244 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 9.3 t -136.62 158.54 44.19 Favored 'General case' 0 N--CA 1.496 1.868 0 O-C-N 121.707 -0.878 . . . . 0.0 110.297 179.194 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 82.8 tttt -90.51 134.35 34.43 Favored 'General case' 0 N--CA 1.496 1.844 0 O-C-N 121.719 -0.613 . . . . 0.0 110.138 179.39 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 18.7 p -83.48 154.66 65.95 Favored Pre-proline 0 N--CA 1.498 1.937 0 O-C-N 121.773 -0.579 . . . . 0.0 110.214 -179.225 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 29.0 Cg_endo -67.46 149.87 80.33 Favored 'Trans proline' 0 N--CA 1.488 1.151 0 O-C-N 123.67 1.352 . . . . 0.0 110.426 -179.695 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 87.4 p -91.69 161.7 14.79 Favored 'General case' 0 N--CA 1.496 1.831 0 O-C-N 121.615 -0.678 . . . . 0.0 110.103 179.162 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 44.1 p -127.24 -42.59 1.68 Allowed 'General case' 0 N--CA 1.497 1.924 0 O-C-N 121.648 -0.658 . . . . 0.0 110.502 -178.792 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 91.7 m-20 -94.29 143.46 26.37 Favored 'General case' 0 N--CA 1.495 1.804 0 O-C-N 121.605 -0.684 . . . . 0.0 110.22 -179.645 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 73.3 p -112.06 150.72 30.27 Favored 'General case' 0 N--CA 1.496 1.842 0 O-C-N 121.693 -0.63 . . . . 0.0 110.277 -179.494 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 42.6 p -76.98 -33.61 57.6 Favored 'General case' 0 N--CA 1.498 1.948 0 O-C-N 121.712 -0.618 . . . . 0.0 110.248 -179.697 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 16.4 pttp -157.16 44.71 0.37 Allowed 'General case' 0 N--CA 1.496 1.869 0 O-C-N 121.583 -0.698 . . . . 0.0 110.444 -179.568 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . 0.444 HD13 ' HA ' ' A' ' 79' ' ' LEU . 4.6 mm? 52.09 -172.43 0.03 OUTLIER 'General case' 0 N--CA 1.506 2.356 0 O-C-N 121.538 -0.726 . . . . 0.0 111.003 -179.596 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 73.1 tttt -131.51 136.25 47.73 Favored 'General case' 0 N--CA 1.496 1.829 0 O-C-N 121.628 -0.67 . . . . 0.0 110.206 -179.943 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 94.6 p -119.09 154.38 33.29 Favored 'General case' 0 N--CA 1.495 1.81 0 O-C-N 121.64 -0.662 . . . . 0.0 110.075 179.54 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -124.42 -45.01 1.97 Allowed 'General case' 0 N--CA 1.494 1.771 0 O-C-N 121.594 -0.691 . . . . 0.0 110.298 -179.381 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 54.8 mt-10 -104.35 157.24 17.28 Favored 'General case' 0 N--CA 1.495 1.776 0 O-C-N 121.64 -0.663 . . . . 0.0 110.233 -179.1 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 24.1 m -86.12 135.17 33.71 Favored 'General case' 0 N--CA 1.497 1.893 0 O-C-N 121.763 -0.586 . . . . 0.0 109.98 179.56 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 41.1 p90 -149.21 160.03 43.74 Favored 'General case' 0 N--CA 1.495 1.805 0 O-C-N 121.666 -0.646 . . . . 0.0 110.377 -178.071 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 15.4 m -84.7 -35.89 22.23 Favored 'General case' 0 N--CA 1.497 1.877 0 O-C-N 121.708 -0.62 . . . . 0.0 109.958 177.006 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 90.3 p -150.45 162.19 41.07 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.772 -0.58 . . . . 0.0 110.152 178.88 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 40.5 mtmt -99.88 125.03 45.79 Favored 'General case' 0 N--CA 1.495 1.789 0 O-C-N 121.67 -0.644 . . . . 0.0 110.369 -179.891 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 92.2 m-20 -133.75 27.88 3.94 Favored 'General case' 0 N--CA 1.496 1.858 0 O-C-N 121.686 -0.633 . . . . 0.0 110.449 177.391 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 72.2 mttt -139.08 149.3 44.41 Favored 'General case' 0 N--CA 1.496 1.835 0 O-C-N 121.624 -0.673 . . . . 0.0 110.107 -179.56 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 91' ' ' TRP . . . . . . . . . . . . . 62.3 p-90 -147.7 32.86 0.86 Allowed 'General case' 0 N--CA 1.497 1.88 0 O-C-N 121.633 -0.667 . . . . 0.0 110.323 179.733 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 88.4 p -129.42 153.01 48.34 Favored 'General case' 0 N--CA 1.495 1.811 0 O-C-N 121.606 -0.684 . . . . 0.0 110.255 -179.799 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 93' ' ' MET . . . . . . . . . . . . . 89.4 mtp -67.38 -35.07 78.59 Favored 'General case' 0 N--CA 1.499 2.011 0 O-C-N 121.68 -0.637 . . . . 0.0 110.29 179.583 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 74.4 m-20 . . . . . 0 N--CA 1.495 1.802 0 CA-C-O 118.021 -0.99 . . . . 0.0 110.256 -179.831 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' B' B ' 240' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.272 0 N-CA-C 109.536 -1.426 . . . . 0.0 109.536 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' B' B ' 241' ' ' ALA . . . . . . . . . . . . . . . -68.07 -37.67 81.54 Favored 'General case' 0 N--CA 1.499 2.002 0 O-C-N 121.702 -0.881 . . . . 0.0 110.272 -179.651 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 242' ' ' THR . . . . . 0.494 HG22 ' O ' ' B' ' 244' ' ' LYS . 22.6 m -125.61 130.31 51.39 Favored 'General case' 0 N--CA 1.496 1.832 0 O-C-N 121.713 -0.617 . . . . 0.0 110.237 179.812 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 243' ' ' THR . . . . . . . . . . . . . 22.6 m -70.86 -40.69 72.16 Favored 'General case' 0 N--CA 1.499 1.981 0 O-C-N 121.67 -0.643 . . . . 0.0 110.27 -179.236 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 244' ' ' LYS . . . . . 0.494 ' O ' HG22 ' B' ' 242' ' ' THR . 78.7 mttt -118.07 157.33 27.04 Favored 'General case' 0 N--CA 1.496 1.856 0 O-C-N 121.671 -0.643 . . . . 0.0 110.265 -178.275 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 245' ' ' GLU . . . . . . . . . . . . . 78.8 mt-10 -94.11 67.09 3.59 Favored 'General case' 0 N--CA 1.496 1.85 0 O-C-N 121.748 -0.595 . . . . 0.0 110.237 -179.019 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 246' ' ' LYS . . . . . . . . . . . . . 50.7 tptt 53.31 94.9 0.02 OUTLIER 'General case' 0 N--CA 1.505 2.304 0 O-C-N 121.454 -0.779 . . . . 0.0 111.025 179.436 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 247' ' ' ASN . . . . . . . . . . . . . 30.1 m120 -78.38 -177.37 5.19 Favored 'General case' 0 N--CA 1.499 1.978 0 O-C-N 121.657 -0.652 . . . . 0.0 110.206 -179.204 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 248' ' ' ILE . . . . . . . . . . . . . 84.3 mt 58.82 -81.77 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.508 2.431 0 O-C-N 122.017 -0.427 . . . . 0.0 110.84 -179.476 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 249' ' ' SER . . . . . . . . . . . . . 33.0 t -112.29 144.08 42.3 Favored 'General case' 0 N--CA 1.495 1.805 0 O-C-N 121.152 -0.968 . . . . 0.0 110.342 -177.411 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 250' ' ' VAL . . . . . . . . . . . . . 58.4 t -85.61 -32.39 7.08 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.983 0 O-C-N 121.71 -0.619 . . . . 0.0 109.735 178.73 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 251' ' ' ASP . . . . . 0.528 ' OD1' HG23 ' B' ' 252' ' ' VAL . 12.7 t70 -161.18 164.72 30.31 Favored 'General case' 0 N--CA 1.494 1.754 0 O-C-N 121.661 -0.649 . . . . 0.0 110.03 179.366 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 252' ' ' VAL . . . . . 0.528 HG23 ' OD1' ' B' ' 251' ' ' ASP . 40.1 t 58.0 164.18 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.509 2.486 0 O-C-N 121.719 -0.613 . . . . 0.0 110.563 -177.955 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 253' ' ' ASP . . . . . 0.422 ' N ' HG12 ' B' ' 252' ' ' VAL . 1.3 m-20 -157.63 166.88 31.67 Favored 'General case' 0 N--CA 1.496 1.842 0 O-C-N 121.526 -0.734 . . . . 0.0 110.037 -178.048 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 254' ' ' ALA . . . . . . . . . . . . . . . -66.66 -29.48 69.51 Favored 'General case' 0 N--CA 1.502 2.145 0 O-C-N 121.78 -0.575 . . . . 0.0 110.492 179.733 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 255' ' ' ASP . . . . . . . . . . . . . 74.4 m-20 -72.13 -29.04 63.66 Favored 'General case' 0 N--CA 1.499 1.977 0 O-C-N 121.634 -0.666 . . . . 0.0 110.396 179.937 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 256' ' ' ALA . . . . . . . . . . . . . . . -62.77 -30.65 71.61 Favored 'General case' 0 N--CA 1.501 2.091 0 O-C-N 121.557 -0.714 . . . . 0.0 110.303 177.777 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 257' ' ' SER . . . . . . . . . . . . . 69.2 m -54.36 -34.93 62.15 Favored 'General case' 0 N--CA 1.503 2.186 0 O-C-N 121.682 -0.636 . . . . 0.0 110.48 176.728 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 258' ' ' SER . . . . . . . . . . . . . 27.6 m -68.27 -31.43 70.88 Favored 'General case' 0 N--CA 1.499 2.009 0 C-N-CA 120.438 -0.505 . . . . 0.0 110.296 179.186 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 259' ' ' GLN . . . . . . . . . . . . . 58.4 tp60 -63.59 -37.31 86.85 Favored 'General case' 0 N--CA 1.501 2.075 0 O-C-N 121.638 -0.664 . . . . 0.0 110.64 -179.472 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 260' ' ' LEU . . . . . 0.509 HD21 ' CE1' ' A' ' 6' ' ' PHE . 83.2 mt -70.89 -43.86 67.48 Favored 'General case' 0 N--CA 1.499 1.983 0 O-C-N 121.524 -0.735 . . . . 0.0 110.214 179.946 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 261' ' ' LEU . . . . . 0.408 HD22 ' HA ' ' A' ' 54' ' ' ASP . 24.2 tp -69.1 -39.04 79.24 Favored 'General case' 0 N--CA 1.498 1.963 0 O-C-N 121.737 -0.602 . . . . 0.0 109.844 178.023 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 262' ' ' SER . . . . . . . . . . . . . 84.9 p -62.99 -34.78 78.28 Favored 'General case' 0 N--CA 1.499 2.019 0 O-C-N 121.687 -0.633 . . . . 0.0 110.611 177.539 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 263' ' ' LEU . . . . . . . . . . . . . 23.5 mt -65.45 -41.84 92.99 Favored 'General case' 0 N--CA 1.501 2.105 0 O-C-N 121.58 -0.7 . . . . 0.0 110.357 179.409 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 264' ' ' LEU . . . . . 0.482 ' CD1' HD11 ' A' ' 55' ' ' LEU . 84.1 mt -62.28 -37.8 86.89 Favored 'General case' 0 N--CA 1.501 2.123 0 O-C-N 121.624 -0.673 . . . . 0.0 110.421 178.224 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 265' ' ' LYS . . . . . . . . . . . . . 75.8 mttt -76.47 -33.17 58.7 Favored 'General case' 0 N--CA 1.497 1.897 0 O-C-N 121.747 -0.596 . . . . 0.0 110.235 179.392 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 266' ' ' SER . . . . . . . . . . . . . 84.7 p -78.93 164.77 24.15 Favored 'General case' 0 N--CA 1.498 1.966 0 O-C-N 121.744 -0.597 . . . . 0.0 110.213 -179.716 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 267' ' ' SER . . . . . . . . . . . . . 85.8 p -75.86 165.68 24.64 Favored 'General case' 0 N--CA 1.499 1.979 0 O-C-N 121.731 -0.606 . . . . 0.0 110.185 -179.742 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 268' ' ' THR . . . . . . . . . . . . . 40.1 p -118.68 168.66 10.51 Favored 'General case' 0 N--CA 1.496 1.856 0 O-C-N 121.71 -0.619 . . . . 0.0 110.115 -179.629 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 269' ' ' ALA . . . . . . . . . . . . . . . 49.46 88.05 0.12 Allowed Pre-proline 0 N--CA 1.506 2.338 0 O-C-N 121.679 -0.638 . . . . 0.0 111.19 -178.568 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 270' ' ' PRO . . . . . . . . . . . . . 20.6 Cg_exo -62.18 147.24 95.39 Favored 'Trans proline' 0 N--CA 1.491 1.333 0 O-C-N 123.553 1.291 . . . . 0.0 110.66 -179.98 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 271' ' ' SER . . . . . . . . . . . . . 88.7 p -66.49 -29.76 69.94 Favored 'General case' 0 N--CA 1.5 2.042 0 O-C-N 121.651 -0.656 . . . . 0.0 110.595 179.773 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 272' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -63.05 -32.71 74.15 Favored 'General case' 0 N--CA 1.501 2.125 0 O-C-N 121.589 -0.694 . . . . 0.0 110.549 -179.819 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 273' ' ' LEU . . . . . . . . . . . . . 81.2 mt 52.63 -168.66 0.05 OUTLIER 'General case' 0 N--CA 1.507 2.375 0 O-C-N 121.693 -0.629 . . . . 0.0 110.987 179.976 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 274' ' ' ALA . . . . . . . . . . . . . . . -165.54 165.11 19.19 Favored 'General case' 0 N--CA 1.497 1.887 0 O-C-N 121.637 -0.665 . . . . 0.0 110.008 -179.722 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 275' ' ' THR . . . . . . . . . . . . . 23.7 p -117.31 87.37 24.1 Favored Pre-proline 0 N--CA 1.494 1.761 0 O-C-N 121.674 -0.641 . . . . 0.0 110.186 -179.117 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 276' ' ' PRO . . . . . . . . . . . . . 25.1 Cg_endo -66.0 -29.34 49.02 Favored 'Trans proline' 0 N--CA 1.489 1.247 0 O-C-N 123.537 1.283 . . . . 0.0 110.728 179.35 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 277' ' ' GLN . . . . . . . . . . . . . 9.2 pt20 -65.05 157.66 75.35 Favored Pre-proline 0 N--CA 1.501 2.102 0 O-C-N 121.495 -0.753 . . . . 0.0 110.584 -179.263 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 278' ' ' PRO . . . . . . . . . . . . . 26.7 Cg_endo -66.5 161.21 42.21 Favored 'Trans proline' 0 N--CA 1.488 1.19 0 O-C-N 123.698 1.367 . . . . 0.0 110.49 -179.602 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 279' ' ' SER . . . . . . . . . . . . . 29.9 t -97.24 151.41 19.88 Favored 'General case' 0 N--CA 1.496 1.845 0 O-C-N 121.772 -0.58 . . . . 0.0 110.206 -179.826 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 280' ' ' THR . . . . . . . . . . . . . 42.6 p -81.71 160.8 23.58 Favored 'General case' 0 N--CA 1.498 1.946 0 O-C-N 121.742 -0.599 . . . . 0.0 110.164 -179.147 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 281' ' ' PHE . . . . . . . . . . . . . 9.9 t80 -141.64 144.59 33.79 Favored Pre-proline 0 N--CA 1.495 1.785 0 O-C-N 121.673 -0.642 . . . . 0.0 109.977 -179.415 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 282' ' ' PRO . . . . . . . . . . . . . 19.2 Cg_endo -64.02 -50.61 2.83 Favored 'Trans proline' 0 N--CA 1.49 1.319 0 O-C-N 123.453 1.239 . . . . 0.0 110.601 -178.864 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 283' ' ' GLN . . . . . . . . . . . . . 31.2 mt-30 -79.08 162.57 63.91 Favored Pre-proline 0 N--CA 1.497 1.897 0 O-C-N 121.68 -0.638 . . . . 0.0 110.077 178.572 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 284' ' ' PRO . . . . . . . . . . . . . 17.6 Cg_exo -62.95 151.96 81.73 Favored 'Trans proline' 0 N--CA 1.489 1.248 0 O-C-N 123.605 1.318 . . . . 0.0 110.595 -178.932 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 285' ' ' PRO . . . . . . . . . . . . . 31.3 Cg_endo -68.55 161.13 46.39 Favored 'Trans proline' 0 N--CA 1.488 1.177 0 O-C-N 123.604 1.318 . . . . 0.0 110.346 -179.963 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 286' ' ' VAL . . . . . . . . . . . . . 60.5 t -100.11 135.76 34.45 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.909 0 O-C-N 121.698 -0.626 . . . . 0.0 109.668 179.273 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 287' ' ' GLU . . . . . . . . . . . . . 13.2 pt-20 -63.16 136.06 57.53 Favored 'General case' 0 N--CA 1.502 2.134 0 O-C-N 121.698 -0.627 . . . . 0.0 110.743 -178.691 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 288' ' ' SER . . . . . . . . . . . . . 51.1 m -129.76 151.05 50.76 Favored 'General case' 0 N--CA 1.495 1.777 0 O-C-N 121.742 -0.599 . . . . 0.0 110.179 179.617 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 289' ' ' HIS . . . . . . . . . . . . . 99.1 m-70 -112.13 135.17 53.13 Favored 'General case' 0 N--CA 1.495 1.803 0 O-C-N 121.602 -0.686 . . . . 0.0 110.184 179.853 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 290' ' ' SER . . . . . . . . . . . . . 27.4 m -65.71 -34.48 78.3 Favored 'General case' 0 N--CA 1.5 2.051 0 O-C-N 121.612 -0.68 . . . . 0.0 110.384 179.932 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 291' ' ' SER . . . . . . . . . . . . . 18.7 t . . . . . 0 N--CA 1.495 1.792 0 CA-C-O 117.979 -1.01 . . . . 0.0 110.268 179.967 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' -1' ' ' MET . . . . . . . . . . . . . 49.0 ttm . . . . . 0 N--CA 1.492 1.644 0 CA-C-O 120.975 0.417 . . . . 0.0 110.211 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 0' ' ' GLY . . . . . . . . . . . . . . . -83.88 -177.71 51.6 Favored Glycine 0 N--CA 1.494 2.518 0 N-CA-C 109.509 -1.437 . . . . 0.0 109.509 179.709 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 89.9 mtp -111.97 141.04 46.12 Favored 'General case' 0 N--CA 1.496 1.85 0 O-C-N 121.703 -0.88 . . . . 0.0 110.227 -179.968 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 69.8 m -101.09 167.22 10.37 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.626 -0.671 . . . . 0.0 110.021 179.536 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 3' ' ' VAL . . . . . 0.43 HG12 ' CE1' ' A' ' 7' ' ' TYR . 79.8 t -66.67 -27.81 41.23 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.036 0 O-C-N 121.58 -0.7 . . . . 0.0 110.263 -179.684 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -55.15 -30.83 60.61 Favored 'General case' 0 N--CA 1.505 2.315 0 O-C-N 121.461 -0.774 . . . . 0.0 110.389 -178.925 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 74.6 m-20 -68.76 -30.52 69.14 Favored 'General case' 0 N--CA 1.499 2.025 0 O-C-N 121.813 -0.555 . . . . 0.0 110.223 174.821 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 96.2 m-85 -95.4 10.07 37.69 Favored 'General case' 0 N--CA 1.498 1.953 0 O-C-N 121.645 -0.659 . . . . 0.0 111.512 -178.367 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 7' ' ' TYR . . . . . 0.43 ' CE1' HG12 ' A' ' 3' ' ' VAL . 3.7 m-30 -67.18 137.82 56.53 Favored 'General case' 0 N--CA 1.502 2.16 0 O-C-N 121.131 -0.98 . . . . 0.0 110.106 173.979 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 8' ' ' GLY . . . . . 0.433 ' O ' HG13 ' A' ' 24' ' ' VAL . . . 83.07 -1.08 89.3 Favored Glycine 0 N--CA 1.496 2.694 0 N-CA-C 110.718 -0.953 . . . . 0.0 110.718 -177.352 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 68.9 m -77.2 136.82 38.58 Favored 'General case' 0 N--CA 1.499 1.979 0 O-C-N 121.031 -1.276 . . . . 0.0 110.417 177.747 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 16.1 t-20 -84.16 117.11 23.27 Favored 'General case' 0 N--CA 1.498 1.944 0 O-C-N 121.633 -0.667 . . . . 0.0 109.628 173.4 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . 0.522 HG12 ' HA ' ' A' ' 57' ' ' ILE . 35.7 m -142.71 162.7 17.99 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.705 0 N-CA-C 109.387 -0.597 . . . . 0.0 109.387 -178.206 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . 0.464 ' HB2' HD11 ' A' ' 58' ' ' LEU . 45.3 tt0 -109.34 130.3 55.5 Favored 'General case' 0 N--CA 1.492 1.661 0 C-N-CA 119.838 -0.745 . . . . 0.0 109.863 176.918 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 60.0 t -106.69 126.67 62.54 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.679 0 O-C-N 121.623 -0.673 . . . . 0.0 109.841 -179.597 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 27.1 tp -95.93 130.22 42.96 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.697 -0.627 . . . . 0.0 109.358 176.512 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 86.3 mt -97.38 160.12 14.51 Favored 'General case' 0 N--CA 1.496 1.875 0 O-C-N 121.59 -0.694 . . . . 0.0 111.067 -174.25 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 24.4 p30 -58.24 -21.87 49.95 Favored 'General case' 0 N--CA 1.506 2.345 0 O-C-N 121.756 -0.59 . . . . 0.0 111.503 -178.477 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 38.3 p-10 -93.14 23.93 4.07 Favored 'General case' 0 N--CA 1.498 1.927 0 O-C-N 121.5 -0.75 . . . . 0.0 110.778 -177.154 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 74.3 m-20 59.42 28.08 17.35 Favored 'General case' 0 N--CA 1.505 2.322 0 O-C-N 121.493 -0.754 . . . . 0.0 110.644 175.8 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 51.0 m -104.04 141.43 36.22 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.57 -0.706 . . . . 0.0 109.516 171.964 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 52.8 mttp -109.69 143.43 39.47 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.593 -0.692 . . . . 0.0 110.553 -176.013 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -153.1 154.6 35.16 Favored 'General case' 0 N--CA 1.497 1.889 0 O-C-N 121.722 -0.612 . . . . 0.0 110.3 176.477 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 31.0 ptt180 -144.07 154.98 43.78 Favored 'General case' 0 N--CA 1.498 1.947 0 O-C-N 121.705 -0.622 . . . . 0.0 110.463 177.573 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . 0.469 ' HA2' HD13 ' A' ' 39' ' ' LEU . . . -171.93 171.18 44.0 Favored Glycine 0 N--CA 1.494 2.522 0 N-CA-C 109.237 -1.545 . . . . 0.0 109.237 -178.967 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . 0.433 HG13 ' O ' ' A' ' 8' ' ' GLY . 41.0 t -94.5 119.51 42.58 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.926 0 O-C-N 121.596 -0.944 . . . . 0.0 109.02 174.252 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 25' ' ' ILE . . . . . 0.409 HD11 HG21 ' A' ' 11' ' ' VAL . 76.0 mt -63.52 143.75 15.31 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.23 0 CA-C-O 121.304 0.573 . . . . 0.0 110.66 -167.749 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . 0.711 HG21 ' HG3' ' A' ' 38' ' ' ARG . 2.3 p -121.15 -25.87 5.21 Favored 'General case' 0 N--CA 1.494 1.768 0 O-C-N 121.831 -0.543 . . . . 0.0 111.379 179.934 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 27' ' ' ASN . . . . . 0.555 ' O ' HD12 ' A' ' 35' ' ' LEU . 7.3 t30 -163.94 160.0 21.5 Favored 'General case' 0 N--CA 1.501 2.091 0 O-C-N 120.952 -1.092 . . . . 0.0 111.774 -179.844 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 28' ' ' PHE . . . . . 0.569 ' HE1' HG21 ' A' ' 49' ' ' THR . 91.5 t80 -150.1 128.78 12.37 Favored 'General case' 0 N--CA 1.5 2.028 0 N-CA-C 109.223 -0.658 . . . . 0.0 109.223 170.279 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 20.2 t0 -98.86 130.84 45.29 Favored 'General case' 0 N--CA 1.49 1.559 0 N-CA-C 108.941 -0.763 . . . . 0.0 108.941 179.994 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 88.6 p -70.84 -51.48 26.31 Favored 'General case' 0 N--CA 1.497 1.922 0 C-N-CA 119.98 -0.688 . . . . 0.0 110.686 -175.175 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 6.3 t -61.25 -40.47 94.18 Favored 'General case' 0 N--CA 1.501 2.124 0 O-C-N 121.517 -0.74 . . . . 0.0 110.718 -175.737 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 28.8 m120 -103.27 -9.07 19.83 Favored 'General case' 0 N--CA 1.498 1.941 0 O-C-N 121.738 -0.601 . . . . 0.0 111.615 -176.877 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 28.6 p 46.79 67.13 0.83 Allowed 'General case' 0 N--CA 1.509 2.477 0 O-C-N 121.385 -0.822 . . . . 0.0 111.266 -175.009 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 34' ' ' ILE . . . . . 1.07 HD12 HG22 ' A' ' 48' ' ' VAL . 46.0 mm -122.53 125.83 73.2 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.059 0 N-CA-C 109.138 -0.69 . . . . 0.0 109.138 -176.881 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.555 HD12 ' O ' ' A' ' 27' ' ' ASN . 12.5 tp -115.98 122.25 44.69 Favored 'General case' 0 N--CA 1.495 1.776 0 O-C-N 121.677 -0.639 . . . . 0.0 110.7 -169.888 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 77.9 mt-30 -90.93 142.1 28.13 Favored 'General case' 0 N--CA 1.489 1.524 0 N-CA-C 109.358 -0.608 . . . . 0.0 109.358 171.097 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 6.4 mt -133.53 123.57 25.41 Favored 'General case' 0 N--CA 1.495 1.803 0 O-C-N 121.76 -0.588 . . . . 0.0 109.783 178.846 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 38' ' ' ARG . . . . . 0.711 ' HG3' HG21 ' A' ' 26' ' ' THR . 23.2 mtm180 -102.25 104.83 15.41 Favored 'General case' 0 N--CA 1.496 1.863 0 O-C-N 121.738 -0.601 . . . . 0.0 110.38 173.392 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.469 HD13 ' HA2' ' A' ' 23' ' ' GLY . 62.8 tp -84.19 157.33 21.68 Favored 'General case' 0 N--CA 1.497 1.901 0 O-C-N 121.509 -0.744 . . . . 0.0 110.49 -177.946 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -66.43 -2.91 5.09 Favored 'General case' 0 N--CA 1.504 2.227 0 O-C-N 121.911 -0.493 . . . . 0.0 112.126 -171.154 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 91.4 m-20 -84.87 28.98 0.65 Allowed 'General case' 0 N--CA 1.499 1.993 0 O-C-N 121.112 -0.993 . . . . 0.0 110.856 172.267 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 74.4 m-20 59.43 31.17 20.87 Favored 'General case' 0 N--CA 1.504 2.272 0 O-C-N 121.108 -0.995 . . . . 0.0 110.433 174.148 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 50.8 m -126.26 137.76 53.55 Favored 'General case' 0 N--CA 1.496 1.847 0 O-C-N 121.498 -0.751 . . . . 0.0 110.517 178.99 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 10.0 t -102.36 151.11 22.65 Favored 'General case' 0 N--CA 1.497 1.882 0 O-C-N 121.864 -0.523 . . . . 0.0 110.105 174.629 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 69.5 mttt -149.04 123.79 9.87 Favored 'General case' 0 N--CA 1.496 1.87 0 O-C-N 121.574 -0.704 . . . . 0.0 110.741 178.939 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 92.6 p -97.45 118.52 34.11 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.792 -0.568 . . . . 0.0 110.122 177.551 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 82.6 mt -129.34 140.1 50.03 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.842 0 O-C-N 121.675 -0.641 . . . . 0.0 109.369 179.665 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 48' ' ' VAL . . . . . 1.07 HG22 HD12 ' A' ' 34' ' ' ILE . 58.1 t -81.85 127.65 39.42 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.863 0 C-N-CA 119.981 -0.688 . . . . 0.0 109.164 178.694 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 49' ' ' THR . . . . . 0.569 HG21 ' HE1' ' A' ' 28' ' ' PHE . 38.7 p -60.42 -27.18 67.27 Favored 'General case' 0 N--CA 1.502 2.128 0 O-C-N 121.62 -0.675 . . . . 0.0 111.926 -171.005 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 50.3 mmtt -58.58 -25.03 62.13 Favored 'General case' 0 N--CA 1.501 2.122 0 O-C-N 121.531 -0.731 . . . . 0.0 111.363 -173.776 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 6.4 p30 -82.44 -1.16 49.3 Favored 'General case' 0 N--CA 1.498 1.967 0 C-N-CA 119.635 -0.826 . . . . 0.0 111.084 176.41 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 52' ' ' ILE . . . . . 0.624 HG21 HD11 ' A' ' 55' ' ' LEU . 75.3 mt -79.66 133.92 28.74 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.102 0 O-C-N 121.185 -0.947 . . . . 0.0 110.131 177.317 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 47.2 tptt -92.38 -27.51 17.48 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.854 -0.529 . . . . 0.0 109.928 171.412 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . 0.489 ' HA ' HD13 ' B' ' 261' ' ' LEU . 1.5 m-20 -164.34 155.5 15.53 Favored 'General case' 0 N--CA 1.502 2.17 0 O-C-N 121.684 -0.635 . . . . 0.0 110.47 -176.211 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . 0.624 HD11 HG21 ' A' ' 52' ' ' ILE . 4.7 mp -132.91 155.36 49.2 Favored 'General case' 0 N--CA 1.497 1.88 0 O-C-N 121.877 -0.514 . . . . 0.0 110.175 178.191 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 19.6 ptp180 -151.6 148.93 28.57 Favored 'General case' 0 N--CA 1.497 1.891 0 O-C-N 121.693 -0.629 . . . . 0.0 109.976 175.801 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 57' ' ' ILE . . . . . 0.522 ' HA ' HG12 ' A' ' 11' ' ' VAL . 67.5 mt -86.01 133.33 29.91 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.871 0 C-N-CA 119.944 -0.702 . . . . 0.0 109.868 172.808 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . 0.464 HD11 ' HB2' ' A' ' 12' ' ' GLU . 72.7 mt -82.53 148.25 58.08 Favored Pre-proline 0 N--CA 1.498 1.928 0 O-C-N 121.613 -0.68 . . . . 0.0 110.045 -178.299 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 32.1 Cg_endo -68.62 -33.4 21.98 Favored 'Trans proline' 0 N--CA 1.488 1.2 0 O-C-N 123.552 1.29 . . . . 0.0 110.45 -178.952 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 50.7 mttp -103.03 139.09 39.04 Favored 'General case' 0 N--CA 1.495 1.787 0 O-C-N 121.631 -0.668 . . . . 0.0 110.229 -179.161 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 23.1 t30 -93.62 -61.93 1.46 Allowed 'General case' 0 N--CA 1.495 1.788 0 O-C-N 121.63 -0.669 . . . . 0.0 110.22 179.411 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 41.6 tt0 -121.8 136.42 54.93 Favored 'General case' 0 N--CA 1.495 1.822 0 O-C-N 121.6 -0.688 . . . . 0.0 110.238 -179.209 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 38.7 pt -127.34 159.13 38.11 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.974 0 O-C-N 121.681 -0.637 . . . . 0.0 110.187 178.806 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 64' ' ' MET . . . . . 0.467 ' CB ' ' HD3' ' A' ' 65' ' ' PRO . 1.9 mtt -163.38 -56.11 0.01 OUTLIER Pre-proline 0 N--CA 1.498 1.946 0 O-C-N 121.651 -0.656 . . . . 0.0 110.981 -179.914 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 65' ' ' PRO . . . . . 0.467 ' HD3' ' CB ' ' A' ' 64' ' ' MET . 22.7 Cg_exo -61.16 127.87 23.44 Favored 'Trans proline' 0 N--CA 1.493 1.483 0 O-C-N 122.946 0.972 . . . . 0.0 110.733 -179.08 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 76.1 tttt -143.97 122.03 12.13 Favored 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.697 -0.627 . . . . 0.0 110.042 178.795 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 92.0 m-20 -101.32 -38.86 7.87 Favored 'General case' 0 N--CA 1.495 1.808 0 O-C-N 121.669 -0.644 . . . . 0.0 110.581 -177.391 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . -66.36 -43.45 92.66 Favored Glycine 0 N--CA 1.497 2.717 0 N-CA-C 109.904 -1.278 . . . . 0.0 109.904 -177.363 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 5.2 m 55.37 33.84 21.66 Favored 'General case' 0 N--CA 1.506 2.363 0 O-C-N 121.575 -0.956 . . . . 0.0 110.771 -178.554 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 52.7 mttp -108.57 161.11 15.38 Favored 'General case' 0 N--CA 1.497 1.884 0 O-C-N 121.599 -0.688 . . . . 0.0 110.125 177.563 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 15.5 m -68.7 159.63 81.0 Favored Pre-proline 0 N--CA 1.499 2.004 0 O-C-N 121.755 -0.591 . . . . 0.0 110.15 179.444 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 22.3 Cg_exo -61.05 -42.24 37.92 Favored 'Trans proline' 0 N--CA 1.49 1.295 0 O-C-N 123.509 1.268 . . . . 0.0 110.76 -179.094 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 49.6 m -131.38 143.52 50.54 Favored 'General case' 0 N--CA 1.495 1.801 0 O-C-N 121.661 -0.649 . . . . 0.0 110.261 179.713 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 42.0 p -80.45 -32.12 37.28 Favored 'General case' 0 N--CA 1.499 1.996 0 O-C-N 121.686 -0.634 . . . . 0.0 110.251 178.665 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 17.1 t-20 -98.55 155.2 17.4 Favored 'General case' 0 N--CA 1.494 1.769 0 O-C-N 121.596 -0.69 . . . . 0.0 110.138 179.852 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 50.0 m -110.21 151.01 27.84 Favored 'General case' 0 N--CA 1.495 1.821 0 O-C-N 121.717 -0.614 . . . . 0.0 110.214 -179.715 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 9.5 t -130.27 166.09 21.08 Favored 'General case' 0 N--CA 1.497 1.893 0 O-C-N 121.657 -0.652 . . . . 0.0 110.439 -179.37 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 90.5 mttt -86.56 137.34 32.59 Favored 'General case' 0 N--CA 1.497 1.876 0 O-C-N 121.741 -0.6 . . . . 0.0 110.161 -179.438 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 83.4 mt -68.81 -34.78 76.09 Favored 'General case' 0 N--CA 1.499 1.992 0 O-C-N 121.639 -0.663 . . . . 0.0 110.23 179.826 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 98.9 mttt -65.24 -43.9 89.93 Favored 'General case' 0 N--CA 1.5 2.063 0 O-C-N 121.638 -0.663 . . . . 0.0 110.481 -178.568 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 49.4 m -135.22 148.0 49.49 Favored 'General case' 0 N--CA 1.495 1.816 0 O-C-N 121.646 -0.659 . . . . 0.0 110.253 -179.562 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -142.65 -63.07 0.42 Allowed 'General case' 0 N--CA 1.494 1.757 0 O-C-N 121.739 -0.6 . . . . 0.0 110.207 179.478 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 13.7 pt-20 -66.22 -31.03 71.61 Favored 'General case' 0 N--CA 1.5 2.056 0 O-C-N 121.696 -0.628 . . . . 0.0 110.669 -179.954 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 23.9 m -106.71 140.5 39.47 Favored 'General case' 0 N--CA 1.495 1.802 0 O-C-N 121.628 -0.67 . . . . 0.0 110.258 -179.27 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 53.8 p90 -141.73 166.41 24.82 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.671 -0.643 . . . . 0.0 110.305 179.864 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 48.2 m -118.78 147.48 43.84 Favored 'General case' 0 N--CA 1.495 1.814 0 O-C-N 121.606 -0.684 . . . . 0.0 110.178 -179.931 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 12.6 t -90.41 -41.21 11.6 Favored 'General case' 0 N--CA 1.497 1.879 0 O-C-N 121.664 -0.648 . . . . 0.0 110.204 -179.694 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 68.7 mttt -134.92 124.68 25.34 Favored 'General case' 0 N--CA 1.495 1.792 0 O-C-N 121.716 -0.615 . . . . 0.0 110.197 179.77 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 29.9 m120 -91.16 -37.29 13.45 Favored 'General case' 0 N--CA 1.496 1.844 0 O-C-N 121.689 -0.632 . . . . 0.0 110.191 179.638 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 84.0 tttt -65.69 -39.88 91.72 Favored 'General case' 0 N--CA 1.5 2.028 0 O-C-N 121.671 -0.643 . . . . 0.0 110.398 -179.514 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 91' ' ' TRP . . . . . . . . . . . . . 75.0 t-105 -89.97 -56.9 3.05 Favored 'General case' 0 N--CA 1.497 1.88 0 O-C-N 121.665 -0.647 . . . . 0.0 110.191 -179.71 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 36.5 t 52.66 -175.37 0.03 OUTLIER 'General case' 0 N--CA 1.506 2.326 0 O-C-N 121.588 -0.695 . . . . 0.0 110.999 -179.601 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 93' ' ' MET . . . . . . . . . . . . . 89.7 mtp -119.18 152.17 37.07 Favored 'General case' 0 N--CA 1.495 1.824 0 O-C-N 121.642 -0.661 . . . . 0.0 110.162 179.904 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 18.6 t70 . . . . . 0 N--CA 1.506 2.331 0 CA-C-O 118.027 -0.987 . . . . 0.0 110.964 -179.808 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' B' B ' 240' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.357 0 N-CA-C 109.573 -1.411 . . . . 0.0 109.573 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' B' B ' 241' ' ' ALA . . . . . . . . . . . . . . . -100.26 31.63 3.31 Favored 'General case' 0 N--CA 1.495 1.802 0 O-C-N 121.628 -0.925 . . . . 0.0 110.317 179.712 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 242' ' ' THR . . . . . . . . . . . . . 40.3 p -126.25 164.61 20.62 Favored 'General case' 0 N--CA 1.497 1.882 0 O-C-N 121.63 -0.669 . . . . 0.0 110.065 179.639 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 243' ' ' THR . . . . . . . . . . . . . 36.6 p -103.21 151.53 22.53 Favored 'General case' 0 N--CA 1.495 1.804 0 O-C-N 121.682 -0.636 . . . . 0.0 110.161 179.561 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 244' ' ' LYS . . . . . . . . . . . . . 21.7 ttmt -97.6 -34.69 10.86 Favored 'General case' 0 N--CA 1.495 1.809 0 O-C-N 121.72 -0.613 . . . . 0.0 110.306 -179.168 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 245' ' ' GLU . . . . . . . . . . . . . 45.6 tt0 -65.95 -37.51 86.2 Favored 'General case' 0 N--CA 1.499 1.995 0 O-C-N 121.706 -0.621 . . . . 0.0 110.339 -178.66 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 246' ' ' LYS . . . . . . . . . . . . . 47.7 mtmt -131.1 139.5 49.86 Favored 'General case' 0 N--CA 1.496 1.85 0 O-C-N 121.705 -0.622 . . . . 0.0 110.291 -179.72 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 247' ' ' ASN . . . . . . . . . . . . . 29.8 m120 -130.58 32.38 4.41 Favored 'General case' 0 N--CA 1.496 1.845 0 O-C-N 121.573 -0.705 . . . . 0.0 110.24 178.974 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 248' ' ' ILE . . . . . . . . . . . . . 51.2 mm -77.94 -34.44 19.46 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.03 0 O-C-N 121.549 -0.719 . . . . 0.0 109.884 -178.904 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 249' ' ' SER . . . . . . . . . . . . . 24.4 m -64.69 -41.51 95.99 Favored 'General case' 0 N--CA 1.5 2.063 0 O-C-N 121.617 -0.677 . . . . 0.0 110.479 -178.685 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 250' ' ' VAL . . . . . 0.866 HG12 HG12 ' B' ' 252' ' ' VAL . 46.0 t -87.44 -51.82 12.31 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.975 0 O-C-N 121.633 -0.667 . . . . 0.0 109.545 179.449 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 251' ' ' ASP . . . . . . . . . . . . . 26.0 t0 52.18 71.28 0.48 Allowed 'General case' 0 N--CA 1.506 2.354 0 O-C-N 121.734 -0.604 . . . . 0.0 111.305 177.946 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 252' ' ' VAL . . . . . 0.866 HG12 HG12 ' B' ' 250' ' ' VAL . 13.5 p -161.6 124.22 0.36 Allowed 'Isoleucine or valine' 0 N--CA 1.497 1.899 0 O-C-N 121.51 -0.744 . . . . 0.0 110.152 176.174 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 253' ' ' ASP . . . . . . . . . . . . . 74.4 m-20 -82.87 121.04 26.43 Favored 'General case' 0 N--CA 1.496 1.862 0 O-C-N 121.635 -0.666 . . . . 0.0 110.261 178.479 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 254' ' ' ALA . . . . . . . . . . . . . . . -67.5 -36.14 80.51 Favored 'General case' 0 N--CA 1.499 2.01 0 O-C-N 121.594 -0.692 . . . . 0.0 110.305 179.36 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 255' ' ' ASP . . . . . . . . . . . . . 4.0 p30 -73.02 -28.12 62.17 Favored 'General case' 0 N--CA 1.5 2.035 0 O-C-N 121.709 -0.619 . . . . 0.0 110.652 -179.777 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 256' ' ' ALA . . . . . . . . . . . . . . . -63.02 -33.55 75.67 Favored 'General case' 0 N--CA 1.501 2.089 0 O-C-N 121.535 -0.728 . . . . 0.0 110.414 -179.561 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 257' ' ' SER . . . . . . . . . . . . . 22.0 m -55.49 -36.33 66.54 Favored 'General case' 0 N--CA 1.503 2.185 0 O-C-N 121.565 -0.709 . . . . 0.0 110.361 177.67 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 258' ' ' SER . . . . . . . . . . . . . 23.8 m -69.33 -34.28 74.41 Favored 'General case' 0 N--CA 1.498 1.95 0 C-N-CA 120.402 -0.519 . . . . 0.0 110.176 179.303 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 259' ' ' GLN . . . . . . . . . . . . . 78.2 mt-30 -64.66 -34.47 78.36 Favored 'General case' 0 N--CA 1.5 2.058 0 O-C-N 121.606 -0.684 . . . . 0.0 110.407 -179.931 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 260' ' ' LEU . . . . . 0.492 ' HA ' HD12 ' B' ' 263' ' ' LEU . 77.9 mt -66.57 -41.57 88.39 Favored 'General case' 0 N--CA 1.5 2.028 0 O-C-N 121.716 -0.615 . . . . 0.0 110.223 179.371 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 261' ' ' LEU . . . . . 0.571 HD13 HD12 ' A' ' 55' ' ' LEU . 33.5 tp -70.03 -35.67 74.49 Favored 'General case' 0 N--CA 1.498 1.973 0 C-N-CA 120.132 -0.627 . . . . 0.0 109.798 176.997 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 262' ' ' SER . . . . . . . . . . . . . 23.2 m -62.47 -37.68 86.89 Favored 'General case' 0 N--CA 1.5 2.067 0 O-C-N 121.683 -0.636 . . . . 0.0 110.468 177.241 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 263' ' ' LEU . . . . . 0.492 HD12 ' HA ' ' B' ' 260' ' ' LEU . 21.6 mt -65.02 -43.02 93.83 Favored 'General case' 0 N--CA 1.5 2.067 0 O-C-N 121.718 -0.613 . . . . 0.0 110.292 179.195 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 264' ' ' LEU . . . . . . . . . . . . . 79.7 mt -62.76 -32.75 73.95 Favored 'General case' 0 N--CA 1.502 2.145 0 O-C-N 121.744 -0.597 . . . . 0.0 110.726 179.036 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 265' ' ' LYS . . . . . . . . . . . . . 53.2 tttm -74.54 -39.44 62.32 Favored 'General case' 0 N--CA 1.498 1.928 0 O-C-N 121.677 -0.639 . . . . 0.0 110.142 -177.97 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 266' ' ' SER . . . . . . . . . . . . . 9.6 m -163.05 155.93 19.06 Favored 'General case' 0 N--CA 1.496 1.829 0 O-C-N 121.697 -0.627 . . . . 0.0 110.203 -179.829 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 267' ' ' SER . . . . . . . . . . . . . 51.0 m -121.37 154.39 36.53 Favored 'General case' 0 N--CA 1.495 1.804 0 O-C-N 121.734 -0.604 . . . . 0.0 110.099 179.455 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 268' ' ' THR . . . . . . . . . . . . . 23.5 m -69.12 134.65 49.6 Favored 'General case' 0 N--CA 1.498 1.953 0 O-C-N 121.682 -0.636 . . . . 0.0 110.119 -179.676 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 269' ' ' ALA . . . . . 0.551 ' HB1' ' HD2' ' B' ' 270' ' ' PRO . . . 54.0 178.07 0.03 OUTLIER Pre-proline 0 N--CA 1.507 2.39 0 O-C-N 121.508 -0.745 . . . . 0.0 111.088 -178.115 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 270' ' ' PRO . . . . . 0.551 ' HD2' ' HB1' ' B' ' 269' ' ' ALA . 17.7 Cg_exo -63.28 132.39 35.97 Favored 'Trans proline' 0 N--CA 1.491 1.329 0 O-C-N 123.516 1.272 . . . . 0.0 110.479 179.416 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 271' ' ' SER . . . . . . . . . . . . . 11.0 t -98.3 -47.6 5.38 Favored 'General case' 0 N--CA 1.494 1.763 0 O-C-N 121.61 -0.682 . . . . 0.0 110.242 179.812 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 272' ' ' ASP . . . . . . . . . . . . . 9.7 m-20 -67.24 -38.92 85.99 Favored 'General case' 0 N--CA 1.5 2.05 0 O-C-N 121.708 -0.62 . . . . 0.0 110.322 179.994 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 273' ' ' LEU . . . . . 0.453 ' C ' HD23 ' B' ' 273' ' ' LEU . 6.7 tt 51.15 90.6 0.02 OUTLIER 'General case' 0 N--CA 1.505 2.311 0 O-C-N 121.545 -0.722 . . . . 0.0 111.029 -179.111 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 274' ' ' ALA . . . . . . . . . . . . . . . 50.15 -171.7 0.02 OUTLIER 'General case' 0 N--CA 1.506 2.37 0 O-C-N 121.62 -0.675 . . . . 0.0 111.211 -178.687 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 275' ' ' THR . . . . . . . . . . . . . 6.0 t -123.65 61.91 23.42 Favored Pre-proline 0 N--CA 1.498 1.933 0 O-C-N 121.618 -0.676 . . . . 0.0 110.284 179.511 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 276' ' ' PRO . . . . . . . . . . . . . 29.7 Cg_endo -67.79 150.98 79.12 Favored 'Trans proline' 0 N--CA 1.487 1.144 0 O-C-N 123.531 1.279 . . . . 0.0 110.404 179.637 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 277' ' ' GLN . . . . . . . . . . . . . 40.6 mt-30 -82.37 156.19 68.83 Favored Pre-proline 0 N--CA 1.497 1.883 0 O-C-N 121.665 -0.647 . . . . 0.0 110.11 179.496 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 278' ' ' PRO . . . . . . . . . . . . . 25.8 Cg_endo -66.5 137.39 46.45 Favored 'Trans proline' 0 N--CA 1.489 1.218 0 O-C-N 123.687 1.362 . . . . 0.0 110.408 -179.232 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 279' ' ' SER . . . . . . . . . . . . . 49.8 m -123.79 144.17 49.87 Favored 'General case' 0 N--CA 1.495 1.788 0 O-C-N 121.607 -0.683 . . . . 0.0 110.272 179.492 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 280' ' ' THR . . . . . . . . . . . . . 24.7 m -128.93 140.15 51.8 Favored 'General case' 0 N--CA 1.496 1.866 0 O-C-N 121.708 -0.62 . . . . 0.0 110.124 179.792 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 281' ' ' PHE . . . . . . . . . . . . . 60.1 m-85 -127.38 154.92 77.23 Favored Pre-proline 0 N--CA 1.495 1.78 0 O-C-N 121.671 -0.643 . . . . 0.0 110.206 179.177 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 282' ' ' PRO . . . . . . . . . . . . . 30.4 Cg_endo -68.27 137.66 40.83 Favored 'Trans proline' 0 N--CA 1.486 1.074 0 O-C-N 123.636 1.335 . . . . 0.0 110.465 -179.007 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 283' ' ' GLN . . . . . . . . . . . . . 1.8 mp0 52.33 89.16 0.1 Allowed Pre-proline 0 N--CA 1.506 2.332 0 O-C-N 121.656 -0.652 . . . . 0.0 111.137 178.769 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 284' ' ' PRO . . . . . . . . . . . . . 30.4 Cg_endo -68.51 154.33 71.92 Favored 'Trans proline' 0 N--CA 1.486 1.081 0 O-C-N 123.485 1.255 . . . . 0.0 110.27 178.625 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 285' ' ' PRO . . . . . . . . . . . . . 26.2 Cg_endo -66.56 131.25 25.63 Favored 'Trans proline' 0 N--CA 1.49 1.271 0 O-C-N 123.632 1.333 . . . . 0.0 110.393 -179.323 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 286' ' ' VAL . . . . . . . . . . . . . 57.8 t -87.13 -56.38 5.36 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.912 0 O-C-N 121.686 -0.634 . . . . 0.0 109.803 179.874 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 287' ' ' GLU . . . . . . . . . . . . . 34.3 tt0 -104.61 -54.23 2.55 Favored 'General case' 0 N--CA 1.495 1.784 0 O-C-N 121.651 -0.655 . . . . 0.0 110.27 -178.851 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 288' ' ' SER . . . . . . . . . . . . . 23.3 t 54.0 178.98 0.03 OUTLIER 'General case' 0 N--CA 1.505 2.3 0 O-C-N 121.596 -0.69 . . . . 0.0 111.147 -178.82 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 289' ' ' HIS . . . . . . . . . . . . . 76.4 m80 -95.39 -49.2 5.55 Favored 'General case' 0 N--CA 1.495 1.79 0 O-C-N 121.614 -0.679 . . . . 0.0 110.268 -179.686 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 290' ' ' SER . . . . . . . . . . . . . 50.6 m -124.49 148.7 47.54 Favored 'General case' 0 N--CA 1.495 1.812 0 O-C-N 121.671 -0.643 . . . . 0.0 110.267 -179.896 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 291' ' ' SER . . . . . . . . . . . . . 1.9 t . . . . . 0 N--CA 1.506 2.346 0 CA-C-O 117.996 -1.002 . . . . 0.0 110.988 179.794 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' -1' ' ' MET . . . . . . . . . . . . . 84.0 mtp . . . . . 0 N--CA 1.492 1.666 0 CA-C-O 120.962 0.411 . . . . 0.0 110.216 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 0' ' ' GLY . . . . . . . . . . . . . . . -175.48 -172.37 40.28 Favored Glycine 0 N--CA 1.494 2.514 0 N-CA-C 109.502 -1.439 . . . . 0.0 109.502 -179.853 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . 0.415 ' HB2' ' HE3' ' A' ' 1' ' ' MET . 74.5 mtm -110.69 170.65 7.95 Favored 'General case' 0 N--CA 1.496 1.827 0 O-C-N 121.719 -0.871 . . . . 0.0 110.149 179.92 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 63.5 m -101.03 163.68 12.17 Favored 'General case' 0 N--CA 1.495 1.79 0 O-C-N 121.701 -0.624 . . . . 0.0 110.076 -179.175 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 3' ' ' VAL . . . . . 0.429 HG12 ' CE1' ' A' ' 7' ' ' TYR . 74.6 t -66.77 -27.71 40.79 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.014 0 O-C-N 121.65 -0.656 . . . . 0.0 110.099 179.798 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -55.12 -30.94 60.79 Favored 'General case' 0 N--CA 1.504 2.228 0 O-C-N 121.434 -0.791 . . . . 0.0 110.369 -179.854 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -68.76 -30.88 69.57 Favored 'General case' 0 N--CA 1.499 1.991 0 O-C-N 121.783 -0.573 . . . . 0.0 110.24 174.676 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 91.1 m-85 -95.81 10.11 38.21 Favored 'General case' 0 N--CA 1.497 1.895 0 O-C-N 121.584 -0.697 . . . . 0.0 111.637 -178.0 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 7' ' ' TYR . . . . . 0.429 ' CE1' HG12 ' A' ' 3' ' ' VAL . 3.1 m-30 -67.35 133.36 49.48 Favored 'General case' 0 N--CA 1.502 2.174 0 O-C-N 121.088 -1.007 . . . . 0.0 110.043 173.801 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 82.38 1.88 90.51 Favored Glycine 0 N--CA 1.496 2.644 0 N-CA-C 110.625 -0.99 . . . . 0.0 110.625 -176.854 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 52.8 m -77.42 137.13 38.52 Favored 'General case' 0 N--CA 1.498 1.955 0 O-C-N 121.111 -1.229 . . . . 0.0 110.476 176.365 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 10' ' ' ASN . . . . . 0.754 ' CG ' HG22 ' A' ' 24' ' ' VAL . 2.6 m-20 -85.24 121.85 28.57 Favored 'General case' 0 N--CA 1.499 1.981 0 O-C-N 121.606 -0.684 . . . . 0.0 109.506 173.739 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . 0.483 HG12 ' HA ' ' A' ' 57' ' ' ILE . 30.9 m -144.0 161.08 15.77 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.774 0 C-N-CA 120.151 -0.62 . . . . 0.0 109.885 -179.403 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . 0.417 ' HB2' HD11 ' A' ' 58' ' ' LEU . 48.1 tt0 -109.33 147.23 33.03 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.737 -0.602 . . . . 0.0 109.6 177.124 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . 0.697 HG22 ' CD2' ' A' ' 55' ' ' LEU . 60.1 t -135.74 126.96 44.37 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.825 0 O-C-N 121.559 -0.713 . . . . 0.0 109.924 -173.758 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.447 HD13 ' HG2' ' A' ' 20' ' ' LYS . 26.3 tp -95.91 125.6 40.58 Favored 'General case' 0 N--CA 1.492 1.665 0 N-CA-C 109.192 -0.67 . . . . 0.0 109.192 173.955 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 87.5 mt -93.12 170.51 9.59 Favored 'General case' 0 N--CA 1.497 1.889 0 O-C-N 121.67 -0.644 . . . . 0.0 110.951 -174.372 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 24.7 p30 -57.19 -21.55 34.15 Favored 'General case' 0 N--CA 1.505 2.309 0 O-C-N 121.738 -0.601 . . . . 0.0 111.575 -178.213 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 53.1 p-10 -91.6 22.04 4.31 Favored 'General case' 0 N--CA 1.499 1.975 0 O-C-N 121.571 -0.706 . . . . 0.0 110.933 -177.989 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 74.4 m-20 58.9 27.92 16.85 Favored 'General case' 0 N--CA 1.506 2.331 0 O-C-N 121.433 -0.792 . . . . 0.0 110.714 175.399 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 50.7 m -108.98 145.84 34.85 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.494 -0.754 . . . . 0.0 109.674 173.128 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . 0.447 ' HG2' HD13 ' A' ' 14' ' ' LEU . 80.3 mttt -109.68 140.03 44.02 Favored 'General case' 0 N--CA 1.495 1.777 0 O-C-N 121.57 -0.706 . . . . 0.0 110.481 -177.342 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -153.14 137.83 16.95 Favored 'General case' 0 N--CA 1.497 1.878 0 O-C-N 121.785 -0.572 . . . . 0.0 110.178 177.008 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 9.7 ptp180 -124.37 158.59 32.32 Favored 'General case' 0 N--CA 1.497 1.899 0 O-C-N 121.575 -0.703 . . . . 0.0 110.197 -179.219 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . 0.526 ' HA2' HD13 ' A' ' 39' ' ' LEU . . . -171.82 171.24 44.01 Favored Glycine 0 N--CA 1.493 2.447 0 N-CA-C 109.087 -1.605 . . . . 0.0 109.087 -178.337 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . 0.754 HG22 ' CG ' ' A' ' 10' ' ' ASN . 20.0 t -94.69 122.15 45.9 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.878 0 O-C-N 121.626 -0.926 . . . . 0.0 109.162 175.803 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 25' ' ' ILE . . . . . 0.432 ' HA ' HD23 ' A' ' 37' ' ' LEU . 87.9 mt -63.05 141.39 18.18 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.272 0 O-C-N 121.508 -0.745 . . . . 0.0 110.351 -171.988 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . 0.606 HG21 ' HB2' ' A' ' 38' ' ' ARG . 13.7 p -121.11 -26.04 5.19 Favored 'General case' 0 N--CA 1.495 1.785 0 O-C-N 121.728 -0.607 . . . . 0.0 111.304 -179.906 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 26.9 t30 -162.87 160.24 24.78 Favored 'General case' 0 N--CA 1.5 2.062 0 O-C-N 120.965 -1.084 . . . . 0.0 111.789 179.936 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 28' ' ' PHE . . . . . 0.486 ' HE1' HG21 ' A' ' 49' ' ' THR . 87.8 t80 -150.09 127.1 11.18 Favored 'General case' 0 N--CA 1.498 1.96 0 N-CA-C 109.468 -0.568 . . . . 0.0 109.468 169.804 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 21.7 t70 -97.89 127.73 44.03 Favored 'General case' 0 N--CA 1.493 1.681 0 N-CA-C 109.111 -0.7 . . . . 0.0 109.111 -178.675 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 88.3 p -65.82 -44.62 85.03 Favored 'General case' 0 N--CA 1.499 1.985 0 O-C-N 121.607 -0.683 . . . . 0.0 110.755 -174.745 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 22.4 t -58.86 -48.1 82.57 Favored 'General case' 0 N--CA 1.502 2.158 0 O-C-N 121.446 -0.784 . . . . 0.0 111.002 -173.372 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 91.4 m-20 -107.03 -2.66 20.87 Favored 'General case' 0 N--CA 1.498 1.963 0 O-C-N 121.616 -0.678 . . . . 0.0 111.62 -178.932 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 3.4 m 49.2 67.24 0.91 Allowed 'General case' 0 N--CA 1.507 2.416 0 O-C-N 121.058 -1.026 . . . . 0.0 110.903 -174.027 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 34' ' ' ILE . . . . . 1.064 HD12 HG22 ' A' ' 48' ' ' VAL . 44.8 mm -116.22 125.83 73.45 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.025 0 O-C-N 121.512 -0.743 . . . . 0.0 109.162 -175.656 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 8.1 tp -115.83 121.53 42.69 Favored 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.636 -0.665 . . . . 0.0 110.569 -167.805 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 98.5 mt-30 -91.0 133.16 35.52 Favored 'General case' 0 N--CA 1.489 1.515 0 N-CA-C 109.351 -0.611 . . . . 0.0 109.351 172.392 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 0.432 HD23 ' HA ' ' A' ' 25' ' ' ILE . 19.2 mt -117.84 123.58 46.25 Favored 'General case' 0 N--CA 1.495 1.793 0 C-N-CA 120.294 -0.562 . . . . 0.0 110.086 175.579 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 38' ' ' ARG . . . . . 0.606 ' HB2' HG21 ' A' ' 26' ' ' THR . 56.3 ttt85 -103.86 104.93 14.99 Favored 'General case' 0 N--CA 1.496 1.843 0 O-C-N 121.803 -0.561 . . . . 0.0 110.125 173.632 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.526 HD13 ' HA2' ' A' ' 23' ' ' GLY . 61.1 tp -84.38 155.66 22.2 Favored 'General case' 0 N--CA 1.498 1.938 0 O-C-N 121.577 -0.702 . . . . 0.0 110.639 -176.647 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -68.3 -2.93 9.32 Favored 'General case' 0 N--CA 1.502 2.141 0 O-C-N 121.865 -0.522 . . . . 0.0 112.213 -170.548 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 7.0 m120 -86.7 28.16 0.91 Allowed 'General case' 0 N--CA 1.497 1.925 0 O-C-N 121.039 -1.038 . . . . 0.0 110.954 174.551 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 13.4 t0 64.9 28.77 12.64 Favored 'General case' 0 N--CA 1.505 2.298 0 O-C-N 121.205 -0.934 . . . . 0.0 110.388 175.528 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 66.5 m -125.92 138.03 53.75 Favored 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.437 -0.79 . . . . 0.0 110.113 178.633 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 9.8 t -128.29 146.78 50.65 Favored 'General case' 0 N--CA 1.495 1.813 0 O-C-N 121.702 -0.624 . . . . 0.0 109.928 178.197 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 46.3 mtmt -150.18 141.84 23.6 Favored 'General case' 0 N--CA 1.497 1.894 0 C-N-CA 120.129 -0.628 . . . . 0.0 110.655 -177.812 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 89.8 p -95.84 121.95 38.11 Favored 'General case' 0 N--CA 1.495 1.799 0 O-C-N 121.839 -0.538 . . . . 0.0 110.089 176.771 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 83.1 mt -129.32 135.8 60.92 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.789 0 O-C-N 121.616 -0.677 . . . . 0.0 109.349 -179.76 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 48' ' ' VAL . . . . . 1.064 HG22 HD12 ' A' ' 34' ' ' ILE . 65.4 t -81.84 127.69 39.38 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.861 0 O-C-N 121.577 -0.702 . . . . 0.0 109.224 179.755 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 49' ' ' THR . . . . . 0.486 HG21 ' HE1' ' A' ' 28' ' ' PHE . 37.5 p -58.7 -24.87 62.21 Favored 'General case' 0 N--CA 1.505 2.298 0 O-C-N 121.547 -0.721 . . . . 0.0 111.915 -169.959 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 33.5 tttp -56.46 -23.14 36.98 Favored 'General case' 0 N--CA 1.503 2.214 0 O-C-N 121.485 -0.759 . . . . 0.0 111.09 -177.141 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 51.7 p30 -83.05 0.73 43.55 Favored 'General case' 0 N--CA 1.5 2.029 0 C-N-CA 119.762 -0.775 . . . . 0.0 111.24 176.199 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 98.8 mt -75.81 126.79 36.92 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.038 0 O-C-N 121.193 -0.942 . . . . 0.0 109.955 177.829 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 79.6 tttt -91.28 -29.5 17.13 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.829 -0.545 . . . . 0.0 109.849 171.165 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 5.4 m-20 -164.15 157.3 17.9 Favored 'General case' 0 N--CA 1.5 2.063 0 O-C-N 121.768 -0.582 . . . . 0.0 110.093 -178.585 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . 0.697 ' CD2' HG22 ' A' ' 13' ' ' VAL . 84.6 mt -133.01 151.24 52.09 Favored 'General case' 0 N--CA 1.497 1.894 0 O-C-N 121.674 -0.641 . . . . 0.0 110.576 -179.525 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 6.2 ptm180 -152.63 136.87 16.56 Favored 'General case' 0 N--CA 1.495 1.798 0 O-C-N 121.833 -0.542 . . . . 0.0 109.732 174.818 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 57' ' ' ILE . . . . . 0.483 ' HA ' HG12 ' A' ' 11' ' ' VAL . 64.6 mt -83.51 133.17 29.74 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.846 0 O-C-N 121.522 -0.736 . . . . 0.0 109.81 176.212 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . 0.417 HD11 ' HB2' ' A' ' 12' ' ' GLU . 22.6 mt -82.21 157.62 67.97 Favored Pre-proline 0 N--CA 1.497 1.915 0 O-C-N 121.633 -0.667 . . . . 0.0 109.964 -179.301 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 22.3 Cg_endo -65.39 134.23 37.94 Favored 'Trans proline' 0 N--CA 1.489 1.235 0 O-C-N 123.722 1.38 . . . . 0.0 110.585 -177.565 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 48.0 mttp -114.2 175.16 5.59 Favored 'General case' 0 N--CA 1.495 1.807 0 O-C-N 121.7 -0.625 . . . . 0.0 110.155 178.797 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 26.7 t30 -98.76 30.64 3.23 Favored 'General case' 0 N--CA 1.494 1.774 0 O-C-N 121.715 -0.616 . . . . 0.0 110.567 179.458 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 26.9 tp10 -123.55 147.47 47.24 Favored 'General case' 0 N--CA 1.495 1.783 0 O-C-N 121.578 -0.701 . . . . 0.0 110.0 179.799 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 85.9 mt -67.58 -36.2 75.47 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.088 0 O-C-N 121.654 -0.654 . . . . 0.0 109.818 -178.895 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 64' ' ' MET . . . . . . . . . . . . . 6.8 tpt 52.27 90.52 0.08 OUTLIER Pre-proline 0 N--CA 1.507 2.389 0 O-C-N 121.595 -0.691 . . . . 0.0 110.905 -179.888 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 23.2 Cg_endo -65.79 145.56 81.11 Favored 'Trans proline' 0 N--CA 1.489 1.244 0 O-C-N 123.513 1.27 . . . . 0.0 110.493 -179.668 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 50.1 tttm -119.93 146.43 45.81 Favored 'General case' 0 N--CA 1.495 1.814 0 O-C-N 121.709 -0.62 . . . . 0.0 110.123 -179.927 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 42.8 t30 -92.52 120.9 33.44 Favored 'General case' 0 N--CA 1.495 1.82 0 O-C-N 121.72 -0.612 . . . . 0.0 110.256 -179.502 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 157.3 90.19 0.08 OUTLIER Glycine 0 N--CA 1.494 2.501 0 N-CA-C 109.496 -1.442 . . . . 0.0 109.496 -179.892 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 23.9 m -66.35 -38.93 88.75 Favored 'General case' 0 N--CA 1.5 2.032 0 O-C-N 121.764 -0.845 . . . . 0.0 110.306 -179.455 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 34.6 tptt -109.11 129.12 55.47 Favored 'General case' 0 N--CA 1.495 1.794 0 O-C-N 121.672 -0.642 . . . . 0.0 110.19 -179.879 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 1.6 t -142.89 151.19 55.75 Favored Pre-proline 0 N--CA 1.494 1.766 0 O-C-N 121.65 -0.656 . . . . 0.0 110.121 179.195 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 35.8 Cg_endo -70.08 102.38 1.07 Allowed 'Trans proline' 0 N--CA 1.487 1.104 0 O-C-N 123.528 1.278 . . . . 0.0 110.285 -179.907 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 27.4 t -160.52 -65.33 0.07 Allowed 'General case' 0 N--CA 1.496 1.847 0 O-C-N 121.733 -0.605 . . . . 0.0 110.203 179.457 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 25.5 m -129.57 136.9 50.37 Favored 'General case' 0 N--CA 1.495 1.792 0 O-C-N 121.705 -0.622 . . . . 0.0 110.162 179.969 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 39.4 t30 -112.1 99.55 8.15 Favored 'General case' 0 N--CA 1.495 1.792 0 O-C-N 121.618 -0.676 . . . . 0.0 110.181 179.033 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 51.1 m -125.99 146.86 49.7 Favored 'General case' 0 N--CA 1.495 1.797 0 O-C-N 121.729 -0.607 . . . . 0.0 110.246 -179.792 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 77' ' ' THR . . . . . 0.457 ' O ' HG22 ' A' ' 77' ' ' THR . 18.9 m -119.29 31.74 6.45 Favored 'General case' 0 N--CA 1.496 1.863 0 O-C-N 121.756 -0.59 . . . . 0.0 110.312 179.203 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 53.7 tptt -83.22 -62.26 1.64 Allowed 'General case' 0 N--CA 1.497 1.888 0 O-C-N 121.608 -0.683 . . . . 0.0 110.181 -178.912 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . 0.695 HD22 ' N ' ' A' ' 80' ' ' LYS . 0.0 OUTLIER -161.12 179.04 8.72 Favored 'General case' 0 N--CA 1.496 1.842 0 O-C-N 121.655 -0.653 . . . . 0.0 110.596 -179.3 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 80' ' ' LYS . . . . . 0.695 ' N ' HD22 ' A' ' 79' ' ' LEU . 50.1 mttp -114.74 149.13 37.36 Favored 'General case' 0 N--CA 1.495 1.821 0 O-C-N 121.598 -0.689 . . . . 0.0 110.212 -179.896 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 27.2 t -98.94 146.08 26.37 Favored 'General case' 0 N--CA 1.495 1.808 0 O-C-N 121.751 -0.593 . . . . 0.0 110.259 -179.248 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -81.87 -173.12 4.28 Favored 'General case' 0 N--CA 1.498 1.93 0 O-C-N 121.73 -0.607 . . . . 0.0 110.161 -179.538 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 54.5 mt-10 -66.15 -33.04 74.87 Favored 'General case' 0 N--CA 1.5 2.053 0 O-C-N 121.668 -0.645 . . . . 0.0 110.435 -179.526 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 40.9 p -90.92 156.0 18.31 Favored 'General case' 0 N--CA 1.497 1.905 0 O-C-N 121.682 -0.636 . . . . 0.0 110.101 -179.598 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 70.7 t80 -135.57 142.13 45.28 Favored 'General case' 0 N--CA 1.495 1.781 0 O-C-N 121.752 -0.592 . . . . 0.0 110.186 -179.959 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 49.7 m -120.09 144.92 47.35 Favored 'General case' 0 N--CA 1.494 1.773 0 O-C-N 121.661 -0.649 . . . . 0.0 110.147 179.376 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 29.4 t -135.66 140.94 44.89 Favored 'General case' 0 N--CA 1.496 1.842 0 O-C-N 121.756 -0.59 . . . . 0.0 110.248 179.916 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 88.2 mttt -105.5 142.66 34.86 Favored 'General case' 0 N--CA 1.495 1.788 0 O-C-N 121.722 -0.611 . . . . 0.0 110.159 179.407 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 30.0 m120 -64.82 -35.59 81.61 Favored 'General case' 0 N--CA 1.501 2.111 0 O-C-N 121.679 -0.638 . . . . 0.0 110.238 179.161 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 52.5 mttp -128.28 143.8 51.06 Favored 'General case' 0 N--CA 1.494 1.765 0 O-C-N 121.704 -0.622 . . . . 0.0 110.068 178.573 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 91' ' ' TRP . . . . . . . . . . . . . 74.3 t-105 -101.84 126.5 48.74 Favored 'General case' 0 N--CA 1.494 1.751 0 O-C-N 121.672 -0.643 . . . . 0.0 110.175 179.665 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 65.0 m 51.99 -172.41 0.03 OUTLIER 'General case' 0 N--CA 1.506 2.365 0 O-C-N 121.609 -0.682 . . . . 0.0 111.055 -179.759 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 93' ' ' MET . . . . . . . . . . . . . 74.2 mtm -63.03 -34.04 76.72 Favored 'General case' 0 N--CA 1.501 2.09 0 O-C-N 121.659 -0.65 . . . . 0.0 110.413 179.755 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 3.3 p30 . . . . . 0 N--CA 1.497 1.917 0 CA-C-O 117.972 -1.013 . . . . 0.0 110.307 179.817 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' B' B ' 240' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.367 0 N-CA-C 109.576 -1.41 . . . . 0.0 109.576 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' B' B ' 241' ' ' ALA . . . . . . . . . . . . . . . -66.76 -32.99 74.64 Favored 'General case' 0 N--CA 1.501 2.093 0 O-C-N 121.696 -0.884 . . . . 0.0 110.283 179.958 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 242' ' ' THR . . . . . . . . . . . . . 24.2 m -116.13 138.23 51.43 Favored 'General case' 0 N--CA 1.496 1.827 0 O-C-N 121.676 -0.64 . . . . 0.0 110.159 179.83 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 243' ' ' THR . . . . . 0.654 HG23 ' O ' ' B' ' 245' ' ' GLU . 6.4 t -136.72 159.6 41.35 Favored 'General case' 0 N--CA 1.498 1.938 0 O-C-N 121.707 -0.62 . . . . 0.0 110.406 179.695 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 244' ' ' LYS . . . . . . . . . . . . . 51.5 tttm -65.62 -37.56 86.95 Favored 'General case' 0 N--CA 1.5 2.067 0 O-C-N 121.677 -0.639 . . . . 0.0 110.475 -178.972 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 245' ' ' GLU . . . . . 0.654 ' O ' HG23 ' B' ' 243' ' ' THR . 80.4 mt-10 -95.79 146.76 24.28 Favored 'General case' 0 N--CA 1.496 1.842 0 O-C-N 121.665 -0.647 . . . . 0.0 110.217 -178.806 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 246' ' ' LYS . . . . . . . . . . . . . 84.3 mttt -105.85 121.49 44.17 Favored 'General case' 0 N--CA 1.494 1.759 0 O-C-N 121.729 -0.607 . . . . 0.0 110.326 -179.283 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 247' ' ' ASN . . . . . . . . . . . . . 92.7 m-20 -118.62 124.03 46.44 Favored 'General case' 0 N--CA 1.496 1.845 0 O-C-N 121.69 -0.631 . . . . 0.0 109.992 177.584 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 248' ' ' ILE . . . . . . . . . . . . . 50.6 mm 52.24 93.3 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.507 2.383 0 O-C-N 121.572 -0.705 . . . . 0.0 110.51 -178.416 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 249' ' ' SER . . . . . 0.417 ' C ' HG13 ' B' ' 250' ' ' VAL . 95.1 p -101.24 152.3 20.83 Favored 'General case' 0 N--CA 1.496 1.838 0 O-C-N 121.675 -0.641 . . . . 0.0 110.291 -177.851 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 250' ' ' VAL . . . . . 0.668 ' O ' ' HB2' ' B' ' 254' ' ' ALA . 31.6 m -150.89 33.26 0.09 OUTLIER 'Isoleucine or valine' 0 N--CA 1.498 1.968 0 O-C-N 121.761 -0.587 . . . . 0.0 109.99 179.824 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 251' ' ' ASP . . . . . . . . . . . . . 74.4 m-20 51.85 37.62 21.15 Favored 'General case' 0 N--CA 1.506 2.35 0 O-C-N 121.586 -0.696 . . . . 0.0 110.992 -179.362 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 252' ' ' VAL . . . . . . . . . . . . . 53.2 t 52.69 94.37 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.508 2.451 0 O-C-N 121.588 -0.695 . . . . 0.0 110.84 179.252 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 253' ' ' ASP . . . . . . . . . . . . . 74.6 m-20 53.53 55.43 8.62 Favored 'General case' 0 N--CA 1.506 2.372 0 O-C-N 121.639 -0.663 . . . . 0.0 111.055 177.787 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 254' ' ' ALA . . . . . 0.668 ' HB2' ' O ' ' B' ' 250' ' ' VAL . . . -65.97 -32.82 74.54 Favored 'General case' 0 N--CA 1.501 2.104 0 O-C-N 121.495 -0.753 . . . . 0.0 110.236 179.53 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 255' ' ' ASP . . . . . . . . . . . . . 74.3 m-20 -73.88 -31.66 63.24 Favored 'General case' 0 N--CA 1.499 1.984 0 O-C-N 121.542 -0.724 . . . . 0.0 110.327 179.147 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 256' ' ' ALA . . . . . . . . . . . . . . . -63.67 -37.84 88.86 Favored 'General case' 0 N--CA 1.5 2.055 0 O-C-N 121.539 -0.725 . . . . 0.0 110.32 179.603 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 257' ' ' SER . . . . . . . . . . . . . 54.6 p -55.75 -36.64 67.52 Favored 'General case' 0 N--CA 1.503 2.199 0 O-C-N 121.643 -0.661 . . . . 0.0 110.462 178.551 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 258' ' ' SER . . . . . . . . . . . . . 23.8 m -70.21 -31.95 69.62 Favored 'General case' 0 N--CA 1.498 1.955 0 C-N-CA 120.383 -0.527 . . . . 0.0 110.47 -179.335 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 259' ' ' GLN . . . . . . . . . . . . . 98.6 mt-30 -63.66 -40.84 97.85 Favored 'General case' 0 N--CA 1.501 2.109 0 O-C-N 121.511 -0.743 . . . . 0.0 110.542 -178.536 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 260' ' ' LEU . . . . . . . . . . . . . 84.2 mt -72.96 -41.63 64.21 Favored 'General case' 0 N--CA 1.498 1.955 0 O-C-N 121.635 -0.666 . . . . 0.0 110.295 -179.587 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 261' ' ' LEU . . . . . . . . . . . . . 20.7 tp -69.75 -38.46 76.82 Favored 'General case' 0 N--CA 1.497 1.909 0 O-C-N 121.655 -0.653 . . . . 0.0 109.884 178.857 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 262' ' ' SER . . . . . . . . . . . . . 88.8 p -63.32 -35.5 80.58 Favored 'General case' 0 N--CA 1.499 1.987 0 O-C-N 121.71 -0.619 . . . . 0.0 110.674 177.263 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 263' ' ' LEU . . . . . . . . . . . . . 26.7 mt -64.99 -42.05 94.86 Favored 'General case' 0 N--CA 1.501 2.098 0 O-C-N 121.564 -0.71 . . . . 0.0 110.366 -179.734 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 264' ' ' LEU . . . . . 0.491 ' CD1' HD11 ' A' ' 55' ' ' LEU . 86.4 mt -62.68 -38.72 91.47 Favored 'General case' 0 N--CA 1.502 2.134 0 O-C-N 121.667 -0.646 . . . . 0.0 110.401 178.328 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 265' ' ' LYS . . . . . . . . . . . . . 92.9 mttt -76.38 -37.07 57.72 Favored 'General case' 0 N--CA 1.496 1.864 0 O-C-N 121.649 -0.657 . . . . 0.0 109.988 178.976 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 266' ' ' SER . . . . . . . . . . . . . 25.2 p 47.77 -169.06 0.02 OUTLIER 'General case' 0 N--CA 1.507 2.387 0 CA-C-O 121.049 0.452 . . . . 0.0 111.61 179.842 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 267' ' ' SER . . . . . . . . . . . . . 93.8 p -133.32 152.17 51.91 Favored 'General case' 0 N--CA 1.494 1.774 0 O-C-N 121.7 -0.625 . . . . 0.0 110.141 179.118 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 268' ' ' THR . . . . . . . . . . . . . 41.0 p -128.22 157.82 39.81 Favored 'General case' 0 N--CA 1.497 1.889 0 O-C-N 121.668 -0.645 . . . . 0.0 110.135 -179.945 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 269' ' ' ALA . . . . . 0.733 ' HB3' ' HD3' ' B' ' 270' ' ' PRO . . . -70.91 -49.34 13.61 Favored Pre-proline 0 N--CA 1.499 1.981 0 O-C-N 121.672 -0.643 . . . . 0.0 110.764 -179.804 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 270' ' ' PRO . . . . . 0.733 ' HD3' ' HB3' ' B' ' 269' ' ' ALA . 33.7 Cg_exo -57.14 151.86 48.4 Favored 'Trans proline' 0 N--CA 1.493 1.449 0 O-C-N 123.121 1.064 . . . . 0.0 110.975 179.3 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 271' ' ' SER . . . . . . . . . . . . . 86.9 p -70.68 172.26 8.99 Favored 'General case' 0 N--CA 1.498 1.931 0 O-C-N 121.721 -0.612 . . . . 0.0 110.317 -179.057 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 272' ' ' ASP . . . . . . . . . . . . . 3.9 p30 -99.03 34.21 2.17 Favored 'General case' 0 N--CA 1.497 1.891 0 O-C-N 121.73 -0.606 . . . . 0.0 110.372 -179.84 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 273' ' ' LEU . . . . . . . . . . . . . 20.8 tp -160.81 155.6 23.91 Favored 'General case' 0 N--CA 1.495 1.817 0 O-C-N 121.637 -0.664 . . . . 0.0 109.95 -179.186 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 274' ' ' ALA . . . . . . . . . . . . . . . 51.58 -167.28 0.04 OUTLIER 'General case' 0 N--CA 1.505 2.307 0 O-C-N 121.615 -0.678 . . . . 0.0 110.96 -177.95 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 275' ' ' THR . . . . . . . . . . . . . 18.3 p -68.67 151.62 97.14 Favored Pre-proline 0 N--CA 1.498 1.969 0 O-C-N 121.649 -0.657 . . . . 0.0 110.203 -178.573 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 276' ' ' PRO . . . . . . . . . . . . . 31.0 Cg_endo -68.58 155.69 68.1 Favored 'Trans proline' 0 N--CA 1.487 1.123 0 O-C-N 123.651 1.343 . . . . 0.0 110.346 -179.589 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 277' ' ' GLN . . . . . . . . . . . . . 13.6 mm100 -122.23 75.66 41.74 Favored Pre-proline 0 N--CA 1.496 1.856 0 O-C-N 121.718 -0.614 . . . . 0.0 110.067 179.262 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 278' ' ' PRO . . . . . . . . . . . . . 26.7 Cg_endo -66.68 -30.59 41.76 Favored 'Trans proline' 0 N--CA 1.489 1.228 0 O-C-N 123.492 1.259 . . . . 0.0 110.635 -179.748 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 279' ' ' SER . . . . . . . . . . . . . 33.3 t -103.27 146.56 28.26 Favored 'General case' 0 N--CA 1.494 1.766 0 O-C-N 121.619 -0.676 . . . . 0.0 110.279 -179.288 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 280' ' ' THR . . . . . . . . . . . . . 10.2 m 54.78 99.4 0.01 OUTLIER 'General case' 0 N--CA 1.506 2.349 0 O-C-N 121.734 -0.604 . . . . 0.0 110.997 -179.042 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 281' ' ' PHE . . . . . . . . . . . . . 1.9 m-85 -61.2 -48.24 92.28 Favored Pre-proline 0 N--CA 1.502 2.138 0 O-C-N 121.608 -0.682 . . . . 0.0 110.89 -179.554 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 282' ' ' PRO . . . . . . . . . . . . . 23.7 Cg_exo -59.49 144.17 99.49 Favored 'Trans proline' 0 N--CA 1.493 1.448 0 O-C-N 123.192 1.101 . . . . 0.0 110.633 175.544 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 283' ' ' GLN . . . . . . . . . . . . . 33.7 mt-30 -93.58 146.15 31.26 Favored Pre-proline 0 N--CA 1.494 1.762 0 O-C-N 121.69 -0.632 . . . . 0.0 110.165 -179.669 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 284' ' ' PRO . . . . . . . . . . . . . 40.2 Cg_endo -72.85 154.16 53.47 Favored 'Trans proline' 0 N--CA 1.486 1.078 0 O-C-N 123.597 1.314 . . . . 0.0 110.169 -179.992 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 285' ' ' PRO . . . . . . . . . . . . . 26.1 Cg_endo -67.11 142.84 62.89 Favored 'Trans proline' 0 N--CA 1.489 1.209 0 O-C-N 123.604 1.318 . . . . 0.0 110.342 178.766 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 286' ' ' VAL . . . . . . . . . . . . . 57.4 t -69.62 -34.46 61.46 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.032 0 O-C-N 121.637 -0.664 . . . . 0.0 109.871 -179.812 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 287' ' ' GLU . . . . . . . . . . . . . 55.1 mt-10 -64.82 -36.0 82.91 Favored 'General case' 0 N--CA 1.501 2.11 0 O-C-N 121.702 -0.624 . . . . 0.0 110.633 -177.096 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 288' ' ' SER . . . . . . . . . . . . . 28.2 t -138.77 144.74 39.53 Favored 'General case' 0 N--CA 1.495 1.823 0 O-C-N 121.647 -0.658 . . . . 0.0 110.364 -179.01 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 289' ' ' HIS . . . . . . . . . . . . . 50.5 p-80 -116.52 130.02 56.52 Favored 'General case' 0 N--CA 1.497 1.898 0 O-C-N 121.73 -0.606 . . . . 0.0 110.322 179.955 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 290' ' ' SER . . . . . . . . . . . . . 25.0 m -66.64 -34.4 77.8 Favored 'General case' 0 N--CA 1.5 2.074 0 O-C-N 121.729 -0.607 . . . . 0.0 110.261 179.63 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 291' ' ' SER . . . . . . . . . . . . . 49.1 m . . . . . 0 N--CA 1.495 1.781 0 CA-C-O 117.995 -1.003 . . . . 0.0 110.192 -179.658 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' -1' ' ' MET . . . . . . . . . . . . . 56.5 ttp . . . . . 0 N--CA 1.492 1.644 0 CA-C-O 120.97 0.414 . . . . 0.0 110.161 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 0' ' ' GLY . . . . . . . . . . . . . . . 85.14 -169.09 43.53 Favored Glycine 0 N--CA 1.495 2.613 0 N-CA-C 109.376 -1.49 . . . . 0.0 109.376 -179.369 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 88.8 mtp -121.83 139.3 53.8 Favored 'General case' 0 N--CA 1.495 1.817 0 O-C-N 121.638 -0.919 . . . . 0.0 110.263 179.701 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 70.0 m -101.06 168.24 9.72 Favored 'General case' 0 N--CA 1.496 1.833 0 O-C-N 121.764 -0.585 . . . . 0.0 110.245 179.726 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 3' ' ' VAL . . . . . 0.416 HG21 ' CZ ' ' A' ' 28' ' ' PHE . 49.9 t -65.74 -27.92 42.68 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.198 0 O-C-N 121.654 -0.654 . . . . 0.0 110.138 179.595 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -55.58 -31.99 62.68 Favored 'General case' 0 N--CA 1.501 2.123 0 O-C-N 121.394 -0.816 . . . . 0.0 110.334 -179.838 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 74.2 m-20 -68.65 -35.38 77.18 Favored 'General case' 0 N--CA 1.498 1.937 0 O-C-N 121.809 -0.557 . . . . 0.0 109.956 175.387 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 6' ' ' PHE . . . . . 0.411 ' CE1' HD21 ' B' ' 260' ' ' LEU . 97.6 m-85 -97.9 10.06 41.18 Favored 'General case' 0 N--CA 1.498 1.965 0 O-C-N 121.746 -0.596 . . . . 0.0 111.226 178.812 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -67.49 126.95 30.91 Favored 'General case' 0 N--CA 1.501 2.095 0 O-C-N 121.241 -0.912 . . . . 0.0 110.052 178.752 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 81.95 2.11 90.47 Favored Glycine 0 N--CA 1.497 2.716 0 N-CA-C 110.695 -0.962 . . . . 0.0 110.695 -176.938 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 59.6 p -77.86 142.66 38.37 Favored 'General case' 0 N--CA 1.497 1.924 0 O-C-N 121.061 -1.258 . . . . 0.0 110.065 175.31 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 10' ' ' ASN . . . . . 0.774 ' ND2' HG22 ' A' ' 24' ' ' VAL . 1.9 m120 -85.27 117.53 24.26 Favored 'General case' 0 N--CA 1.5 2.028 0 N-CA-C 109.064 -0.717 . . . . 0.0 109.064 176.303 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . 0.443 HG12 ' HA ' ' A' ' 57' ' ' ILE . 29.8 m -142.21 158.88 20.08 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.89 0 C-N-CA 120.164 -0.614 . . . . 0.0 109.983 -179.152 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . 0.583 ' HB2' HD11 ' A' ' 58' ' ' LEU . 46.4 tt0 -109.4 129.53 55.54 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.619 -0.676 . . . . 0.0 110.107 178.772 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . 0.545 HG22 ' CD2' ' A' ' 55' ' ' LEU . 58.9 t -106.68 127.59 62.04 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.733 0 O-C-N 121.589 -0.695 . . . . 0.0 109.961 -178.917 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.506 HD13 ' HG2' ' A' ' 20' ' ' LYS . 28.3 tp -95.84 127.67 42.06 Favored 'General case' 0 N--CA 1.493 1.689 0 N-CA-C 109.096 -0.705 . . . . 0.0 109.096 173.947 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 87.9 mt -96.47 169.26 10.03 Favored 'General case' 0 N--CA 1.495 1.814 0 O-C-N 121.567 -0.708 . . . . 0.0 111.168 -172.793 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 24.2 p30 -57.59 -22.14 43.21 Favored 'General case' 0 N--CA 1.507 2.398 0 O-C-N 121.94 -0.475 . . . . 0.0 111.636 -177.123 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 44.6 p-10 -92.53 22.83 4.36 Favored 'General case' 0 N--CA 1.498 1.943 0 O-C-N 121.522 -0.736 . . . . 0.0 110.905 -176.995 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 74.5 m-20 58.56 27.5 15.77 Favored 'General case' 0 N--CA 1.505 2.312 0 O-C-N 121.465 -0.772 . . . . 0.0 110.637 176.078 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 48.0 m -106.29 143.6 34.18 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.519 -0.738 . . . . 0.0 109.597 172.859 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . 0.506 ' HG2' HD13 ' A' ' 14' ' ' LEU . 66.5 mttt -109.73 148.86 30.66 Favored 'General case' 0 N--CA 1.494 1.749 0 O-C-N 121.579 -0.701 . . . . 0.0 110.556 -176.229 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -153.07 154.21 34.41 Favored 'General case' 0 N--CA 1.496 1.834 0 O-C-N 121.729 -0.607 . . . . 0.0 110.105 176.066 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . 0.402 ' O ' HD22 ' A' ' 39' ' ' LEU . 30.8 ptt180 -138.69 151.17 46.94 Favored 'General case' 0 N--CA 1.497 1.913 0 O-C-N 121.597 -0.689 . . . . 0.0 110.466 179.341 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . 0.433 ' HA2' HD13 ' A' ' 39' ' ' LEU . . . -171.9 171.27 44.04 Favored Glycine 0 N--CA 1.492 2.394 0 N-CA-C 108.956 -1.658 . . . . 0.0 108.956 -178.71 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . 0.774 HG22 ' ND2' ' A' ' 10' ' ' ASN . 30.3 t -94.56 124.85 47.21 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.815 0 O-C-N 121.571 -0.958 . . . . 0.0 109.125 175.498 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 25' ' ' ILE . . . . . 0.492 ' HA ' HD23 ' A' ' 37' ' ' LEU . 51.0 mt -61.87 134.77 27.07 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.171 0 O-C-N 121.428 -0.795 . . . . 0.0 110.834 -171.839 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . 0.737 HG21 ' HB2' ' A' ' 38' ' ' ARG . 11.0 p -121.21 -16.94 7.84 Favored 'General case' 0 N--CA 1.494 1.765 0 O-C-N 121.916 -0.49 . . . . 0.0 111.61 -177.844 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 27' ' ' ASN . . . . . 0.424 ' O ' HD12 ' A' ' 35' ' ' LEU . 13.5 t30 -166.09 157.38 13.49 Favored 'General case' 0 N--CA 1.504 2.251 0 O-C-N 120.927 -1.108 . . . . 0.0 111.75 175.61 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 28' ' ' PHE . . . . . 0.416 ' CZ ' HG21 ' A' ' 3' ' ' VAL . 72.0 t80 -150.28 122.15 8.15 Favored 'General case' 0 N--CA 1.496 1.855 0 N-CA-C 109.225 -0.657 . . . . 0.0 109.225 173.459 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 26.6 t0 -99.12 130.45 45.44 Favored 'General case' 0 N--CA 1.491 1.614 0 N-CA-C 109.139 -0.689 . . . . 0.0 109.139 -178.022 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 19.3 m -70.55 -51.88 25.53 Favored 'General case' 0 N--CA 1.497 1.916 0 C-N-CA 120.0 -0.68 . . . . 0.0 110.54 -176.081 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 31.5 m -60.71 -40.79 93.6 Favored 'General case' 0 N--CA 1.501 2.116 0 O-C-N 121.617 -0.677 . . . . 0.0 110.847 -174.813 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 91.6 m-20 -103.85 -9.97 18.57 Favored 'General case' 0 N--CA 1.497 1.914 0 O-C-N 121.678 -0.639 . . . . 0.0 111.616 -177.579 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 15.0 m 49.83 67.26 0.93 Allowed 'General case' 0 N--CA 1.508 2.468 0 O-C-N 121.142 -0.974 . . . . 0.0 110.899 -174.665 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 34' ' ' ILE . . . . . 1.042 HD12 HG22 ' A' ' 48' ' ' VAL . 43.9 mm -120.8 125.93 74.64 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.997 0 O-C-N 121.623 -0.673 . . . . 0.0 109.26 -175.645 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.424 HD12 ' O ' ' A' ' 27' ' ' ASN . 14.8 tp -115.93 118.89 34.22 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.691 -0.63 . . . . 0.0 110.451 -170.659 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 78.4 mt-30 -90.96 132.75 35.77 Favored 'General case' 0 N--CA 1.489 1.517 0 N-CA-C 109.21 -0.663 . . . . 0.0 109.21 171.863 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 0.492 HD23 ' HA ' ' A' ' 25' ' ' ILE . 56.7 mt -117.77 123.57 46.32 Favored 'General case' 0 N--CA 1.493 1.693 0 C-N-CA 120.214 -0.594 . . . . 0.0 109.946 175.435 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 38' ' ' ARG . . . . . 0.737 ' HB2' HG21 ' A' ' 26' ' ' THR . 74.2 ttt-85 -104.27 104.87 14.84 Favored 'General case' 0 N--CA 1.496 1.835 0 O-C-N 121.716 -0.615 . . . . 0.0 109.97 173.643 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.433 HD13 ' HA2' ' A' ' 23' ' ' GLY . 63.7 tp -85.01 156.76 20.98 Favored 'General case' 0 N--CA 1.498 1.926 0 O-C-N 121.622 -0.674 . . . . 0.0 110.607 -176.339 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -66.82 -3.0 5.79 Favored 'General case' 0 N--CA 1.502 2.168 0 O-C-N 121.927 -0.483 . . . . 0.0 112.203 -170.954 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 91.6 m-20 -86.01 28.94 0.76 Allowed 'General case' 0 N--CA 1.498 1.946 0 O-C-N 120.97 -1.081 . . . . 0.0 110.765 172.364 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 10.2 m-20 59.34 31.4 21.1 Favored 'General case' 0 N--CA 1.504 2.243 0 O-C-N 121.244 -0.91 . . . . 0.0 110.419 174.372 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 66.2 m -124.64 137.83 54.35 Favored 'General case' 0 N--CA 1.496 1.865 0 O-C-N 121.486 -0.759 . . . . 0.0 110.439 178.877 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 8.5 t -103.93 151.13 23.53 Favored 'General case' 0 N--CA 1.498 1.933 0 O-C-N 121.816 -0.553 . . . . 0.0 110.262 176.32 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 39.0 ttmt -149.81 119.15 6.85 Favored 'General case' 0 N--CA 1.495 1.819 0 O-C-N 121.616 -0.677 . . . . 0.0 110.365 178.224 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 88.6 p -94.93 121.4 36.49 Favored 'General case' 0 N--CA 1.495 1.811 0 O-C-N 121.781 -0.575 . . . . 0.0 110.264 179.936 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 81.7 mt -129.28 135.14 62.5 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.853 0 O-C-N 121.686 -0.634 . . . . 0.0 109.342 179.572 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 48' ' ' VAL . . . . . 1.042 HG22 HD12 ' A' ' 34' ' ' ILE . 67.6 t -81.61 127.63 39.42 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.862 0 N-CA-C 109.069 -0.715 . . . . 0.0 109.069 177.35 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 49' ' ' THR . . . . . 0.6 ' HB ' HD22 ' B' ' 264' ' ' LEU . 59.6 p -58.28 -24.85 60.82 Favored 'General case' 0 N--CA 1.503 2.2 0 O-C-N 121.492 -0.755 . . . . 0.0 111.855 -168.337 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 19.0 tptm -56.89 -26.65 59.4 Favored 'General case' 0 N--CA 1.501 2.118 0 O-C-N 121.531 -0.731 . . . . 0.0 111.024 -177.12 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 4.9 p30 -85.1 6.85 23.81 Favored 'General case' 0 N--CA 1.498 1.958 0 C-N-CA 119.748 -0.781 . . . . 0.0 111.42 176.562 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 52' ' ' ILE . . . . . 0.406 HD12 HD13 ' B' ' 264' ' ' LEU . 98.4 mt -75.34 124.25 32.86 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.115 0 O-C-N 121.171 -0.956 . . . . 0.0 109.849 175.704 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 23.2 tptp -92.06 -29.11 16.74 Favored 'General case' 0 N--CA 1.494 1.774 0 O-C-N 121.801 -0.562 . . . . 0.0 109.879 171.081 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 5.2 m-20 -163.62 155.08 16.76 Favored 'General case' 0 N--CA 1.5 2.052 0 O-C-N 121.813 -0.554 . . . . 0.0 110.11 -178.145 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . 0.545 ' CD2' HG22 ' A' ' 13' ' ' VAL . 85.1 mt -132.99 149.65 52.22 Favored 'General case' 0 N--CA 1.497 1.903 0 O-C-N 121.736 -0.603 . . . . 0.0 110.432 -179.04 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 7.7 ptm180 -151.74 141.59 21.98 Favored 'General case' 0 N--CA 1.494 1.757 0 O-C-N 121.706 -0.621 . . . . 0.0 109.925 175.861 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 57' ' ' ILE . . . . . 0.443 ' HA ' HG12 ' A' ' 11' ' ' VAL . 69.5 mt -85.65 133.13 30.27 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.881 0 O-C-N 121.482 -0.762 . . . . 0.0 109.776 173.78 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . 0.583 HD11 ' HB2' ' A' ' 12' ' ' GLU . 79.2 mt -84.56 161.16 54.72 Favored Pre-proline 0 N--CA 1.496 1.869 0 O-C-N 121.616 -0.677 . . . . 0.0 110.07 178.611 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 24.9 Cg_endo -66.15 131.73 27.71 Favored 'Trans proline' 0 N--CA 1.488 1.165 0 O-C-N 123.628 1.331 . . . . 0.0 110.477 179.658 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 52.9 tttm -102.78 -53.93 2.75 Favored 'General case' 0 N--CA 1.495 1.797 0 O-C-N 121.698 -0.627 . . . . 0.0 110.302 -179.669 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 37.6 t30 -98.4 136.15 38.96 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.681 -0.637 . . . . 0.0 110.279 -178.764 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 74.8 mm-40 -101.48 162.96 12.52 Favored 'General case' 0 N--CA 1.495 1.812 0 O-C-N 121.626 -0.671 . . . . 0.0 110.233 179.683 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 18.2 tt -121.66 141.19 43.15 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.859 0 O-C-N 121.655 -0.653 . . . . 0.0 110.179 -179.455 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 64' ' ' MET . . . . . . . . . . . . . 23.8 ttm 52.16 67.49 3.98 Favored Pre-proline 0 N--CA 1.505 2.292 0 O-C-N 121.569 -0.707 . . . . 0.0 110.884 -179.32 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 25.7 Cg_endo -66.28 -35.09 33.35 Favored 'Trans proline' 0 N--CA 1.488 1.159 0 O-C-N 123.434 1.229 . . . . 0.0 110.503 -179.139 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 73.7 tttt -140.43 115.52 9.8 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.605 -0.684 . . . . 0.0 110.243 -179.986 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 15.4 t-20 -74.4 -37.25 63.44 Favored 'General case' 0 N--CA 1.498 1.943 0 O-C-N 121.741 -0.599 . . . . 0.0 110.178 178.36 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 173.94 -173.36 45.86 Favored Glycine 0 N--CA 1.494 2.518 0 N-CA-C 109.448 -1.461 . . . . 0.0 109.448 -179.581 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 23.0 m -97.54 113.38 25.07 Favored 'General case' 0 N--CA 1.494 1.749 0 O-C-N 121.632 -0.922 . . . . 0.0 110.175 179.745 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 47.8 mttp -144.88 164.35 31.34 Favored 'General case' 0 N--CA 1.495 1.814 0 O-C-N 121.723 -0.611 . . . . 0.0 110.211 179.598 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 2.3 t -120.34 78.66 27.37 Favored Pre-proline 0 N--CA 1.495 1.825 0 O-C-N 121.656 -0.653 . . . . 0.0 109.955 178.355 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 27.8 Cg_endo -67.03 -38.3 16.63 Favored 'Trans proline' 0 N--CA 1.489 1.261 0 O-C-N 123.546 1.287 . . . . 0.0 110.493 -178.323 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 88.4 p -147.08 156.85 43.35 Favored 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.707 -0.62 . . . . 0.0 110.348 -179.309 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 74' ' ' THR . . . . . 0.419 HG22 ' OG ' ' A' ' 76' ' ' SER . 24.3 m -68.04 -32.66 73.18 Favored 'General case' 0 N--CA 1.498 1.951 0 O-C-N 121.75 -0.594 . . . . 0.0 110.297 178.988 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 28.0 t30 55.97 40.15 30.45 Favored 'General case' 0 N--CA 1.505 2.314 0 O-C-N 121.508 -0.745 . . . . 0.0 110.748 -178.679 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 76' ' ' SER . . . . . 0.419 ' OG ' HG22 ' A' ' 74' ' ' THR . 49.9 m -123.34 152.28 41.64 Favored 'General case' 0 N--CA 1.495 1.806 0 O-C-N 121.644 -0.66 . . . . 0.0 110.097 178.995 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 23.9 m -79.0 131.19 36.21 Favored 'General case' 0 N--CA 1.497 1.889 0 O-C-N 121.648 -0.658 . . . . 0.0 110.183 -179.15 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 43.7 mmtt -130.51 143.63 50.88 Favored 'General case' 0 N--CA 1.496 1.826 0 O-C-N 121.621 -0.674 . . . . 0.0 110.164 179.454 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 83.0 mt -67.12 -34.73 78.24 Favored 'General case' 0 N--CA 1.5 2.044 0 O-C-N 121.686 -0.633 . . . . 0.0 110.14 179.064 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 90.2 mttt -102.11 168.9 9.08 Favored 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.741 -0.599 . . . . 0.0 110.147 179.322 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 50.2 m -108.68 149.16 29.35 Favored 'General case' 0 N--CA 1.495 1.82 0 O-C-N 121.675 -0.641 . . . . 0.0 110.174 -179.784 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -68.61 151.36 46.83 Favored 'General case' 0 N--CA 1.498 1.96 0 O-C-N 121.65 -0.656 . . . . 0.0 110.173 -179.479 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 41.1 tt0 -94.54 137.09 34.08 Favored 'General case' 0 N--CA 1.495 1.777 0 O-C-N 121.648 -0.658 . . . . 0.0 110.184 -179.658 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 10.1 t -134.32 156.71 47.98 Favored 'General case' 0 N--CA 1.497 1.897 0 O-C-N 121.782 -0.574 . . . . 0.0 110.236 179.532 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 97.5 m-85 -113.7 103.24 11.02 Favored 'General case' 0 N--CA 1.495 1.796 0 O-C-N 121.642 -0.662 . . . . 0.0 110.23 179.896 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 93.3 p -163.92 99.4 0.87 Allowed 'General case' 0 N--CA 1.496 1.829 0 O-C-N 121.635 -0.665 . . . . 0.0 110.11 179.231 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 78.6 p -66.96 -30.35 70.46 Favored 'General case' 0 N--CA 1.5 2.032 0 O-C-N 121.711 -0.618 . . . . 0.0 110.374 179.908 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 71.4 tttt 54.0 47.07 24.22 Favored 'General case' 0 N--CA 1.505 2.296 0 O-C-N 121.556 -0.715 . . . . 0.0 110.969 178.196 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 28.0 p-10 -162.68 -39.55 0.04 OUTLIER 'General case' 0 N--CA 1.498 1.949 0 O-C-N 121.545 -0.722 . . . . 0.0 110.664 178.172 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 36.2 ttmt -131.85 125.81 32.71 Favored 'General case' 0 N--CA 1.496 1.826 0 O-C-N 121.552 -0.718 . . . . 0.0 110.086 177.859 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 91' ' ' TRP . . . . . . . . . . . . . 45.9 p-90 -143.27 162.93 34.36 Favored 'General case' 0 N--CA 1.496 1.841 0 O-C-N 121.688 -0.632 . . . . 0.0 110.299 -179.923 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 48.4 m -120.66 147.15 45.64 Favored 'General case' 0 N--CA 1.496 1.852 0 O-C-N 121.733 -0.605 . . . . 0.0 110.198 -179.88 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 93' ' ' MET . . . . . . . . . . . . . 24.0 ttt -106.96 137.48 44.95 Favored 'General case' 0 N--CA 1.494 1.771 0 O-C-N 121.724 -0.61 . . . . 0.0 110.209 179.993 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 4.5 p-10 . . . . . 0 N--CA 1.498 1.942 0 CA-C-O 117.997 -1.001 . . . . 0.0 110.253 179.856 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' B' B ' 240' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.334 0 N-CA-C 109.529 -1.428 . . . . 0.0 109.529 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' B' B ' 241' ' ' ALA . . . . . . . . . . . . . . . -100.33 134.75 42.81 Favored 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.679 -0.895 . . . . 0.0 110.231 -179.867 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 242' ' ' THR . . . . . . . . . . . . . 9.8 t -139.15 161.42 37.45 Favored 'General case' 0 N--CA 1.496 1.827 0 O-C-N 121.676 -0.64 . . . . 0.0 110.356 179.721 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 243' ' ' THR . . . . . . . . . . . . . 24.6 m -113.95 128.78 56.54 Favored 'General case' 0 N--CA 1.495 1.824 0 O-C-N 121.636 -0.665 . . . . 0.0 110.215 -179.872 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 244' ' ' LYS . . . . . . . . . . . . . 67.7 mttt -140.75 155.15 46.5 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.71 -0.619 . . . . 0.0 110.132 179.126 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 245' ' ' GLU . . . . . . . . . . . . . 54.1 mt-10 -66.09 -33.68 76.34 Favored 'General case' 0 N--CA 1.5 2.048 0 O-C-N 121.69 -0.631 . . . . 0.0 110.318 179.775 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 246' ' ' LYS . . . . . . . . . . . . . 34.7 tttp -98.62 135.45 40.12 Favored 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.561 -0.712 . . . . 0.0 110.172 179.108 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 247' ' ' ASN . . . . . . . . . . . . . 27.2 p30 -140.35 -177.45 5.03 Favored 'General case' 0 N--CA 1.497 1.913 0 O-C-N 121.67 -0.644 . . . . 0.0 110.393 -179.55 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 248' ' ' ILE . . . . . . . . . . . . . 50.7 mm 54.11 96.82 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.508 2.452 0 O-C-N 121.631 -0.668 . . . . 0.0 110.659 -179.787 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 249' ' ' SER . . . . . . . . . . . . . 33.9 t -89.16 161.82 16.26 Favored 'General case' 0 N--CA 1.495 1.823 0 O-C-N 121.704 -0.622 . . . . 0.0 110.172 179.596 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 250' ' ' VAL . . . . . 0.407 ' H ' HG22 ' B' ' 250' ' ' VAL . 35.1 m -90.21 14.45 1.33 Allowed 'Isoleucine or valine' 0 N--CA 1.503 2.181 0 O-C-N 121.698 -0.626 . . . . 0.0 111.435 -179.34 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 251' ' ' ASP . . . . . . . . . . . . . 74.3 m-20 -82.17 -3.22 54.5 Favored 'General case' 0 N--CA 1.499 1.995 0 O-C-N 121.266 -0.896 . . . . 0.0 111.37 179.407 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 252' ' ' VAL . . . . . 0.421 HG12 ' N ' ' B' ' 253' ' ' ASP . 39.9 t 58.37 164.33 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.51 2.54 0 O-C-N 121.363 -0.836 . . . . 0.0 110.595 -178.994 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 253' ' ' ASP . . . . . 0.421 ' N ' HG12 ' B' ' 252' ' ' VAL . 74.6 m-20 -81.42 117.82 22.18 Favored 'General case' 0 N--CA 1.497 1.913 0 O-C-N 121.417 -0.802 . . . . 0.0 110.294 -179.289 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 254' ' ' ALA . . . . . . . . . . . . . . . -67.42 -28.59 68.02 Favored 'General case' 0 N--CA 1.501 2.098 0 O-C-N 121.689 -0.632 . . . . 0.0 110.497 177.837 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 255' ' ' ASP . . . . . . . . . . . . . 74.5 m-20 -72.04 -25.97 62.01 Favored 'General case' 0 N--CA 1.499 2.019 0 O-C-N 121.62 -0.675 . . . . 0.0 110.751 -178.908 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 256' ' ' ALA . . . . . . . . . . . . . . . -61.67 -35.37 77.78 Favored 'General case' 0 N--CA 1.501 2.122 0 O-C-N 121.4 -0.813 . . . . 0.0 110.541 -178.056 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 257' ' ' SER . . . . . . . . . . . . . 32.2 t -55.14 -35.0 64.26 Favored 'General case' 0 N--CA 1.505 2.28 0 O-C-N 121.61 -0.681 . . . . 0.0 110.327 177.238 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 258' ' ' SER . . . . . . . . . . . . . 24.1 m -68.01 -31.39 71.05 Favored 'General case' 0 N--CA 1.497 1.919 0 C-N-CA 120.513 -0.475 . . . . 0.0 110.225 178.87 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 259' ' ' GLN . . . . . . . . . . . . . 48.7 tt0 -63.26 -37.12 86.01 Favored 'General case' 0 N--CA 1.5 2.027 0 O-C-N 121.647 -0.658 . . . . 0.0 110.37 178.714 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 260' ' ' LEU . . . . . 0.493 ' HA ' HD12 ' B' ' 263' ' ' LEU . 82.1 mt -64.18 -43.75 94.14 Favored 'General case' 0 N--CA 1.501 2.079 0 O-C-N 121.628 -0.67 . . . . 0.0 110.248 179.184 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 261' ' ' LEU . . . . . . . . . . . . . 17.5 tp -70.69 -38.36 73.68 Favored 'General case' 0 N--CA 1.497 1.915 0 O-C-N 121.662 -0.649 . . . . 0.0 109.733 175.919 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 262' ' ' SER . . . . . . . . . . . . . 23.1 t -62.38 -35.56 79.56 Favored 'General case' 0 N--CA 1.501 2.093 0 O-C-N 121.681 -0.637 . . . . 0.0 110.52 176.639 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 263' ' ' LEU . . . . . 0.493 HD12 ' HA ' ' B' ' 260' ' ' LEU . 18.3 mt -64.53 -42.0 96.01 Favored 'General case' 0 N--CA 1.501 2.101 0 O-C-N 121.689 -0.632 . . . . 0.0 110.254 179.679 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 264' ' ' LEU . . . . . 0.6 HD22 ' HB ' ' A' ' 49' ' ' THR . 87.6 mt -62.51 -38.62 90.64 Favored 'General case' 0 N--CA 1.502 2.146 0 O-C-N 121.691 -0.631 . . . . 0.0 110.509 178.715 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 265' ' ' LYS . . . . . . . . . . . . . 96.1 mttt -75.71 -32.84 60.24 Favored 'General case' 0 N--CA 1.498 1.949 0 O-C-N 121.743 -0.598 . . . . 0.0 110.272 -179.874 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 266' ' ' SER . . . . . . . . . . . . . 7.7 m -162.94 149.08 12.26 Favored 'General case' 0 N--CA 1.494 1.762 0 O-C-N 121.589 -0.694 . . . . 0.0 110.069 179.262 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 267' ' ' SER . . . . . . . . . . . . . 14.2 m -120.91 32.34 6.01 Favored 'General case' 0 N--CA 1.495 1.809 0 O-C-N 121.63 -0.669 . . . . 0.0 110.421 -179.36 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 268' ' ' THR . . . . . . . . . . . . . 43.1 p -69.73 -35.66 75.18 Favored 'General case' 0 N--CA 1.498 1.958 0 O-C-N 121.564 -0.71 . . . . 0.0 110.016 179.564 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 269' ' ' ALA . . . . . . . . . . . . . . . 47.92 85.32 0.18 Allowed Pre-proline 0 N--CA 1.506 2.329 0 O-C-N 121.77 -0.582 . . . . 0.0 111.323 -179.16 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 270' ' ' PRO . . . . . . . . . . . . . 18.9 Cg_exo -62.75 142.13 87.91 Favored 'Trans proline' 0 N--CA 1.49 1.29 0 O-C-N 123.513 1.27 . . . . 0.0 110.524 179.318 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 271' ' ' SER . . . . . . . . . . . . . 90.5 p -143.77 157.81 44.12 Favored 'General case' 0 N--CA 1.495 1.813 0 O-C-N 121.704 -0.622 . . . . 0.0 110.291 -179.944 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 272' ' ' ASP . . . . . . . . . . . . . 74.2 m-20 -102.11 145.51 29.25 Favored 'General case' 0 N--CA 1.495 1.81 0 O-C-N 121.666 -0.646 . . . . 0.0 110.268 179.634 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 273' ' ' LEU . . . . . . . . . . . . . 4.3 mm? 51.12 -171.84 0.03 OUTLIER 'General case' 0 N--CA 1.505 2.318 0 O-C-N 121.651 -0.656 . . . . 0.0 111.184 -179.932 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 274' ' ' ALA . . . . . . . . . . . . . . . 51.22 -174.8 0.02 OUTLIER 'General case' 0 N--CA 1.505 2.292 0 O-C-N 121.682 -0.636 . . . . 0.0 111.275 -179.383 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 275' ' ' THR . . . . . . . . . . . . . 22.8 p -150.44 164.62 19.83 Favored Pre-proline 0 N--CA 1.494 1.751 0 O-C-N 121.636 -0.665 . . . . 0.0 110.259 -179.839 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 276' ' ' PRO . . . . . . . . . . . . . 19.9 Cg_exo -62.32 152.9 73.88 Favored 'Trans proline' 0 N--CA 1.491 1.34 0 O-C-N 123.591 1.311 . . . . 0.0 110.615 179.144 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 277' ' ' GLN . . . . . . . . . . . . . 13.3 pt20 -114.1 161.84 26.08 Favored Pre-proline 0 N--CA 1.498 1.973 0 O-C-N 121.641 -0.662 . . . . 0.0 110.347 -179.876 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 278' ' ' PRO . . . . . . . . . . . . . 19.7 Cg_exo -62.19 138.83 74.61 Favored 'Trans proline' 0 N--CA 1.491 1.34 0 O-C-N 123.656 1.345 . . . . 0.0 110.703 -179.24 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 279' ' ' SER . . . . . . . . . . . . . 86.8 p -122.81 32.52 5.7 Favored 'General case' 0 N--CA 1.495 1.822 0 O-C-N 121.628 -0.67 . . . . 0.0 110.207 178.7 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 280' ' ' THR . . . . . . . . . . . . . 24.3 m -65.56 -36.97 85.35 Favored 'General case' 0 N--CA 1.501 2.084 0 O-C-N 121.626 -0.671 . . . . 0.0 110.447 -178.301 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 281' ' ' PHE . . . . . . . . . . . . . 89.0 m-85 -109.03 162.6 19.46 Favored Pre-proline 0 N--CA 1.495 1.796 0 O-C-N 121.701 -0.624 . . . . 0.0 110.298 -178.692 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 282' ' ' PRO . . . . . . . . . . . . . 19.4 Cg_exo -62.36 153.91 67.36 Favored 'Trans proline' 0 N--CA 1.49 1.275 0 O-C-N 123.587 1.309 . . . . 0.0 110.626 179.759 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 283' ' ' GLN . . . . . . . . . . . . . 58.0 mm-40 -88.35 156.21 51.2 Favored Pre-proline 0 N--CA 1.496 1.832 0 O-C-N 121.651 -0.655 . . . . 0.0 110.24 179.975 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 284' ' ' PRO . . . . . . . . . . . . . 29.9 Cg_endo -68.06 157.39 61.99 Favored 'Trans proline' 0 N--CA 1.487 1.132 0 O-C-N 123.667 1.351 . . . . 0.0 110.383 -179.537 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 285' ' ' PRO . . . . . . . . . . . . . 26.1 Cg_endo -66.45 152.79 80.1 Favored 'Trans proline' 0 N--CA 1.487 1.146 0 O-C-N 123.652 1.343 . . . . 0.0 110.45 179.746 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 286' ' ' VAL . . . . . . . . . . . . . 62.0 t -109.45 135.39 48.55 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.884 0 O-C-N 121.651 -0.656 . . . . 0.0 109.775 -179.584 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 287' ' ' GLU . . . . . . . . . . . . . 79.2 mt-10 -109.82 157.88 18.72 Favored 'General case' 0 N--CA 1.496 1.834 0 O-C-N 121.718 -0.614 . . . . 0.0 110.194 179.875 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 288' ' ' SER . . . . . . . . . . . . . 49.1 m -68.22 153.77 43.07 Favored 'General case' 0 N--CA 1.498 1.975 0 O-C-N 121.591 -0.693 . . . . 0.0 110.266 -179.815 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 289' ' ' HIS . . . . . . . . . . . . . 48.3 p-80 -128.86 33.29 4.64 Favored 'General case' 0 N--CA 1.497 1.895 0 O-C-N 121.713 -0.617 . . . . 0.0 110.377 -179.78 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 290' ' ' SER . . . . . . . . . . . . . 85.3 p -80.44 160.89 25.17 Favored 'General case' 0 N--CA 1.498 1.946 0 O-C-N 121.62 -0.675 . . . . 0.0 110.222 -179.7 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 291' ' ' SER . . . . . . . . . . . . . 23.0 t . . . . . 0 N--CA 1.494 1.763 0 CA-C-O 118.029 -0.986 . . . . 0.0 110.242 -179.91 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' -1' ' ' MET . . . . . . . . . . . . . 85.3 mtp . . . . . 0 N--CA 1.494 1.736 0 CA-C-O 120.994 0.426 . . . . 0.0 110.13 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 0' ' ' GLY . . . . . . . . . . . . . . . 75.31 71.49 1.14 Allowed Glycine 0 N--CA 1.493 2.483 0 N-CA-C 109.598 -1.401 . . . . 0.0 109.598 179.708 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 89.4 mtp 52.66 95.19 0.02 OUTLIER 'General case' 0 N--CA 1.505 2.3 0 O-C-N 121.556 -0.967 . . . . 0.0 111.119 -179.97 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 69.7 m -99.58 168.76 9.75 Favored 'General case' 0 N--CA 1.494 1.725 0 O-C-N 121.668 -0.645 . . . . 0.0 110.146 -179.748 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 3' ' ' VAL . . . . . 0.428 HG12 ' CE1' ' A' ' 7' ' ' TYR . 61.3 t -65.92 -27.86 42.3 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.111 0 O-C-N 121.707 -0.621 . . . . 0.0 110.241 -178.798 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -55.19 -30.84 60.73 Favored 'General case' 0 N--CA 1.504 2.255 0 O-C-N 121.4 -0.813 . . . . 0.0 110.44 -178.64 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 74.4 m-20 -68.77 -30.98 69.69 Favored 'General case' 0 N--CA 1.5 2.032 0 C-N-CA 120.33 -0.548 . . . . 0.0 110.252 174.854 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 6' ' ' PHE . . . . . 0.404 ' CE1' HD21 ' B' ' 260' ' ' LEU . 96.7 m-85 -96.09 10.04 38.89 Favored 'General case' 0 N--CA 1.497 1.889 0 O-C-N 121.653 -0.655 . . . . 0.0 111.512 -178.168 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 7' ' ' TYR . . . . . 0.428 ' CE1' HG12 ' A' ' 3' ' ' VAL . 3.3 m-30 -67.24 137.53 56.23 Favored 'General case' 0 N--CA 1.501 2.105 0 O-C-N 121.093 -1.004 . . . . 0.0 110.014 174.189 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 8' ' ' GLY . . . . . 0.416 ' O ' HG13 ' A' ' 24' ' ' VAL . . . 82.72 -0.64 89.3 Favored Glycine 0 N--CA 1.498 2.796 0 N-CA-C 110.704 -0.959 . . . . 0.0 110.704 -176.294 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 31.8 t -77.02 133.96 38.96 Favored 'General case' 0 N--CA 1.498 1.937 0 O-C-N 121.113 -1.228 . . . . 0.0 110.488 178.928 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 13.6 t-20 -83.13 120.53 25.89 Favored 'General case' 0 N--CA 1.497 1.887 0 O-C-N 121.694 -0.628 . . . . 0.0 109.526 173.399 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . 0.538 HG12 ' HA ' ' A' ' 57' ' ' ILE . 35.2 m -143.15 165.42 15.45 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.734 0 N-CA-C 109.527 -0.546 . . . . 0.0 109.527 -178.329 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . 0.446 ' HB2' HD11 ' A' ' 58' ' ' LEU . 47.0 tt0 -109.35 126.38 53.34 Favored 'General case' 0 N--CA 1.494 1.729 0 C-N-CA 119.897 -0.721 . . . . 0.0 109.752 176.54 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . 0.608 HG22 ' CD2' ' A' ' 55' ' ' LEU . 54.1 t -106.79 125.1 62.77 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.745 0 O-C-N 121.614 -0.679 . . . . 0.0 109.891 -178.098 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 25.0 tp -95.94 128.59 42.97 Favored 'General case' 0 N--CA 1.494 1.734 0 N-CA-C 109.326 -0.62 . . . . 0.0 109.326 174.838 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 87.6 mt -96.68 169.5 9.83 Favored 'General case' 0 N--CA 1.496 1.837 0 O-C-N 121.677 -0.64 . . . . 0.0 111.004 -173.846 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 24.3 p30 -57.71 -22.2 44.94 Favored 'General case' 0 N--CA 1.505 2.307 0 O-C-N 121.701 -0.625 . . . . 0.0 111.615 -176.984 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 43.7 p-10 -93.05 23.16 4.44 Favored 'General case' 0 N--CA 1.497 1.902 0 O-C-N 121.523 -0.736 . . . . 0.0 110.867 -177.001 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 74.4 m-20 58.72 27.54 16.06 Favored 'General case' 0 N--CA 1.506 2.344 0 O-C-N 121.435 -0.79 . . . . 0.0 110.594 176.155 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 51.0 m -106.86 146.06 31.42 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.502 -0.749 . . . . 0.0 109.563 173.109 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 48.6 mttm -109.6 143.74 38.89 Favored 'General case' 0 N--CA 1.495 1.776 0 O-C-N 121.599 -0.688 . . . . 0.0 110.63 -176.599 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -153.07 123.64 7.23 Favored 'General case' 0 N--CA 1.497 1.876 0 O-C-N 121.778 -0.576 . . . . 0.0 110.048 176.575 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . 0.532 ' O ' HD13 ' A' ' 39' ' ' LEU . 8.9 ptp85 -118.32 147.61 43.31 Favored 'General case' 0 N--CA 1.498 1.96 0 O-C-N 121.615 -0.678 . . . . 0.0 110.375 -176.483 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -171.79 171.44 44.1 Favored Glycine 0 N--CA 1.495 2.63 0 N-CA-C 108.975 -1.65 . . . . 0.0 108.975 -176.148 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . 0.416 HG13 ' O ' ' A' ' 8' ' ' GLY . 47.2 t -94.58 119.41 42.53 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.925 0 O-C-N 121.433 -1.039 . . . . 0.0 109.355 -177.462 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 25' ' ' ILE . . . . . 0.413 ' HA ' HD23 ' A' ' 37' ' ' LEU . 74.9 mt -64.25 143.58 15.55 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.155 0 O-C-N 121.7 -0.625 . . . . 0.0 110.449 -171.975 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . 0.794 HG21 ' HG3' ' A' ' 38' ' ' ARG . 20.7 p -121.3 -27.31 4.88 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.785 -0.572 . . . . 0.0 111.233 179.176 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 27' ' ' ASN . . . . . 0.538 ' O ' HD12 ' A' ' 35' ' ' LEU . 26.9 t30 -161.39 160.91 30.06 Favored 'General case' 0 N--CA 1.501 2.078 0 C-N-CA 118.95 -1.1 . . . . 0.0 111.814 -178.854 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 28' ' ' PHE . . . . . 0.444 ' CE1' HG21 ' A' ' 49' ' ' THR . 69.5 t80 -150.02 128.37 12.14 Favored 'General case' 0 N--CA 1.496 1.86 0 N-CA-C 109.301 -0.629 . . . . 0.0 109.301 169.107 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 17.9 t70 -100.2 130.56 46.34 Favored 'General case' 0 N--CA 1.492 1.659 0 N-CA-C 109.04 -0.726 . . . . 0.0 109.04 -178.351 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 87.1 p -68.87 -48.59 63.03 Favored 'General case' 0 N--CA 1.498 1.963 0 C-N-CA 120.016 -0.674 . . . . 0.0 110.649 -175.925 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 23.0 m -59.76 -43.77 94.15 Favored 'General case' 0 N--CA 1.502 2.16 0 O-C-N 121.636 -0.665 . . . . 0.0 110.907 -174.221 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 91.5 m-20 -104.24 -8.66 19.18 Favored 'General case' 0 N--CA 1.497 1.919 0 O-C-N 121.687 -0.633 . . . . 0.0 111.619 -178.252 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 24.8 m 49.71 67.22 0.93 Allowed 'General case' 0 N--CA 1.508 2.442 0 O-C-N 121.131 -0.98 . . . . 0.0 110.929 -174.403 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 34' ' ' ILE . . . . . 0.986 HD12 HG22 ' A' ' 48' ' ' VAL . 42.6 mm -122.52 126.1 73.6 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.028 0 O-C-N 121.635 -0.666 . . . . 0.0 109.356 -175.45 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.538 HD12 ' O ' ' A' ' 27' ' ' ASN . 12.3 tp -115.78 120.47 39.41 Favored 'General case' 0 N--CA 1.494 1.739 0 O-C-N 121.699 -0.626 . . . . 0.0 110.589 -169.464 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 99.0 mt-30 -91.08 132.96 35.71 Favored 'General case' 0 N--CA 1.49 1.538 0 N-CA-C 109.517 -0.549 . . . . 0.0 109.517 174.506 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 0.413 HD23 ' HA ' ' A' ' 25' ' ' ILE . 15.5 mt -117.95 123.84 46.76 Favored 'General case' 0 N--CA 1.495 1.811 0 O-C-N 121.902 -0.498 . . . . 0.0 109.964 176.034 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 38' ' ' ARG . . . . . 0.794 ' HG3' HG21 ' A' ' 26' ' ' THR . 11.6 mtt85 -96.83 106.91 19.31 Favored 'General case' 0 N--CA 1.498 1.934 0 O-C-N 121.646 -0.659 . . . . 0.0 109.924 175.792 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.532 HD13 ' O ' ' A' ' 22' ' ' ARG . 16.8 tp -84.67 152.48 23.75 Favored 'General case' 0 N--CA 1.495 1.777 0 C-N-CA 120.24 -0.584 . . . . 0.0 110.813 -174.807 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -66.8 -5.44 12.19 Favored 'General case' 0 N--CA 1.502 2.146 0 O-C-N 121.941 -0.474 . . . . 0.0 112.041 -171.658 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 91.6 m-20 -86.99 28.09 0.95 Allowed 'General case' 0 N--CA 1.499 2.001 0 O-C-N 121.115 -0.991 . . . . 0.0 110.879 174.547 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 8.5 t70 62.91 29.27 16.55 Favored 'General case' 0 N--CA 1.505 2.278 0 O-C-N 120.981 -1.074 . . . . 0.0 110.462 175.769 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 50.1 m -124.5 137.86 54.39 Favored 'General case' 0 N--CA 1.496 1.838 0 O-C-N 121.401 -0.812 . . . . 0.0 110.49 -179.438 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 9.8 t -97.7 150.99 20.59 Favored 'General case' 0 N--CA 1.497 1.911 0 O-C-N 121.818 -0.552 . . . . 0.0 110.194 175.47 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 41.3 tttp -149.3 119.13 7.07 Favored 'General case' 0 N--CA 1.495 1.786 0 O-C-N 121.546 -0.721 . . . . 0.0 110.313 178.679 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 90.2 p -95.61 122.27 38.18 Favored 'General case' 0 N--CA 1.494 1.769 0 O-C-N 121.701 -0.625 . . . . 0.0 110.194 179.005 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 82.3 mt -129.21 134.38 64.0 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.924 0 O-C-N 121.717 -0.614 . . . . 0.0 109.423 179.396 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 48' ' ' VAL . . . . . 0.986 HG22 HD12 ' A' ' 34' ' ' ILE . 49.1 t -82.62 127.88 39.24 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.941 0 O-C-N 121.66 -0.65 . . . . 0.0 109.321 179.14 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 49' ' ' THR . . . . . 0.444 HG21 ' CE1' ' A' ' 28' ' ' PHE . 33.9 p -58.53 -24.98 61.93 Favored 'General case' 0 N--CA 1.505 2.285 0 O-C-N 121.649 -0.657 . . . . 0.0 112.332 -166.013 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 24.6 pttm -56.34 -22.59 31.87 Favored 'General case' 0 N--CA 1.505 2.278 0 O-C-N 121.488 -0.757 . . . . 0.0 111.239 -175.779 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 9.9 p30 -82.51 -0.53 46.98 Favored 'General case' 0 N--CA 1.5 2.042 0 O-C-N 121.563 -0.711 . . . . 0.0 111.199 176.253 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 94.1 mt -77.0 126.96 38.06 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.069 0 O-C-N 121.176 -0.953 . . . . 0.0 110.012 177.585 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 41.1 tttp -92.02 -29.84 16.38 Favored 'General case' 0 N--CA 1.494 1.765 0 O-C-N 121.809 -0.557 . . . . 0.0 109.822 170.592 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 5.3 m-20 -164.24 156.97 17.31 Favored 'General case' 0 N--CA 1.5 2.026 0 O-C-N 121.717 -0.614 . . . . 0.0 110.058 -177.923 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . 0.608 ' CD2' HG22 ' A' ' 13' ' ' VAL . 74.4 mt -132.9 148.73 52.29 Favored 'General case' 0 N--CA 1.497 1.902 0 O-C-N 121.721 -0.612 . . . . 0.0 110.429 -179.287 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 7.0 ptm180 -151.06 141.53 22.5 Favored 'General case' 0 N--CA 1.496 1.863 0 O-C-N 121.694 -0.629 . . . . 0.0 109.868 175.634 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 57' ' ' ILE . . . . . 0.538 ' HA ' HG12 ' A' ' 11' ' ' VAL . 59.1 mt -85.74 133.36 29.74 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.888 0 O-C-N 121.47 -0.769 . . . . 0.0 110.012 176.205 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . 0.456 HD11 ' HB2' ' A' ' 22' ' ' ARG . 20.8 mt -83.6 116.95 67.16 Favored Pre-proline 0 N--CA 1.498 1.962 0 O-C-N 121.606 -0.684 . . . . 0.0 109.942 -179.202 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 26.7 Cg_endo -66.16 -30.46 46.51 Favored 'Trans proline' 0 N--CA 1.49 1.283 0 O-C-N 123.322 1.17 . . . . 0.0 110.763 -178.854 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 62.3 mttm -89.56 136.62 32.93 Favored 'General case' 0 N--CA 1.497 1.91 0 O-C-N 121.587 -0.696 . . . . 0.0 110.237 -178.956 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 91.7 m-20 -137.82 170.33 16.23 Favored 'General case' 0 N--CA 1.495 1.799 0 O-C-N 121.704 -0.622 . . . . 0.0 110.143 179.634 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 54.3 mt-10 -102.71 146.52 28.1 Favored 'General case' 0 N--CA 1.495 1.798 0 O-C-N 121.624 -0.672 . . . . 0.0 110.253 179.992 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 82.1 mt -116.96 135.84 56.03 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.922 0 O-C-N 121.608 -0.683 . . . . 0.0 109.613 179.945 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 64' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -79.15 -56.31 0.84 Allowed Pre-proline 0 N--CA 1.498 1.953 0 O-C-N 121.675 -0.641 . . . . 0.0 110.432 -179.965 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 39.1 Cg_endo -73.47 140.98 30.84 Favored 'Trans proline' 0 N--CA 1.487 1.097 0 O-C-N 123.303 1.16 . . . . 0.0 110.289 -177.837 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 76.4 mttt -93.19 -68.81 0.78 Allowed 'General case' 0 N--CA 1.495 1.806 0 O-C-N 121.704 -0.622 . . . . 0.0 110.22 179.941 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 15.4 t-20 -145.59 111.37 5.51 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.625 -0.672 . . . . 0.0 110.19 -179.849 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 160.84 -35.26 0.41 Allowed Glycine 0 N--CA 1.495 2.575 0 N-CA-C 109.642 -1.383 . . . . 0.0 109.642 179.817 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 23.8 m -95.78 136.22 36.48 Favored 'General case' 0 N--CA 1.496 1.837 0 O-C-N 121.761 -0.846 . . . . 0.0 110.146 -179.484 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 60.2 mttm -116.1 148.72 39.98 Favored 'General case' 0 N--CA 1.496 1.839 0 O-C-N 121.684 -0.635 . . . . 0.0 110.144 179.674 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 46.5 m -96.7 156.77 36.23 Favored Pre-proline 0 N--CA 1.494 1.739 0 O-C-N 121.666 -0.646 . . . . 0.0 110.226 -179.749 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 27.8 Cg_endo -66.87 152.95 79.49 Favored 'Trans proline' 0 N--CA 1.49 1.281 0 O-C-N 123.714 1.376 . . . . 0.0 110.402 179.922 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 30.4 t -108.61 141.5 40.45 Favored 'General case' 0 N--CA 1.495 1.806 0 O-C-N 121.675 -0.641 . . . . 0.0 110.196 179.902 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 74' ' ' THR . . . . . 0.605 HG21 HD11 ' B' ' 248' ' ' ILE . 24.2 m -66.38 -36.93 84.09 Favored 'General case' 0 N--CA 1.5 2.048 0 O-C-N 121.68 -0.638 . . . . 0.0 110.243 -179.494 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 2.6 m-20 -103.89 125.34 50.23 Favored 'General case' 0 N--CA 1.495 1.811 0 O-C-N 121.644 -0.66 . . . . 0.0 110.217 -179.357 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 29.3 t -143.27 146.79 33.91 Favored 'General case' 0 N--CA 1.495 1.819 0 O-C-N 121.725 -0.609 . . . . 0.0 110.156 179.722 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 38.1 p -106.49 30.05 6.35 Favored 'General case' 0 N--CA 1.495 1.822 0 O-C-N 121.646 -0.659 . . . . 0.0 110.487 179.295 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 38.5 tttp -98.38 145.35 26.8 Favored 'General case' 0 N--CA 1.496 1.825 0 O-C-N 121.618 -0.676 . . . . 0.0 110.178 -179.739 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . 0.564 ' N ' HD12 ' A' ' 79' ' ' LEU . 6.0 mp -89.5 136.37 33.07 Favored 'General case' 0 N--CA 1.496 1.866 0 O-C-N 121.702 -0.624 . . . . 0.0 110.176 -179.67 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 33.9 pttt -154.1 48.08 0.62 Allowed 'General case' 0 N--CA 1.495 1.82 0 O-C-N 121.707 -0.62 . . . . 0.0 110.283 -179.756 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 85.0 p -70.56 162.69 28.38 Favored 'General case' 0 N--CA 1.499 1.995 0 O-C-N 121.614 -0.679 . . . . 0.0 110.203 -179.261 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -159.03 -45.34 0.06 Allowed 'General case' 0 N--CA 1.495 1.802 0 O-C-N 121.713 -0.617 . . . . 0.0 110.234 -179.738 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 54.7 mt-10 -100.27 168.02 10.06 Favored 'General case' 0 N--CA 1.495 1.791 0 O-C-N 121.687 -0.633 . . . . 0.0 110.177 179.532 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 9.8 t -123.13 144.26 49.45 Favored 'General case' 0 N--CA 1.497 1.922 0 O-C-N 121.685 -0.634 . . . . 0.0 110.307 -179.543 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 97.8 m-85 -70.88 -35.85 72.52 Favored 'General case' 0 N--CA 1.498 1.956 0 O-C-N 121.743 -0.598 . . . . 0.0 110.375 -178.646 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 30.4 t -111.31 145.89 38.01 Favored 'General case' 0 N--CA 1.495 1.794 0 O-C-N 121.606 -0.684 . . . . 0.0 110.316 -179.18 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 88.4 p -113.69 158.55 20.75 Favored 'General case' 0 N--CA 1.496 1.867 0 O-C-N 121.692 -0.63 . . . . 0.0 110.073 179.492 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 69.5 tttt -63.08 -41.23 99.37 Favored 'General case' 0 N--CA 1.501 2.106 0 O-C-N 121.663 -0.648 . . . . 0.0 110.441 -179.27 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 91.8 m-20 -119.3 105.05 10.94 Favored 'General case' 0 N--CA 1.496 1.844 0 O-C-N 121.66 -0.65 . . . . 0.0 110.221 179.218 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 59.5 tttt -66.22 -38.62 88.37 Favored 'General case' 0 N--CA 1.5 2.054 0 O-C-N 121.742 -0.599 . . . . 0.0 110.283 179.83 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 91' ' ' TRP . . . . . . . . . . . . . 78.7 m95 -150.07 33.13 0.67 Allowed 'General case' 0 N--CA 1.495 1.787 0 O-C-N 121.657 -0.652 . . . . 0.0 110.297 179.186 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 46.7 m -120.11 144.98 47.33 Favored 'General case' 0 N--CA 1.495 1.811 0 O-C-N 121.59 -0.694 . . . . 0.0 110.237 -179.671 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 93' ' ' MET . . . . . . . . . . . . . 65.9 mtt -94.86 -63.85 1.13 Allowed 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.665 -0.647 . . . . 0.0 110.21 179.66 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 74.6 m-20 . . . . . 0 N--CA 1.506 2.36 0 CA-C-O 118.356 -0.83 . . . . 0.0 110.961 -179.917 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' B' B ' 240' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.298 0 N-CA-C 109.582 -1.407 . . . . 0.0 109.582 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' B' B ' 241' ' ' ALA . . . . . . . . . . . . . . . -102.07 138.81 38.53 Favored 'General case' 0 N--CA 1.495 1.799 0 O-C-N 121.701 -0.882 . . . . 0.0 110.249 -179.914 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 242' ' ' THR . . . . . . . . . . . . . 24.7 m -126.81 143.45 51.25 Favored 'General case' 0 N--CA 1.495 1.818 0 O-C-N 121.685 -0.635 . . . . 0.0 110.135 179.911 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 243' ' ' THR . . . . . . . . . . . . . 39.9 p -117.76 151.12 37.94 Favored 'General case' 0 N--CA 1.496 1.871 0 O-C-N 121.667 -0.645 . . . . 0.0 110.104 179.621 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 244' ' ' LYS . . . . . . . . . . . . . 59.6 mttm -100.77 -34.54 9.79 Favored 'General case' 0 N--CA 1.494 1.767 0 O-C-N 121.614 -0.678 . . . . 0.0 110.251 -179.73 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 245' ' ' GLU . . . . . . . . . . . . . 42.2 tt0 -102.52 128.06 49.33 Favored 'General case' 0 N--CA 1.495 1.795 0 O-C-N 121.675 -0.64 . . . . 0.0 110.195 -178.897 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 246' ' ' LYS . . . . . . . . . . . . . 81.1 mttt -110.03 -47.33 3.34 Favored 'General case' 0 N--CA 1.495 1.808 0 O-C-N 121.666 -0.646 . . . . 0.0 110.244 179.174 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 247' ' ' ASN . . . . . . . . . . . . . 17.4 t-20 -131.94 33.38 3.95 Favored 'General case' 0 N--CA 1.494 1.774 0 O-C-N 121.692 -0.63 . . . . 0.0 110.224 -179.358 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 248' ' ' ILE . . . . . 0.605 HD11 HG21 ' A' ' 74' ' ' THR . 79.7 mt 52.75 93.23 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.507 2.393 0 O-C-N 121.581 -0.699 . . . . 0.0 110.556 -179.569 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 249' ' ' SER . . . . . . . . . . . . . 89.4 p -130.1 107.11 9.07 Favored 'General case' 0 N--CA 1.495 1.793 0 O-C-N 121.638 -0.663 . . . . 0.0 110.292 179.603 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 250' ' ' VAL . . . . . . . . . . . . . 12.3 p -154.07 139.51 10.86 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.807 0 O-C-N 121.776 -0.578 . . . . 0.0 109.982 178.8 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 251' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER 51.24 -167.26 0.04 OUTLIER 'General case' 0 N--CA 1.507 2.424 0 O-C-N 121.584 -0.698 . . . . 0.0 110.773 -178.793 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 252' ' ' VAL . . . . . 0.449 HG12 ' N ' ' B' ' 253' ' ' ASP . 24.1 t 58.56 168.6 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.509 2.503 0 O-C-N 121.614 -0.679 . . . . 0.0 110.404 179.14 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 253' ' ' ASP . . . . . 0.449 ' N ' HG12 ' B' ' 252' ' ' VAL . 4.3 m-20 54.73 57.77 5.42 Favored 'General case' 0 N--CA 1.507 2.384 0 O-C-N 121.333 -0.855 . . . . 0.0 110.779 179.249 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 254' ' ' ALA . . . . . . . . . . . . . . . -65.56 -18.47 65.35 Favored 'General case' 0 N--CA 1.501 2.09 0 O-C-N 121.49 -0.756 . . . . 0.0 110.885 178.467 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 255' ' ' ASP . . . . . . . . . . . . . 26.1 t0 -70.45 -26.0 63.45 Favored 'General case' 0 N--CA 1.499 1.989 0 O-C-N 121.41 -0.806 . . . . 0.0 110.463 179.335 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 256' ' ' ALA . . . . . . . . . . . . . . . -61.96 -30.5 70.96 Favored 'General case' 0 N--CA 1.502 2.14 0 O-C-N 121.413 -0.805 . . . . 0.0 110.432 178.951 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 257' ' ' SER . . . . . 0.463 ' HA ' HD12 ' B' ' 260' ' ' LEU . 58.4 m -54.75 -35.0 63.27 Favored 'General case' 0 N--CA 1.502 2.173 0 O-C-N 121.538 -0.726 . . . . 0.0 110.465 176.641 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 258' ' ' SER . . . . . . . . . . . . . 25.4 m -67.75 -33.19 74.36 Favored 'General case' 0 N--CA 1.498 1.936 0 O-C-N 121.827 -0.545 . . . . 0.0 110.204 -179.684 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 259' ' ' GLN . . . . . . . . . . . . . 98.4 mt-30 -64.76 -33.51 76.15 Favored 'General case' 0 N--CA 1.5 2.05 0 O-C-N 121.632 -0.668 . . . . 0.0 110.323 178.883 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 260' ' ' LEU . . . . . 0.51 ' HA ' HD12 ' B' ' 263' ' ' LEU . 82.2 mt -65.38 -40.05 93.01 Favored 'General case' 0 N--CA 1.5 2.071 0 O-C-N 121.636 -0.665 . . . . 0.0 110.181 178.808 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 261' ' ' LEU . . . . . . . . . . . . . 25.5 tp -69.15 -39.93 78.5 Favored 'General case' 0 N--CA 1.499 2.015 0 O-C-N 121.671 -0.643 . . . . 0.0 109.862 176.634 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 262' ' ' SER . . . . . . . . . . . . . 22.7 m -62.55 -37.14 84.98 Favored 'General case' 0 N--CA 1.502 2.136 0 O-C-N 121.74 -0.6 . . . . 0.0 110.493 177.853 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 263' ' ' LEU . . . . . 0.51 HD12 ' HA ' ' B' ' 260' ' ' LEU . 30.2 mt -64.4 -40.77 96.45 Favored 'General case' 0 N--CA 1.501 2.085 0 O-C-N 121.649 -0.657 . . . . 0.0 110.315 179.46 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 264' ' ' LEU . . . . . 0.4 ' CD1' HD11 ' A' ' 55' ' ' LEU . 84.6 mt -62.79 -39.01 92.94 Favored 'General case' 0 N--CA 1.5 2.063 0 O-C-N 121.627 -0.67 . . . . 0.0 110.466 178.874 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 265' ' ' LYS . . . . . . . . . . . . . 73.6 mttt -76.68 -38.86 53.72 Favored 'General case' 0 N--CA 1.498 1.942 0 O-C-N 121.746 -0.596 . . . . 0.0 110.163 -179.753 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 266' ' ' SER . . . . . . . . . . . . . 1.6 m 55.93 -81.78 0.01 OUTLIER 'General case' 0 N--CA 1.506 2.347 0 O-C-N 121.843 -0.536 . . . . 0.0 111.211 -177.151 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 267' ' ' SER . . . . . . . . . . . . . 49.6 m -113.7 157.79 21.74 Favored 'General case' 0 N--CA 1.494 1.774 0 O-C-N 121.237 -0.915 . . . . 0.0 110.167 -179.79 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 268' ' ' THR . . . . . 0.479 ' O ' HG22 ' B' ' 268' ' ' THR . 19.5 m -98.5 29.7 3.54 Favored 'General case' 0 N--CA 1.497 1.909 0 O-C-N 121.726 -0.609 . . . . 0.0 110.558 -179.455 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 269' ' ' ALA . . . . . . . . . . . . . . . 48.46 58.44 17.73 Favored Pre-proline 0 N--CA 1.505 2.319 0 O-C-N 121.593 -0.692 . . . . 0.0 111.364 -179.101 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 270' ' ' PRO . . . . . 0.475 ' O ' ' HB2' ' B' ' 274' ' ' ALA . 26.7 Cg_endo -66.72 -33.79 33.79 Favored 'Trans proline' 0 N--CA 1.488 1.204 0 O-C-N 123.402 1.211 . . . . 0.0 110.373 178.472 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 271' ' ' SER . . . . . . . . . . . . . 87.8 p -70.2 -29.14 65.92 Favored 'General case' 0 N--CA 1.498 1.97 0 O-C-N 121.691 -0.631 . . . . 0.0 110.547 178.803 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 272' ' ' ASP . . . . . . . . . . . . . 20.5 t70 -80.89 122.71 27.56 Favored 'General case' 0 N--CA 1.497 1.915 0 O-C-N 121.586 -0.696 . . . . 0.0 110.286 -178.633 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 273' ' ' LEU . . . . . . . . . . . . . 84.4 mt 56.69 -84.32 0.02 OUTLIER 'General case' 0 N--CA 1.505 2.304 0 O-C-N 121.955 -0.466 . . . . 0.0 111.269 179.774 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 274' ' ' ALA . . . . . 0.475 ' HB2' ' O ' ' B' ' 270' ' ' PRO . . . 49.89 93.77 0.01 OUTLIER 'General case' 0 N--CA 1.506 2.362 0 O-C-N 121.165 -0.959 . . . . 0.0 111.201 -177.006 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 275' ' ' THR . . . . . . . . . . . . . 7.6 t -112.54 154.33 44.67 Favored Pre-proline 0 N--CA 1.498 1.967 0 O-C-N 121.578 -0.701 . . . . 0.0 110.241 -179.572 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 276' ' ' PRO . . . . . . . . . . . . . 22.7 Cg_exo -61.1 138.17 76.33 Favored 'Trans proline' 0 N--CA 1.491 1.329 0 O-C-N 123.458 1.241 . . . . 0.0 110.703 179.736 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 277' ' ' GLN . . . . . . . . . . . . . 28.6 tt0 -133.19 89.64 32.63 Favored Pre-proline 0 N--CA 1.496 1.829 0 O-C-N 121.693 -0.629 . . . . 0.0 110.124 179.72 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 278' ' ' PRO . . . . . . . . . . . . . 22.7 Cg_endo -65.64 144.79 79.77 Favored 'Trans proline' 0 N--CA 1.489 1.235 0 O-C-N 123.56 1.295 . . . . 0.0 110.494 -179.933 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 279' ' ' SER . . . . . . . . . . . . . 95.7 p -132.95 160.61 36.59 Favored 'General case' 0 N--CA 1.495 1.791 0 O-C-N 121.737 -0.602 . . . . 0.0 110.235 -179.361 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 280' ' ' THR . . . . . . . . . . . . . 40.9 p -94.76 165.59 12.41 Favored 'General case' 0 N--CA 1.496 1.858 0 O-C-N 121.698 -0.626 . . . . 0.0 110.208 -179.936 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 281' ' ' PHE . . . . . . . . . . . . . 30.1 m-85 -119.09 89.75 39.98 Favored Pre-proline 0 N--CA 1.496 1.841 0 O-C-N 121.682 -0.636 . . . . 0.0 110.117 -179.681 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 282' ' ' PRO . . . . . . . . . . . . . 21.2 Cg_endo -65.3 -31.15 53.44 Favored 'Trans proline' 0 N--CA 1.49 1.318 0 O-C-N 123.525 1.276 . . . . 0.0 110.574 179.964 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 283' ' ' GLN . . . . . . . . . . . . . 37.3 mt-30 -95.24 156.46 37.72 Favored Pre-proline 0 N--CA 1.496 1.826 0 O-C-N 121.598 -0.689 . . . . 0.0 110.13 179.236 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 284' ' ' PRO . . . . . . . . . . . . . 30.1 Cg_endo -68.19 152.32 76.2 Favored 'Trans proline' 0 N--CA 1.487 1.099 0 O-C-N 123.555 1.292 . . . . 0.0 110.264 -179.868 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 285' ' ' PRO . . . . . . . . . . . . . 30.1 Cg_endo -68.06 132.55 26.5 Favored 'Trans proline' 0 N--CA 1.488 1.182 0 O-C-N 123.591 1.311 . . . . 0.0 110.28 -179.559 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 286' ' ' VAL . . . . . . . . . . . . . 26.9 m -134.35 149.12 29.74 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.032 0 O-C-N 121.639 -0.663 . . . . 0.0 110.208 179.321 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 287' ' ' GLU . . . . . . . . . . . . . 74.7 mm-40 -68.61 -34.99 76.71 Favored 'General case' 0 N--CA 1.499 2.019 0 O-C-N 121.706 -0.621 . . . . 0.0 110.179 179.408 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 288' ' ' SER . . . . . . . . . . . . . 10.4 m 52.91 -178.77 0.02 OUTLIER 'General case' 0 N--CA 1.506 2.357 0 O-C-N 121.671 -0.643 . . . . 0.0 111.158 -179.906 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 289' ' ' HIS . . . . . . . . . . . . . 57.0 t-80 -141.2 138.58 33.44 Favored 'General case' 0 N--CA 1.495 1.793 0 O-C-N 121.597 -0.689 . . . . 0.0 110.138 179.436 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 290' ' ' SER . . . . . . . . . . . . . 91.9 p -123.38 154.4 39.02 Favored 'General case' 0 N--CA 1.495 1.821 0 O-C-N 121.658 -0.651 . . . . 0.0 110.194 179.87 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 291' ' ' SER . . . . . . . . . . . . . 17.2 m . . . . . 0 N--CA 1.496 1.83 0 CA-C-O 117.941 -1.028 . . . . 0.0 110.206 179.827 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' -1' ' ' MET . . . . . . . . . . . . . 61.4 mtt . . . . . 0 N--CA 1.493 1.704 0 CA-C-O 121.012 0.435 . . . . 0.0 110.148 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 0' ' ' GLY . . . . . . . . . . . . . . . -159.8 119.82 0.92 Allowed Glycine 0 N--CA 1.493 2.474 0 N-CA-C 109.542 -1.423 . . . . 0.0 109.542 179.699 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 6.3 mmm -128.93 163.08 26.07 Favored 'General case' 0 N--CA 1.495 1.818 0 O-C-N 121.64 -0.918 . . . . 0.0 110.166 -179.703 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 70.4 m -100.9 166.28 10.92 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.606 -0.684 . . . . 0.0 110.179 -179.828 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 3' ' ' VAL . . . . . 0.443 HG12 ' CE1' ' A' ' 7' ' ' TYR . 63.2 t -66.35 -27.85 41.75 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.093 0 O-C-N 121.644 -0.66 . . . . 0.0 110.188 -179.467 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -55.06 -30.98 60.75 Favored 'General case' 0 N--CA 1.505 2.275 0 O-C-N 121.394 -0.816 . . . . 0.0 110.439 -179.214 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 74.3 m-20 -68.57 -30.8 69.65 Favored 'General case' 0 N--CA 1.499 1.996 0 O-C-N 121.81 -0.556 . . . . 0.0 110.226 174.776 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 96.7 m-85 -95.8 10.15 38.06 Favored 'General case' 0 N--CA 1.496 1.859 0 O-C-N 121.574 -0.704 . . . . 0.0 111.524 -178.589 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 7' ' ' TYR . . . . . 0.443 ' CE1' HG12 ' A' ' 3' ' ' VAL . 4.0 m-30 -67.34 139.43 57.22 Favored 'General case' 0 N--CA 1.504 2.228 0 O-C-N 121.211 -0.931 . . . . 0.0 109.964 174.123 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 82.06 3.14 90.67 Favored Glycine 0 N--CA 1.497 2.727 0 N-CA-C 110.56 -1.016 . . . . 0.0 110.56 -176.595 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 73.9 m -78.12 135.74 37.74 Favored 'General case' 0 N--CA 1.498 1.929 0 O-C-N 121.114 -1.227 . . . . 0.0 110.524 175.943 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 14.0 t-20 -83.92 117.43 23.34 Favored 'General case' 0 N--CA 1.497 1.91 0 O-C-N 121.6 -0.687 . . . . 0.0 109.588 172.169 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . 0.546 HG12 ' HA ' ' A' ' 57' ' ' ILE . 35.4 m -142.29 164.39 17.9 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.691 0 N-CA-C 109.319 -0.622 . . . . 0.0 109.319 -179.275 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . 0.438 ' HB2' HD21 ' A' ' 58' ' ' LEU . 44.8 tt0 -109.36 129.04 55.54 Favored 'General case' 0 N--CA 1.492 1.666 0 C-N-CA 119.739 -0.785 . . . . 0.0 109.914 177.453 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . 0.551 HG22 ' CD2' ' A' ' 55' ' ' LEU . 58.3 t -106.74 125.14 62.69 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.697 0 O-C-N 121.575 -0.703 . . . . 0.0 109.873 -179.566 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 30.2 tp -95.85 128.43 42.72 Favored 'General case' 0 N--CA 1.494 1.728 0 N-CA-C 109.272 -0.64 . . . . 0.0 109.272 175.124 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 84.8 mt -98.28 166.31 11.45 Favored 'General case' 0 N--CA 1.496 1.846 0 O-C-N 121.683 -0.636 . . . . 0.0 111.047 -173.304 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 24.3 p30 -58.86 -21.66 57.55 Favored 'General case' 0 N--CA 1.504 2.271 0 O-C-N 121.769 -0.582 . . . . 0.0 111.64 -176.833 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 43.5 p-10 -92.64 23.4 4.09 Favored 'General case' 0 N--CA 1.498 1.953 0 O-C-N 121.547 -0.72 . . . . 0.0 110.905 -175.725 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 74.3 m-20 58.5 27.1 15.12 Favored 'General case' 0 N--CA 1.506 2.339 0 O-C-N 121.406 -0.809 . . . . 0.0 110.65 176.306 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 51.1 m -106.51 145.85 31.32 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.587 -0.696 . . . . 0.0 109.55 172.531 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 49.7 mttp -109.7 150.26 28.55 Favored 'General case' 0 N--CA 1.494 1.759 0 O-C-N 121.625 -0.672 . . . . 0.0 110.573 -175.531 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -152.97 150.37 29.16 Favored 'General case' 0 N--CA 1.496 1.861 0 O-C-N 121.682 -0.636 . . . . 0.0 110.111 176.05 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . 0.515 ' O ' HD13 ' A' ' 39' ' ' LEU . 5.8 ptm180 -144.06 140.26 29.4 Favored 'General case' 0 N--CA 1.498 1.934 0 O-C-N 121.614 -0.679 . . . . 0.0 110.509 179.407 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -171.8 171.4 44.09 Favored Glycine 0 N--CA 1.496 2.678 0 N-CA-C 109.085 -1.606 . . . . 0.0 109.085 -176.051 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 60.4 t -94.59 121.57 45.31 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.91 0 O-C-N 121.511 -0.993 . . . . 0.0 109.357 -177.338 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 25' ' ' ILE . . . . . 0.665 ' HA ' HD23 ' A' ' 37' ' ' LEU . 91.9 mt -65.09 144.04 15.19 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.066 0 O-C-N 121.636 -0.665 . . . . 0.0 110.65 -171.332 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . 0.611 HG21 ' HB2' ' A' ' 38' ' ' ARG . 7.0 p -121.23 -27.56 4.86 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.78 -0.575 . . . . 0.0 111.133 178.807 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 27' ' ' ASN . . . . . 0.5 ' O ' HD12 ' A' ' 35' ' ' LEU . 8.0 t30 -161.56 160.94 29.59 Favored 'General case' 0 N--CA 1.5 2.044 0 C-N-CA 118.985 -1.086 . . . . 0.0 111.904 -178.547 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 28' ' ' PHE . . . . . 0.577 ' HE1' HG21 ' A' ' 49' ' ' THR . 84.5 t80 -150.15 125.09 9.9 Favored 'General case' 0 N--CA 1.498 1.934 0 N-CA-C 108.87 -0.789 . . . . 0.0 108.87 170.366 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 18.0 t70 -99.44 130.31 45.69 Favored 'General case' 0 N--CA 1.491 1.591 0 N-CA-C 108.986 -0.746 . . . . 0.0 108.986 -176.449 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 20.1 m -69.75 -50.88 39.11 Favored 'General case' 0 N--CA 1.498 1.935 0 C-N-CA 120.004 -0.678 . . . . 0.0 110.449 -177.142 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 23.2 m -59.88 -41.95 92.71 Favored 'General case' 0 N--CA 1.501 2.104 0 O-C-N 121.597 -0.689 . . . . 0.0 110.781 -174.771 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 29.7 m120 -103.93 -10.13 18.38 Favored 'General case' 0 N--CA 1.497 1.915 0 O-C-N 121.676 -0.64 . . . . 0.0 111.644 -177.766 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 1.8 m 49.94 67.31 0.93 Allowed 'General case' 0 N--CA 1.508 2.442 0 O-C-N 121.046 -1.034 . . . . 0.0 111.037 -175.003 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 34' ' ' ILE . . . . . 1.107 HD12 HG22 ' A' ' 48' ' ' VAL . 47.7 mm -126.26 127.39 70.66 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.089 0 O-C-N 121.51 -0.744 . . . . 0.0 109.46 -175.864 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.5 HD12 ' O ' ' A' ' 27' ' ' ASN . 11.2 tp -115.89 120.59 39.7 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.742 -0.599 . . . . 0.0 110.511 -170.832 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 58.6 mt-30 -91.55 134.59 34.53 Favored 'General case' 0 N--CA 1.492 1.65 0 N-CA-C 109.481 -0.563 . . . . 0.0 109.481 174.639 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 0.665 HD23 ' HA ' ' A' ' 25' ' ' ILE . 89.4 mt -117.87 123.94 47.11 Favored 'General case' 0 N--CA 1.497 1.895 0 C-N-CA 120.406 -0.518 . . . . 0.0 109.929 174.641 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 38' ' ' ARG . . . . . 0.611 ' HB2' HG21 ' A' ' 26' ' ' THR . 57.7 ttt85 -96.34 107.21 19.54 Favored 'General case' 0 N--CA 1.497 1.914 0 O-C-N 121.596 -0.69 . . . . 0.0 109.736 175.79 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.515 HD13 ' O ' ' A' ' 22' ' ' ARG . 18.4 tp -85.36 153.58 22.44 Favored 'General case' 0 N--CA 1.495 1.811 0 O-C-N 121.693 -0.629 . . . . 0.0 111.085 -173.65 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -62.99 -9.76 11.24 Favored 'General case' 0 N--CA 1.503 2.186 0 O-C-N 122.031 -0.418 . . . . 0.0 112.045 -170.475 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 53.6 p-10 -85.12 28.94 0.68 Allowed 'General case' 0 N--CA 1.499 2.011 0 O-C-N 121.024 -1.048 . . . . 0.0 111.049 175.064 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 74.4 m-20 57.95 29.59 17.88 Favored 'General case' 0 N--CA 1.504 2.252 0 O-C-N 121.112 -0.992 . . . . 0.0 110.404 176.619 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 28.2 m -119.71 137.9 53.63 Favored 'General case' 0 N--CA 1.496 1.852 0 O-C-N 121.518 -0.739 . . . . 0.0 110.306 178.604 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 9.8 t -97.86 150.07 21.69 Favored 'General case' 0 N--CA 1.495 1.79 0 O-C-N 121.728 -0.608 . . . . 0.0 110.327 176.608 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 19.9 mtpp -148.93 122.25 9.01 Favored 'General case' 0 N--CA 1.495 1.815 0 O-C-N 121.714 -0.616 . . . . 0.0 110.423 178.207 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 90.6 p -96.37 123.79 40.14 Favored 'General case' 0 N--CA 1.496 1.85 0 O-C-N 121.815 -0.553 . . . . 0.0 110.202 179.802 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 82.0 mt -129.28 134.23 64.18 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.858 0 O-C-N 121.673 -0.642 . . . . 0.0 109.269 179.111 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 48' ' ' VAL . . . . . 1.107 HG22 HD12 ' A' ' 34' ' ' ILE . 57.8 t -81.93 127.61 39.46 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.9 0 C-N-CA 120.036 -0.666 . . . . 0.0 109.306 179.989 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 49' ' ' THR . . . . . 0.577 HG21 ' HE1' ' A' ' 28' ' ' PHE . 39.3 p -59.91 -24.79 64.6 Favored 'General case' 0 N--CA 1.504 2.241 0 O-C-N 121.582 -0.698 . . . . 0.0 112.054 -170.415 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 32.3 ttpt -56.25 -23.29 35.12 Favored 'General case' 0 N--CA 1.503 2.214 0 O-C-N 121.43 -0.794 . . . . 0.0 111.138 -177.037 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 48.5 p30 -84.16 1.95 41.94 Favored 'General case' 0 N--CA 1.498 1.933 0 O-C-N 121.463 -0.773 . . . . 0.0 111.342 176.61 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 97.4 mt -75.55 127.84 37.09 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.145 0 O-C-N 121.154 -0.966 . . . . 0.0 110.084 178.66 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 52.3 tttm -92.6 -30.4 15.64 Favored 'General case' 0 N--CA 1.494 1.77 0 O-C-N 121.843 -0.536 . . . . 0.0 109.687 169.379 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 5.1 m-20 -163.9 158.04 19.39 Favored 'General case' 0 N--CA 1.5 2.038 0 O-C-N 121.785 -0.572 . . . . 0.0 109.994 -178.304 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . 0.551 ' CD2' HG22 ' A' ' 13' ' ' VAL . 83.4 mt -132.94 149.59 52.23 Favored 'General case' 0 N--CA 1.496 1.863 0 O-C-N 121.656 -0.653 . . . . 0.0 110.38 -179.201 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 20.1 ptp180 -151.51 144.84 24.76 Favored 'General case' 0 N--CA 1.497 1.895 0 O-C-N 121.705 -0.622 . . . . 0.0 110.16 175.813 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 57' ' ' ILE . . . . . 0.546 ' HA ' HG12 ' A' ' 11' ' ' VAL . 66.4 mt -86.59 133.41 29.91 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.88 0 O-C-N 121.661 -0.649 . . . . 0.0 110.042 174.221 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . 0.448 HD11 ' HB2' ' A' ' 22' ' ' ARG . 16.6 mt -83.45 116.97 67.19 Favored Pre-proline 0 N--CA 1.498 1.935 0 O-C-N 121.64 -0.662 . . . . 0.0 109.894 -179.092 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 26.2 Cg_endo -66.55 141.97 62.98 Favored 'Trans proline' 0 N--CA 1.488 1.186 0 O-C-N 123.286 1.15 . . . . 0.0 110.413 179.648 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 99.2 mttt -97.46 149.51 22.08 Favored 'General case' 0 N--CA 1.495 1.786 0 O-C-N 121.668 -0.645 . . . . 0.0 110.188 179.949 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 25.2 p30 -115.49 154.16 29.81 Favored 'General case' 0 N--CA 1.498 1.926 0 O-C-N 121.657 -0.652 . . . . 0.0 110.373 -179.869 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 12.5 pt-20 -161.86 40.05 0.13 Allowed 'General case' 0 N--CA 1.497 1.905 0 O-C-N 121.718 -0.614 . . . . 0.0 110.319 179.697 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 81.9 mt -111.68 136.83 46.58 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.882 0 O-C-N 121.587 -0.696 . . . . 0.0 109.705 -179.101 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 64' ' ' MET . . . . . . . . . . . . . 51.1 mtm 52.12 85.03 0.2 Allowed Pre-proline 0 N--CA 1.505 2.316 0 O-C-N 121.661 -0.65 . . . . 0.0 111.123 -179.871 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 28.4 Cg_endo -67.35 150.17 80.98 Favored 'Trans proline' 0 N--CA 1.488 1.202 0 O-C-N 123.626 1.329 . . . . 0.0 110.365 179.519 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 51.5 tttm -63.73 -35.17 79.69 Favored 'General case' 0 N--CA 1.501 2.094 0 O-C-N 121.664 -0.648 . . . . 0.0 110.4 179.941 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 23.7 p30 -79.0 173.0 13.02 Favored 'General case' 0 N--CA 1.499 1.993 0 O-C-N 121.66 -0.65 . . . . 0.0 110.315 179.97 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 123.23 -41.9 1.7 Allowed Glycine 0 N--CA 1.494 2.548 0 N-CA-C 109.544 -1.422 . . . . 0.0 109.544 -179.81 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 24.2 m -66.51 -37.25 84.65 Favored 'General case' 0 N--CA 1.5 2.063 0 O-C-N 121.703 -0.88 . . . . 0.0 110.13 179.193 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 62.4 mttm 53.4 42.61 32.0 Favored 'General case' 0 N--CA 1.506 2.336 0 O-C-N 121.607 -0.683 . . . . 0.0 110.914 179.144 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 1.8 t -77.93 158.86 77.19 Favored Pre-proline 0 N--CA 1.497 1.916 0 O-C-N 121.601 -0.687 . . . . 0.0 110.151 179.708 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 22.3 Cg_exo -61.19 139.07 81.67 Favored 'Trans proline' 0 N--CA 1.491 1.368 0 O-C-N 123.612 1.322 . . . . 0.0 110.751 -179.904 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 25.9 t -144.79 149.25 35.15 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.677 -0.64 . . . . 0.0 110.202 179.844 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 9.7 t -132.6 154.22 50.27 Favored 'General case' 0 N--CA 1.497 1.876 0 O-C-N 121.627 -0.671 . . . . 0.0 110.337 179.662 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 38.7 p-10 -126.82 31.47 5.3 Favored 'General case' 0 N--CA 1.496 1.861 0 O-C-N 121.647 -0.658 . . . . 0.0 110.565 -179.81 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 50.9 m -120.54 144.66 47.94 Favored 'General case' 0 N--CA 1.495 1.796 0 O-C-N 121.602 -0.686 . . . . 0.0 110.23 179.836 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 22.4 m -88.88 -60.9 1.83 Allowed 'General case' 0 N--CA 1.497 1.907 0 O-C-N 121.81 -0.556 . . . . 0.0 110.201 179.973 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 55.9 mttm -103.13 146.05 28.98 Favored 'General case' 0 N--CA 1.495 1.82 0 O-C-N 121.777 -0.577 . . . . 0.0 110.19 -179.644 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -100.31 -172.37 2.2 Favored 'General case' 0 N--CA 1.496 1.837 0 O-C-N 121.66 -0.65 . . . . 0.0 109.816 179.586 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 23.6 ttpp -63.05 -35.95 81.95 Favored 'General case' 0 N--CA 1.501 2.125 0 O-C-N 121.583 -0.698 . . . . 0.0 110.31 179.985 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 29.2 t -117.09 145.18 43.93 Favored 'General case' 0 N--CA 1.495 1.783 0 O-C-N 121.724 -0.61 . . . . 0.0 110.271 179.858 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -136.34 154.85 50.73 Favored 'General case' 0 N--CA 1.496 1.858 0 O-C-N 121.709 -0.619 . . . . 0.0 110.102 179.882 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 74.8 mm-40 -98.54 133.15 43.31 Favored 'General case' 0 N--CA 1.495 1.799 0 O-C-N 121.68 -0.638 . . . . 0.0 110.286 -179.303 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 23.4 m -68.89 -34.41 75.38 Favored 'General case' 0 N--CA 1.499 1.988 0 O-C-N 121.695 -0.628 . . . . 0.0 110.188 179.401 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 97.2 m-85 -66.62 158.54 29.66 Favored 'General case' 0 N--CA 1.5 2.05 0 O-C-N 121.7 -0.625 . . . . 0.0 110.326 -178.694 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 25.8 t -114.7 153.35 30.41 Favored 'General case' 0 N--CA 1.495 1.798 0 O-C-N 121.742 -0.599 . . . . 0.0 110.142 179.931 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 50.7 m -65.7 146.5 54.72 Favored 'General case' 0 N--CA 1.5 2.07 0 O-C-N 121.625 -0.672 . . . . 0.0 110.375 -179.007 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 97.5 mttt -66.58 -33.91 76.71 Favored 'General case' 0 N--CA 1.499 2.023 0 O-C-N 121.669 -0.644 . . . . 0.0 110.408 -179.343 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 35.9 t30 -98.11 107.14 19.54 Favored 'General case' 0 N--CA 1.495 1.79 0 O-C-N 121.684 -0.635 . . . . 0.0 110.306 -179.057 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 53.4 pttt -133.17 -39.31 0.94 Allowed 'General case' 0 N--CA 1.498 1.96 0 O-C-N 121.714 -0.617 . . . . 0.0 110.689 179.297 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 91' ' ' TRP . . . . . . . . . . . . . 10.8 m0 -95.06 145.94 24.62 Favored 'General case' 0 N--CA 1.495 1.776 0 O-C-N 121.466 -0.771 . . . . 0.0 110.262 178.753 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 95.9 p -138.21 160.65 38.87 Favored 'General case' 0 N--CA 1.496 1.828 0 O-C-N 121.718 -0.614 . . . . 0.0 110.145 179.476 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 93' ' ' MET . . . . . . . . . . . . . 74.5 mtm -116.41 155.27 28.82 Favored 'General case' 0 N--CA 1.496 1.848 0 O-C-N 121.657 -0.652 . . . . 0.0 110.242 -179.631 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 10.2 p-10 . . . . . 0 N--CA 1.498 1.946 0 CA-C-O 118.044 -0.979 . . . . 0.0 110.291 179.867 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' B' B ' 240' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.286 0 N-CA-C 109.596 -1.402 . . . . 0.0 109.596 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' B' B ' 241' ' ' ALA . . . . . . . . . . . . . . . -143.0 153.31 42.86 Favored 'General case' 0 N--CA 1.494 1.766 0 O-C-N 121.708 -0.877 . . . . 0.0 110.269 179.959 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 242' ' ' THR . . . . . . . . . . . . . 36.8 p -110.77 31.79 5.73 Favored 'General case' 0 N--CA 1.496 1.861 0 O-C-N 121.674 -0.641 . . . . 0.0 110.344 -179.76 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 243' ' ' THR . . . . . . . . . . . . . 24.0 m -105.5 139.19 40.49 Favored 'General case' 0 N--CA 1.495 1.813 0 O-C-N 121.566 -0.709 . . . . 0.0 110.218 -179.456 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 244' ' ' LYS . . . . . . . . . . . . . 5.2 ttpm? -114.87 137.52 51.87 Favored 'General case' 0 N--CA 1.496 1.831 0 O-C-N 121.709 -0.619 . . . . 0.0 110.127 -179.893 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 245' ' ' GLU . . . . . . . . . . . . . 46.4 tt0 -130.97 70.48 1.46 Allowed 'General case' 0 N--CA 1.495 1.794 0 O-C-N 121.65 -0.656 . . . . 0.0 110.195 -179.767 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 246' ' ' LYS . . . . . . . . . . . . . 52.3 mttp 53.5 45.51 28.08 Favored 'General case' 0 N--CA 1.505 2.317 0 O-C-N 121.407 -0.808 . . . . 0.0 111.009 178.343 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 247' ' ' ASN . . . . . . . . . . . . . 36.0 t30 -62.83 -38.68 91.72 Favored 'General case' 0 N--CA 1.501 2.12 0 O-C-N 121.549 -0.719 . . . . 0.0 110.506 179.98 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 248' ' ' ILE . . . . . . . . . . . . . 82.0 mt 52.78 78.88 0.07 OUTLIER 'Isoleucine or valine' 0 N--CA 1.507 2.4 0 O-C-N 121.578 -0.701 . . . . 0.0 110.503 179.816 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 249' ' ' SER . . . . . . . . . . . . . 23.1 t -66.07 -36.19 82.54 Favored 'General case' 0 N--CA 1.5 2.046 0 O-C-N 121.536 -0.727 . . . . 0.0 110.332 179.69 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 250' ' ' VAL . . . . . . . . . . . . . 12.4 p -89.89 144.89 8.17 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.914 0 O-C-N 121.759 -0.588 . . . . 0.0 110.289 -179.903 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 251' ' ' ASP . . . . . . . . . . . . . 74.6 m-20 51.79 -174.39 0.02 OUTLIER 'General case' 0 N--CA 1.507 2.389 0 O-C-N 121.707 -0.621 . . . . 0.0 111.176 179.571 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 252' ' ' VAL . . . . . . . . . . . . . 61.5 t 52.0 84.51 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.507 2.412 0 O-C-N 121.633 -0.667 . . . . 0.0 110.603 179.975 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 253' ' ' ASP . . . . . . . . . . . . . 74.7 m-20 -81.77 111.05 17.65 Favored 'General case' 0 N--CA 1.498 1.936 0 O-C-N 121.659 -0.651 . . . . 0.0 110.191 179.659 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 254' ' ' ALA . . . . . . . . . . . . . . . -67.52 -34.03 76.29 Favored 'General case' 0 N--CA 1.498 1.971 0 O-C-N 121.643 -0.661 . . . . 0.0 110.28 179.308 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 255' ' ' ASP . . . . . . . . . . . . . 11.7 p-10 -72.64 -27.28 62.04 Favored 'General case' 0 N--CA 1.5 2.029 0 O-C-N 121.746 -0.597 . . . . 0.0 110.693 -179.887 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 256' ' ' ALA . . . . . . . . . . . . . . . -63.37 -33.9 76.55 Favored 'General case' 0 N--CA 1.501 2.111 0 O-C-N 121.437 -0.789 . . . . 0.0 110.347 179.024 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 257' ' ' SER . . . . . . . . . . . . . 59.2 m -56.62 -39.8 74.25 Favored 'General case' 0 N--CA 1.502 2.157 0 O-C-N 121.667 -0.646 . . . . 0.0 110.594 179.365 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 258' ' ' SER . . . . . . . . . . . . . 68.9 p -69.93 -31.86 69.83 Favored 'General case' 0 N--CA 1.498 1.96 0 C-N-CA 120.248 -0.581 . . . . 0.0 110.302 -178.983 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 259' ' ' GLN . . . . . . . . . . . . . 98.8 mt-30 -64.61 -37.02 86.13 Favored 'General case' 0 N--CA 1.501 2.081 0 O-C-N 121.54 -0.725 . . . . 0.0 110.39 -179.888 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 260' ' ' LEU . . . . . 0.491 ' HA ' HD12 ' B' ' 263' ' ' LEU . 47.1 mt -66.24 -42.22 88.92 Favored 'General case' 0 N--CA 1.501 2.075 0 O-C-N 121.699 -0.625 . . . . 0.0 110.199 179.637 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 261' ' ' LEU . . . . . . . . . . . . . 21.5 tp -70.57 -38.05 74.05 Favored 'General case' 0 N--CA 1.497 1.887 0 O-C-N 121.704 -0.623 . . . . 0.0 109.762 176.561 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 262' ' ' SER . . . . . . . . . . . . . 66.6 m -62.51 -36.04 81.3 Favored 'General case' 0 N--CA 1.501 2.124 0 O-C-N 121.733 -0.604 . . . . 0.0 110.444 176.724 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 263' ' ' LEU . . . . . 0.491 HD12 ' HA ' ' B' ' 260' ' ' LEU . 22.5 mt -64.59 -41.17 96.42 Favored 'General case' 0 N--CA 1.501 2.098 0 O-C-N 121.669 -0.644 . . . . 0.0 110.241 179.803 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 264' ' ' LEU . . . . . 0.418 ' CD1' HD11 ' A' ' 55' ' ' LEU . 85.3 mt -62.28 -37.73 86.62 Favored 'General case' 0 N--CA 1.503 2.182 0 O-C-N 121.667 -0.646 . . . . 0.0 110.353 177.317 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 265' ' ' LYS . . . . . . . . . . . . . 49.0 tttm -76.42 -35.81 58.34 Favored 'General case' 0 N--CA 1.497 1.912 0 O-C-N 121.769 -0.582 . . . . 0.0 110.098 178.903 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 266' ' ' SER . . . . . . . . . . . . . 3.5 m -163.31 113.28 1.34 Allowed 'General case' 0 N--CA 1.495 1.797 0 O-C-N 121.628 -0.67 . . . . 0.0 110.167 -179.757 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 267' ' ' SER . . . . . . . . . . . . . 34.2 m -79.53 -32.62 42.27 Favored 'General case' 0 N--CA 1.498 1.943 0 O-C-N 121.671 -0.643 . . . . 0.0 110.498 -178.965 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 268' ' ' THR . . . . . . . . . . . . . 39.7 p -108.72 167.63 9.93 Favored 'General case' 0 N--CA 1.495 1.815 0 O-C-N 121.574 -0.704 . . . . 0.0 110.41 -177.436 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 269' ' ' ALA . . . . . 0.435 ' HB1' ' HD2' ' B' ' 270' ' ' PRO . . . 54.93 172.86 0.04 OUTLIER Pre-proline 0 N--CA 1.507 2.405 0 O-C-N 121.707 -0.621 . . . . 0.0 111.312 -178.67 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 270' ' ' PRO . . . . . 0.435 ' HD2' ' HB1' ' B' ' 269' ' ' ALA . 16.2 Cg_exo -64.83 179.59 1.32 Allowed 'Trans proline' 0 N--CA 1.489 1.246 0 O-C-N 123.505 1.266 . . . . 0.0 110.451 179.5 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 271' ' ' SER . . . . . . . . . . . . . 50.2 m -109.83 149.2 30.19 Favored 'General case' 0 N--CA 1.496 1.826 0 O-C-N 121.758 -0.589 . . . . 0.0 110.204 179.914 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 272' ' ' ASP . . . . . . . . . . . . . 74.6 m-20 -90.38 172.26 8.87 Favored 'General case' 0 N--CA 1.496 1.862 0 O-C-N 121.69 -0.632 . . . . 0.0 110.241 -179.249 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 273' ' ' LEU . . . . . 0.428 ' HA ' HD13 ' B' ' 273' ' ' LEU . 4.6 mm? 52.33 91.06 0.02 OUTLIER 'General case' 0 N--CA 1.507 2.378 0 O-C-N 121.638 -0.664 . . . . 0.0 110.887 -179.505 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 274' ' ' ALA . . . . . . . . . . . . . . . -166.26 155.62 11.53 Favored 'General case' 0 N--CA 1.498 1.937 0 O-C-N 121.751 -0.593 . . . . 0.0 109.957 179.77 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 275' ' ' THR . . . . . . . . . . . . . 26.5 p -89.48 153.11 48.1 Favored Pre-proline 0 N--CA 1.495 1.823 0 O-C-N 121.65 -0.656 . . . . 0.0 110.131 179.806 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 276' ' ' PRO . . . . . . . . . . . . . 31.5 Cg_endo -68.8 129.54 18.84 Favored 'Trans proline' 0 N--CA 1.487 1.143 0 O-C-N 123.608 1.32 . . . . 0.0 110.348 -179.572 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 277' ' ' GLN . . . . . . . . . . . . . 7.1 tt0 -160.71 150.58 14.45 Favored Pre-proline 0 N--CA 1.494 1.745 0 O-C-N 121.746 -0.596 . . . . 0.0 110.117 178.757 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 278' ' ' PRO . . . . . . . . . . . . . 17.4 Cg_exo -62.89 133.16 40.25 Favored 'Trans proline' 0 N--CA 1.491 1.331 0 O-C-N 123.452 1.238 . . . . 0.0 110.506 178.632 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 279' ' ' SER . . . . . . . . . . . . . 66.9 p -99.36 -62.58 1.22 Allowed 'General case' 0 N--CA 1.495 1.818 0 O-C-N 121.67 -0.644 . . . . 0.0 110.217 179.655 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 280' ' ' THR . . . . . . . . . . . . . 25.6 m -129.46 138.91 51.68 Favored 'General case' 0 N--CA 1.494 1.77 0 O-C-N 121.654 -0.654 . . . . 0.0 110.134 179.249 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 281' ' ' PHE . . . . . . . . . . . . . 29.9 m-85 51.94 91.44 0.07 OUTLIER Pre-proline 0 N--CA 1.506 2.35 0 O-C-N 121.65 -0.656 . . . . 0.0 111.001 179.966 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 282' ' ' PRO . . . . . . . . . . . . . 19.6 Cg_endo -64.71 -32.06 57.7 Favored 'Trans proline' 0 N--CA 1.49 1.27 0 O-C-N 123.443 1.233 . . . . 0.0 110.506 179.961 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 283' ' ' GLN . . . . . . . . . . . . . 24.2 mt-30 -139.38 154.51 71.84 Favored Pre-proline 0 N--CA 1.495 1.78 0 O-C-N 121.565 -0.709 . . . . 0.0 110.126 178.531 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 284' ' ' PRO . . . . . . . . . . . . . 30.4 Cg_endo -68.49 112.81 2.94 Favored 'Trans proline' 0 N--CA 1.489 1.24 0 O-C-N 123.651 1.342 . . . . 0.0 110.297 -179.619 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 285' ' ' PRO . . . . . . . . . . . . . 33.1 Cg_endo -68.79 -33.82 19.87 Favored 'Trans proline' 0 N--CA 1.489 1.257 0 O-C-N 123.389 1.205 . . . . 0.0 110.363 179.234 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 286' ' ' VAL . . . . . . . . . . . . . 57.5 t -69.93 -37.36 72.62 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.046 0 O-C-N 121.664 -0.647 . . . . 0.0 109.78 -179.002 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 287' ' ' GLU . . . . . . . . . . . . . 46.3 tt0 -65.97 -38.54 88.84 Favored 'General case' 0 N--CA 1.501 2.108 0 O-C-N 121.689 -0.632 . . . . 0.0 110.43 -178.283 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 288' ' ' SER . . . . . . . . . . . . . 29.6 t -132.27 136.03 46.66 Favored 'General case' 0 N--CA 1.496 1.828 0 O-C-N 121.606 -0.684 . . . . 0.0 110.299 -179.623 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 289' ' ' HIS . . . . . . . . . . . . . 48.9 p-80 -128.53 150.24 50.26 Favored 'General case' 0 N--CA 1.496 1.835 0 O-C-N 121.711 -0.618 . . . . 0.0 110.244 179.856 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 290' ' ' SER . . . . . . . . . . . . . 47.5 m -119.57 147.43 44.49 Favored 'General case' 0 N--CA 1.495 1.817 0 O-C-N 121.687 -0.633 . . . . 0.0 110.172 -179.953 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 291' ' ' SER . . . . . . . . . . . . . 2.7 t . . . . . 0 N--CA 1.494 1.764 0 CA-C-O 118.051 -0.976 . . . . 0.0 110.237 -179.955 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' -1' ' ' MET . . . . . . . . . . . . . 69.8 mmm . . . . . 0 N--CA 1.492 1.666 0 CA-C-O 120.993 0.425 . . . . 0.0 110.135 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 0' ' ' GLY . . . . . . . . . . . . . . . 76.65 38.08 33.12 Favored Glycine 0 N--CA 1.495 2.58 0 N-CA-C 109.516 -1.434 . . . . 0.0 109.516 -179.821 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 65.1 mtt 52.2 84.55 0.05 OUTLIER 'General case' 0 N--CA 1.505 2.287 0 O-C-N 121.568 -0.96 . . . . 0.0 110.963 -179.319 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 75.5 m -100.99 -179.1 3.95 Favored 'General case' 0 N--CA 1.494 1.758 0 O-C-N 121.704 -0.622 . . . . 0.0 110.222 -179.681 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 58.1 t -65.78 -27.98 42.79 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.176 0 O-C-N 121.721 -0.612 . . . . 0.0 110.326 -179.146 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -55.63 -32.45 63.17 Favored 'General case' 0 N--CA 1.504 2.24 0 O-C-N 121.427 -0.796 . . . . 0.0 110.424 -178.319 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -68.7 -34.4 75.58 Favored 'General case' 0 N--CA 1.498 1.937 0 C-N-CA 120.389 -0.524 . . . . 0.0 109.971 174.79 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 6' ' ' PHE . . . . . 0.447 ' CE2' HD11 ' B' ' 260' ' ' LEU . 96.2 m-85 -97.37 10.21 40.25 Favored 'General case' 0 N--CA 1.498 1.958 0 O-C-N 121.767 -0.583 . . . . 0.0 111.166 178.798 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -67.43 128.88 38.06 Favored 'General case' 0 N--CA 1.5 2.071 0 O-C-N 121.247 -0.908 . . . . 0.0 110.006 -179.832 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 8' ' ' GLY . . . . . 0.466 ' O ' HG13 ' A' ' 24' ' ' VAL . . . 82.77 -0.82 89.23 Favored Glycine 0 N--CA 1.497 2.723 0 N-CA-C 110.839 -0.904 . . . . 0.0 110.839 -176.463 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 57.7 p -76.37 138.7 40.59 Favored 'General case' 0 N--CA 1.497 1.918 0 O-C-N 121.07 -1.253 . . . . 0.0 110.335 177.171 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 11.3 t-20 -84.55 119.17 24.87 Favored 'General case' 0 N--CA 1.496 1.844 0 O-C-N 121.666 -0.646 . . . . 0.0 109.784 174.154 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . 0.529 HG12 ' HA ' ' A' ' 57' ' ' ILE . 35.1 m -141.75 163.99 19.38 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.717 0 O-C-N 121.737 -0.602 . . . . 0.0 109.427 -179.41 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 37.7 tt0 -109.37 130.15 55.51 Favored 'General case' 0 N--CA 1.492 1.649 0 C-N-CA 119.855 -0.738 . . . . 0.0 109.996 177.574 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . 0.534 HG22 ' CD2' ' A' ' 55' ' ' LEU . 58.4 t -106.78 127.35 62.39 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.692 0 O-C-N 121.551 -0.718 . . . . 0.0 109.827 -179.799 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 29.4 tp -95.81 125.85 40.66 Favored 'General case' 0 N--CA 1.494 1.769 0 N-CA-C 109.102 -0.703 . . . . 0.0 109.102 174.344 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 85.0 mt -97.07 166.79 11.42 Favored 'General case' 0 N--CA 1.495 1.792 0 O-C-N 121.624 -0.672 . . . . 0.0 111.293 -171.968 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 24.4 p30 -58.0 -21.49 45.08 Favored 'General case' 0 N--CA 1.507 2.382 0 O-C-N 121.83 -0.544 . . . . 0.0 111.569 -177.296 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 43.5 p-10 -93.54 27.1 2.74 Favored 'General case' 0 N--CA 1.497 1.887 0 O-C-N 121.537 -0.727 . . . . 0.0 110.539 -178.135 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 1.1 p30 53.08 27.28 5.6 Favored 'General case' 0 N--CA 1.506 2.345 0 CA-C-O 121.173 0.511 . . . . 0.0 111.042 172.249 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 51.1 m -107.62 147.33 30.79 Favored 'General case' 0 N--CA 1.491 1.585 0 N-CA-C 109.149 -0.685 . . . . 0.0 109.149 171.026 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 49.6 mttp -109.62 147.81 32.4 Favored 'General case' 0 N--CA 1.495 1.784 0 O-C-N 121.595 -0.691 . . . . 0.0 110.62 -174.744 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -153.02 156.61 39.13 Favored 'General case' 0 N--CA 1.496 1.826 0 O-C-N 121.742 -0.599 . . . . 0.0 110.129 176.18 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . 0.406 ' O ' HD22 ' A' ' 39' ' ' LEU . 30.8 ptt180 -144.07 152.84 41.52 Favored 'General case' 0 N--CA 1.496 1.838 0 O-C-N 121.679 -0.638 . . . . 0.0 110.416 178.464 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . 0.451 ' HA2' HD13 ' A' ' 39' ' ' LEU . . . -171.9 171.07 43.93 Favored Glycine 0 N--CA 1.493 2.453 0 N-CA-C 109.184 -1.566 . . . . 0.0 109.184 179.597 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . 0.466 HG13 ' O ' ' A' ' 8' ' ' GLY . 45.4 t -94.57 126.31 47.02 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.925 0 O-C-N 121.643 -0.916 . . . . 0.0 109.178 175.498 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 25' ' ' ILE . . . . . 0.475 ' HA ' HD23 ' A' ' 37' ' ' LEU . 52.7 mt -62.86 138.36 22.97 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.147 0 O-C-N 121.589 -0.694 . . . . 0.0 111.012 -170.806 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . 0.622 HG21 ' HG3' ' A' ' 38' ' ' ARG . 18.1 p -121.25 -19.09 7.19 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.861 -0.524 . . . . 0.0 111.563 179.501 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 27' ' ' ASN . . . . . 0.445 ' O ' HD12 ' A' ' 35' ' ' LEU . 2.2 t-20 -165.26 157.94 15.87 Favored 'General case' 0 N--CA 1.504 2.263 0 O-C-N 120.949 -1.095 . . . . 0.0 111.732 175.329 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 28' ' ' PHE . . . . . 0.435 ' HE1' HG21 ' A' ' 49' ' ' THR . 64.3 t80 -150.29 121.11 7.58 Favored 'General case' 0 N--CA 1.495 1.79 0 N-CA-C 109.246 -0.65 . . . . 0.0 109.246 173.683 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 17.8 t70 -98.28 130.42 44.98 Favored 'General case' 0 N--CA 1.492 1.645 0 N-CA-C 109.114 -0.699 . . . . 0.0 109.114 -176.708 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 23.2 t -70.22 -52.32 24.07 Favored 'General case' 0 N--CA 1.497 1.91 0 C-N-CA 119.977 -0.689 . . . . 0.0 110.618 -176.653 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 22.5 m -60.42 -40.69 91.91 Favored 'General case' 0 N--CA 1.502 2.171 0 O-C-N 121.654 -0.654 . . . . 0.0 110.798 -174.993 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 29.8 m120 -104.0 -10.09 18.35 Favored 'General case' 0 N--CA 1.497 1.914 0 O-C-N 121.578 -0.701 . . . . 0.0 111.601 -177.266 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 7.7 m 49.54 67.22 0.93 Allowed 'General case' 0 N--CA 1.508 2.441 0 O-C-N 121.114 -0.991 . . . . 0.0 110.886 -174.606 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 34' ' ' ILE . . . . . 1.028 HD12 HG22 ' A' ' 48' ' ' VAL . 44.7 mm -121.41 125.9 74.23 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.001 0 O-C-N 121.603 -0.686 . . . . 0.0 109.329 -175.886 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.445 HD12 ' O ' ' A' ' 27' ' ' ASN . 15.8 tp -116.19 118.91 34.12 Favored 'General case' 0 N--CA 1.494 1.743 0 O-C-N 121.617 -0.677 . . . . 0.0 110.537 -171.088 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 92.1 mt-30 -91.35 131.24 36.97 Favored 'General case' 0 N--CA 1.491 1.624 0 N-CA-C 109.391 -0.596 . . . . 0.0 109.391 171.299 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 0.475 HD23 ' HA ' ' A' ' 25' ' ' ILE . 44.6 mt -117.81 123.54 46.2 Favored 'General case' 0 N--CA 1.494 1.764 0 O-C-N 121.752 -0.592 . . . . 0.0 110.15 176.41 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 38' ' ' ARG . . . . . 0.622 ' HG3' HG21 ' A' ' 26' ' ' THR . 66.0 mtt-85 -103.18 106.59 17.14 Favored 'General case' 0 N--CA 1.498 1.942 0 O-C-N 121.688 -0.632 . . . . 0.0 110.246 171.583 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.451 HD13 ' HA2' ' A' ' 23' ' ' GLY . 56.9 tp -83.53 151.76 25.24 Favored 'General case' 0 N--CA 1.497 1.925 0 O-C-N 121.527 -0.733 . . . . 0.0 110.488 -178.256 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -68.69 -2.95 10.37 Favored 'General case' 0 N--CA 1.503 2.202 0 O-C-N 121.722 -0.611 . . . . 0.0 112.172 -170.641 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 91.4 m-20 -87.89 28.83 0.98 Allowed 'General case' 0 N--CA 1.498 1.938 0 O-C-N 121.033 -1.042 . . . . 0.0 110.74 174.769 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 6.3 t70 64.99 28.8 12.46 Favored 'General case' 0 N--CA 1.506 2.326 0 O-C-N 121.205 -0.934 . . . . 0.0 110.397 175.771 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 67.2 m -123.97 139.72 53.67 Favored 'General case' 0 N--CA 1.495 1.777 0 O-C-N 121.449 -0.782 . . . . 0.0 110.035 177.869 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 7.6 t -128.16 147.1 50.54 Favored 'General case' 0 N--CA 1.496 1.861 0 O-C-N 121.736 -0.603 . . . . 0.0 109.939 179.486 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . 0.544 ' HE3' HD11 ' A' ' 47' ' ' ILE . 21.8 ttpt -152.25 132.4 13.54 Favored 'General case' 0 N--CA 1.496 1.869 0 C-N-CA 120.1 -0.64 . . . . 0.0 110.686 -177.526 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 86.9 p -95.27 124.33 39.25 Favored 'General case' 0 N--CA 1.495 1.779 0 O-C-N 121.75 -0.594 . . . . 0.0 110.108 177.574 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 47' ' ' ILE . . . . . 0.544 HD11 ' HE3' ' A' ' 45' ' ' LYS . 77.8 mt -129.25 134.94 62.97 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.855 0 O-C-N 121.651 -0.655 . . . . 0.0 109.333 179.724 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 48' ' ' VAL . . . . . 1.028 HG22 HD12 ' A' ' 34' ' ' ILE . 64.2 t -81.78 127.67 39.39 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.916 0 N-CA-C 109.074 -0.713 . . . . 0.0 109.074 177.646 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 49' ' ' THR . . . . . 0.543 ' HB ' HD22 ' B' ' 264' ' ' LEU . 61.0 p -58.03 -24.96 60.41 Favored 'General case' 0 N--CA 1.506 2.365 0 O-C-N 121.49 -0.756 . . . . 0.0 111.872 -167.763 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 33.5 tttp -56.65 -24.8 50.95 Favored 'General case' 0 N--CA 1.503 2.196 0 O-C-N 121.444 -0.785 . . . . 0.0 111.014 -177.228 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 46.3 p30 -84.06 3.28 35.31 Favored 'General case' 0 N--CA 1.499 1.992 0 C-N-CA 119.725 -0.79 . . . . 0.0 111.363 176.691 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 52' ' ' ILE . . . . . 0.427 HG21 HD11 ' A' ' 55' ' ' LEU . 98.9 mt -75.2 124.38 32.94 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.104 0 O-C-N 121.185 -0.947 . . . . 0.0 109.926 177.976 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 74.7 tttt -93.26 -28.59 16.15 Favored 'General case' 0 N--CA 1.495 1.786 0 O-C-N 121.81 -0.556 . . . . 0.0 109.959 171.227 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 5.0 m-20 -163.3 153.58 15.89 Favored 'General case' 0 N--CA 1.499 2.02 0 O-C-N 121.707 -0.62 . . . . 0.0 110.068 -178.094 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . 0.534 ' CD2' HG22 ' A' ' 13' ' ' VAL . 83.8 mt -132.96 148.8 52.27 Favored 'General case' 0 N--CA 1.497 1.902 0 O-C-N 121.681 -0.637 . . . . 0.0 110.512 -178.535 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 20.2 ptp180 -151.97 145.19 24.66 Favored 'General case' 0 N--CA 1.495 1.799 0 O-C-N 121.7 -0.625 . . . . 0.0 110.123 175.152 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 57' ' ' ILE . . . . . 0.529 ' HA ' HG12 ' A' ' 11' ' ' VAL . 67.1 mt -85.84 133.48 29.5 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.822 0 O-C-N 121.539 -0.726 . . . . 0.0 109.765 172.405 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . 0.402 HD11 ' HB2' ' A' ' 22' ' ' ARG . 30.5 mt -79.34 123.92 84.36 Favored Pre-proline 0 N--CA 1.497 1.898 0 O-C-N 121.446 -0.784 . . . . 0.0 109.802 -177.215 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 31.7 Cg_endo -68.05 142.72 57.31 Favored 'Trans proline' 0 N--CA 1.489 1.231 0 O-C-N 123.359 1.189 . . . . 0.0 110.676 -174.872 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 89.4 mttt -135.52 114.84 12.46 Favored 'General case' 0 N--CA 1.495 1.775 0 O-C-N 121.754 -0.591 . . . . 0.0 109.927 176.31 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 29.9 m120 -140.05 174.54 10.41 Favored 'General case' 0 N--CA 1.496 1.828 0 O-C-N 121.603 -0.686 . . . . 0.0 110.353 -178.064 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 75.0 mm-40 -104.42 175.8 5.37 Favored 'General case' 0 N--CA 1.495 1.811 0 O-C-N 121.688 -0.632 . . . . 0.0 110.087 179.348 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 7.0 tp -119.35 142.72 33.31 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.944 0 O-C-N 121.74 -0.6 . . . . 0.0 110.171 -179.297 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 64' ' ' MET . . . . . . . . . . . . . 4.8 ttt 52.37 86.93 0.15 Allowed Pre-proline 0 N--CA 1.505 2.29 0 O-C-N 121.637 -0.665 . . . . 0.0 111.041 -179.683 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 27.7 Cg_endo -66.88 141.93 60.73 Favored 'Trans proline' 0 N--CA 1.488 1.172 0 O-C-N 123.533 1.281 . . . . 0.0 110.368 179.444 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 77.8 mttt -65.5 -36.58 84.27 Favored 'General case' 0 N--CA 1.501 2.11 0 O-C-N 121.719 -0.613 . . . . 0.0 110.391 -179.59 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 1.3 p-10 -128.93 30.41 5.07 Favored 'General case' 0 N--CA 1.498 1.934 0 O-C-N 121.64 -0.663 . . . . 0.0 110.601 -179.513 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 80.0 -178.83 53.63 Favored Glycine 0 N--CA 1.494 2.543 0 N-CA-C 109.523 -1.431 . . . . 0.0 109.523 179.797 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 24.7 m -68.06 -40.55 82.73 Favored 'General case' 0 N--CA 1.498 1.973 0 O-C-N 121.748 -0.854 . . . . 0.0 110.225 179.422 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 39.9 tttp 62.23 -70.97 0.05 OUTLIER 'General case' 0 N--CA 1.507 2.398 0 O-C-N 122.01 -0.431 . . . . 0.0 111.092 -177.377 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 19.5 p -118.25 91.14 39.93 Favored Pre-proline 0 N--CA 1.495 1.816 0 O-C-N 121.308 -0.87 . . . . 0.0 110.232 -178.089 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 23.7 Cg_exo -60.53 -28.79 87.29 Favored 'Trans proline' 0 N--CA 1.491 1.374 0 O-C-N 123.547 1.288 . . . . 0.0 110.944 179.976 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 29.9 t -104.02 137.37 42.08 Favored 'General case' 0 N--CA 1.495 1.787 0 O-C-N 121.607 -0.683 . . . . 0.0 110.174 179.721 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 42.8 p -77.2 -31.39 55.29 Favored 'General case' 0 N--CA 1.499 2.013 0 O-C-N 121.691 -0.631 . . . . 0.0 110.395 -179.588 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 91.7 m-20 -99.18 120.72 39.98 Favored 'General case' 0 N--CA 1.496 1.841 0 O-C-N 121.593 -0.692 . . . . 0.0 110.276 -179.133 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 87.6 p -151.59 164.42 36.91 Favored 'General case' 0 N--CA 1.495 1.784 0 O-C-N 121.694 -0.629 . . . . 0.0 110.089 179.228 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 39.8 p -96.47 11.32 35.4 Favored 'General case' 0 N--CA 1.495 1.806 0 O-C-N 121.586 -0.696 . . . . 0.0 111.255 179.562 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 52.2 mtmt -67.83 -33.79 75.48 Favored 'General case' 0 N--CA 1.5 2.045 0 O-C-N 121.265 -0.897 . . . . 0.0 110.274 179.276 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . 0.557 ' N ' HD12 ' A' ' 79' ' ' LEU . 6.3 mp -92.2 148.04 22.46 Favored 'General case' 0 N--CA 1.496 1.862 0 O-C-N 121.643 -0.661 . . . . 0.0 110.245 -179.836 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 40.5 pttt -133.09 170.66 15.08 Favored 'General case' 0 N--CA 1.496 1.869 0 O-C-N 121.639 -0.663 . . . . 0.0 110.337 179.976 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 31.3 t -102.23 142.91 32.71 Favored 'General case' 0 N--CA 1.495 1.791 0 O-C-N 121.712 -0.617 . . . . 0.0 110.153 -179.715 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -72.76 139.44 47.11 Favored 'General case' 0 N--CA 1.498 1.957 0 O-C-N 121.716 -0.615 . . . . 0.0 110.164 -179.332 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 54.7 mt-10 -118.87 153.94 33.73 Favored 'General case' 0 N--CA 1.496 1.848 0 O-C-N 121.758 -0.589 . . . . 0.0 110.078 179.506 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 46.3 p -126.13 24.62 6.87 Favored 'General case' 0 N--CA 1.498 1.926 0 O-C-N 121.609 -0.682 . . . . 0.0 110.815 -179.864 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 85.8 m-85 -77.25 -34.12 55.86 Favored 'General case' 0 N--CA 1.499 2.009 0 O-C-N 121.461 -0.774 . . . . 0.0 110.158 178.644 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 87.4 p -148.28 169.53 19.91 Favored 'General case' 0 N--CA 1.494 1.775 0 O-C-N 121.718 -0.614 . . . . 0.0 110.238 179.905 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 49.3 m -114.2 148.15 37.78 Favored 'General case' 0 N--CA 1.494 1.76 0 O-C-N 121.715 -0.615 . . . . 0.0 110.173 -179.996 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 86.0 mttt -66.98 -39.54 87.21 Favored 'General case' 0 N--CA 1.5 2.036 0 O-C-N 121.598 -0.689 . . . . 0.0 110.369 179.974 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 30.0 m120 -76.54 -39.1 53.85 Favored 'General case' 0 N--CA 1.499 1.999 0 O-C-N 121.683 -0.636 . . . . 0.0 110.482 -178.016 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 94.3 mttt -107.4 136.52 47.06 Favored 'General case' 0 N--CA 1.496 1.861 0 O-C-N 121.729 -0.607 . . . . 0.0 110.427 -177.633 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 91' ' ' TRP . . . . . . . . . . . . . 98.7 m95 -105.01 145.4 30.49 Favored 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.65 -0.656 . . . . 0.0 110.266 179.557 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 23.6 m -64.29 -35.17 79.98 Favored 'General case' 0 N--CA 1.502 2.146 0 O-C-N 121.701 -0.624 . . . . 0.0 110.318 -179.604 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 93' ' ' MET . . . . . . . . . . . . . 49.4 ttm -120.3 141.38 50.07 Favored 'General case' 0 N--CA 1.494 1.732 0 O-C-N 121.706 -0.621 . . . . 0.0 110.182 179.74 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 20.0 t0 . . . . . 0 N--CA 1.494 1.767 0 CA-C-O 118.008 -0.996 . . . . 0.0 110.22 -179.934 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' B' B ' 240' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.315 0 N-CA-C 109.536 -1.426 . . . . 0.0 109.536 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' B' B ' 241' ' ' ALA . . . . . . . . . . . . . . . -143.37 154.65 43.94 Favored 'General case' 0 N--CA 1.494 1.753 0 O-C-N 121.658 -0.907 . . . . 0.0 110.268 179.895 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 242' ' ' THR . . . . . . . . . . . . . 42.6 p -69.23 -34.1 74.31 Favored 'General case' 0 N--CA 1.498 1.971 0 O-C-N 121.649 -0.657 . . . . 0.0 110.161 -179.758 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 243' ' ' THR . . . . . . . . . . . . . 39.3 p -126.52 154.49 43.73 Favored 'General case' 0 N--CA 1.495 1.798 0 O-C-N 121.587 -0.696 . . . . 0.0 110.168 179.706 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 244' ' ' LYS . . . . . . . . . . . . . 40.6 tttp -66.31 -34.96 79.17 Favored 'General case' 0 N--CA 1.5 2.046 0 O-C-N 121.671 -0.643 . . . . 0.0 110.352 179.5 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 245' ' ' GLU . . . . . . . . . . . . . 55.0 mt-10 -95.25 148.06 22.81 Favored 'General case' 0 N--CA 1.494 1.768 0 O-C-N 121.67 -0.644 . . . . 0.0 110.304 -179.097 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 246' ' ' LYS . . . . . . . . . . . . . 17.2 tptm -157.02 34.06 0.29 Allowed 'General case' 0 N--CA 1.495 1.807 0 O-C-N 121.734 -0.604 . . . . 0.0 110.133 179.986 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 247' ' ' ASN . . . . . . . . . . . . . 90.9 m-20 -109.14 123.22 48.86 Favored 'General case' 0 N--CA 1.495 1.787 0 O-C-N 121.528 -0.733 . . . . 0.0 110.311 -179.289 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 248' ' ' ILE . . . . . . . . . . . . . 81.0 mt 52.68 94.2 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.508 2.427 0 O-C-N 121.649 -0.657 . . . . 0.0 110.692 179.526 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 249' ' ' SER . . . . . 0.41 ' C ' HG23 ' B' ' 250' ' ' VAL . 95.8 p -112.01 146.67 37.48 Favored 'General case' 0 N--CA 1.494 1.774 0 O-C-N 121.652 -0.655 . . . . 0.0 110.218 179.496 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 250' ' ' VAL . . . . . 0.41 HG23 ' C ' ' B' ' 249' ' ' SER . 82.3 t -148.88 140.07 17.24 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.975 0 O-C-N 121.66 -0.65 . . . . 0.0 109.395 -179.769 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 251' ' ' ASP . . . . . . . . . . . . . 5.8 p-10 -161.65 88.07 0.7 Allowed 'General case' 0 N--CA 1.497 1.907 0 O-C-N 121.714 -0.616 . . . . 0.0 110.414 -179.962 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 252' ' ' VAL . . . . . . . . . . . . . 58.8 t 52.61 81.8 0.05 OUTLIER 'Isoleucine or valine' 0 N--CA 1.506 2.342 0 O-C-N 121.432 -0.793 . . . . 0.0 110.668 179.431 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 253' ' ' ASP . . . . . . . . . . . . . 74.6 m-20 51.66 90.42 0.02 OUTLIER 'General case' 0 N--CA 1.506 2.346 0 O-C-N 121.597 -0.689 . . . . 0.0 111.226 178.994 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 254' ' ' ALA . . . . . . . . . . . . . . . -66.99 -31.7 72.44 Favored 'General case' 0 N--CA 1.5 2.045 0 O-C-N 121.632 -0.667 . . . . 0.0 110.32 178.2 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 255' ' ' ASP . . . . . . . . . . . . . 17.5 t0 -72.81 -26.25 61.44 Favored 'General case' 0 N--CA 1.499 1.984 0 O-C-N 121.676 -0.64 . . . . 0.0 110.662 179.89 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 256' ' ' ALA . . . . . . . . . . . . . . . -62.21 -31.72 72.29 Favored 'General case' 0 N--CA 1.501 2.122 0 O-C-N 121.445 -0.785 . . . . 0.0 110.421 -179.694 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 257' ' ' SER . . . . . . . . . . . . . 50.0 m -55.26 -34.91 64.44 Favored 'General case' 0 N--CA 1.503 2.224 0 O-C-N 121.595 -0.69 . . . . 0.0 110.518 176.808 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 258' ' ' SER . . . . . . . . . . . . . 23.4 t -68.23 -33.04 73.66 Favored 'General case' 0 N--CA 1.499 2.0 0 C-N-CA 120.463 -0.495 . . . . 0.0 110.242 -179.814 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 259' ' ' GLN . . . . . . . . . . . . . 78.3 mt-30 -64.65 -34.91 79.4 Favored 'General case' 0 N--CA 1.5 2.031 0 O-C-N 121.665 -0.647 . . . . 0.0 110.37 179.717 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 260' ' ' LEU . . . . . 0.525 ' HA ' HD12 ' B' ' 263' ' ' LEU . 85.7 mt -65.66 -42.6 91.17 Favored 'General case' 0 N--CA 1.501 2.082 0 O-C-N 121.728 -0.608 . . . . 0.0 110.259 179.288 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 261' ' ' LEU . . . . . . . . . . . . . 22.5 tp -69.79 -36.91 76.1 Favored 'General case' 0 N--CA 1.498 1.943 0 C-N-CA 120.175 -0.61 . . . . 0.0 109.73 176.391 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 262' ' ' SER . . . . . . . . . . . . . 22.8 t -62.33 -36.4 82.08 Favored 'General case' 0 N--CA 1.5 2.07 0 O-C-N 121.756 -0.59 . . . . 0.0 110.516 177.198 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 263' ' ' LEU . . . . . 0.525 HD12 ' HA ' ' B' ' 260' ' ' LEU . 18.2 mt -64.79 -44.48 89.83 Favored 'General case' 0 N--CA 1.501 2.076 0 O-C-N 121.654 -0.654 . . . . 0.0 110.154 179.764 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 264' ' ' LEU . . . . . 0.543 HD22 ' HB ' ' A' ' 49' ' ' THR . 84.9 mt -62.92 -35.25 79.46 Favored 'General case' 0 N--CA 1.502 2.13 0 O-C-N 121.734 -0.604 . . . . 0.0 110.678 178.918 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 265' ' ' LYS . . . . . . . . . . . . . 30.1 ttpt -76.04 -44.99 36.62 Favored 'General case' 0 N--CA 1.497 1.911 0 O-C-N 121.697 -0.627 . . . . 0.0 110.265 -177.344 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 266' ' ' SER . . . . . . . . . . . . . 39.2 t 50.58 -170.87 0.02 OUTLIER 'General case' 0 N--CA 1.506 2.367 0 O-C-N 121.635 -0.665 . . . . 0.0 111.111 -178.254 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 267' ' ' SER . . . . . . . . . . . . . 97.1 p -108.66 133.37 52.85 Favored 'General case' 0 N--CA 1.496 1.84 0 O-C-N 121.686 -0.634 . . . . 0.0 110.157 179.21 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 268' ' ' THR . . . . . . . . . . . . . 39.5 p -135.72 161.38 35.71 Favored 'General case' 0 N--CA 1.495 1.82 0 O-C-N 121.726 -0.609 . . . . 0.0 110.262 -179.917 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 269' ' ' ALA . . . . . . . . . . . . . . . 48.2 88.71 0.1 Allowed Pre-proline 0 N--CA 1.506 2.352 0 O-C-N 121.759 -0.588 . . . . 0.0 111.382 -179.873 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 270' ' ' PRO . . . . . . . . . . . . . 27.1 Cg_endo -66.92 145.18 73.37 Favored 'Trans proline' 0 N--CA 1.488 1.183 0 O-C-N 123.519 1.273 . . . . 0.0 110.323 178.748 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 271' ' ' SER . . . . . . . . . . . . . 48.8 m -118.88 145.85 45.38 Favored 'General case' 0 N--CA 1.495 1.81 0 O-C-N 121.682 -0.636 . . . . 0.0 110.208 -179.749 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 272' ' ' ASP . . . . . . . . . . . . . 74.6 m-20 -127.97 -44.88 1.44 Allowed 'General case' 0 N--CA 1.497 1.914 0 O-C-N 121.703 -0.623 . . . . 0.0 110.219 179.762 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 273' ' ' LEU . . . . . . . . . . . . . 21.0 tp -161.77 145.06 12.22 Favored 'General case' 0 N--CA 1.495 1.783 0 O-C-N 121.604 -0.685 . . . . 0.0 110.169 -179.801 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 274' ' ' ALA . . . . . . . . . . . . . . . 50.45 -169.06 0.03 OUTLIER 'General case' 0 N--CA 1.506 2.359 0 O-C-N 121.647 -0.658 . . . . 0.0 111.174 -179.145 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 275' ' ' THR . . . . . . . . . . . . . 22.7 p -96.86 163.2 20.68 Favored Pre-proline 0 N--CA 1.495 1.784 0 O-C-N 121.73 -0.606 . . . . 0.0 110.258 -179.362 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 276' ' ' PRO . . . . . . . . . . . . . 21.9 Cg_exo -61.56 -31.0 86.98 Favored 'Trans proline' 0 N--CA 1.491 1.354 0 O-C-N 123.68 1.358 . . . . 0.0 110.803 -179.566 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 277' ' ' GLN . . . . . . . . . . . . . 35.5 mt-30 -109.75 157.24 38.14 Favored Pre-proline 0 N--CA 1.495 1.806 0 O-C-N 121.596 -0.69 . . . . 0.0 110.258 -179.749 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 278' ' ' PRO . . . . . . . . . . . . . 17.1 Cg_exo -63.05 141.91 85.42 Favored 'Trans proline' 0 N--CA 1.491 1.349 0 O-C-N 123.643 1.338 . . . . 0.0 110.618 179.327 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 279' ' ' SER . . . . . . . . . . . . . 26.7 t -160.64 -67.68 0.07 Allowed 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.644 -0.66 . . . . 0.0 110.171 178.332 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 280' ' ' THR . . . . . . . . . . . . . 24.7 m -70.4 -35.27 73.36 Favored 'General case' 0 N--CA 1.498 1.949 0 O-C-N 121.615 -0.678 . . . . 0.0 110.167 179.069 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 281' ' ' PHE . . . . . . . . . . . . . 42.7 m-85 -112.37 167.71 8.75 Favored Pre-proline 0 N--CA 1.495 1.782 0 O-C-N 121.76 -0.587 . . . . 0.0 110.334 -178.581 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 282' ' ' PRO . . . . . . . . . . . . . 17.3 Cg_exo -63.26 -177.48 0.37 Allowed 'Trans proline' 0 N--CA 1.489 1.25 0 O-C-N 123.683 1.36 . . . . 0.0 110.631 179.895 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 283' ' ' GLN . . . . . . . . . . . . . 39.1 mt-30 -81.94 166.08 39.44 Favored Pre-proline 0 N--CA 1.497 1.914 0 O-C-N 121.756 -0.59 . . . . 0.0 110.095 -179.666 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 284' ' ' PRO . . . . . 0.409 ' N ' ' HD2' ' B' ' 285' ' ' PRO . 24.7 Cg_exo -56.71 -51.81 8.26 Favored 'Trans proline' 0 N--CA 1.492 1.384 0 O-C-N 123.57 1.3 . . . . 0.0 111.905 -177.59 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 285' ' ' PRO . . . . . 0.409 ' HD2' ' N ' ' B' ' 284' ' ' PRO . 36.3 Cg_endo -72.17 159.25 50.28 Favored 'Trans proline' 0 N--CA 1.486 1.053 0 O-C-N 123.226 1.119 . . . . 0.0 110.275 -175.59 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 286' ' ' VAL . . . . . . . . . . . . . 54.6 t -99.63 133.48 42.31 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.823 0 O-C-N 121.629 -0.67 . . . . 0.0 109.704 -178.869 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 287' ' ' GLU . . . . . . . . . . . . . 74.3 mm-40 -66.91 -36.39 82.17 Favored 'General case' 0 N--CA 1.499 2.006 0 O-C-N 121.697 -0.627 . . . . 0.0 110.52 -177.627 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 288' ' ' SER . . . . . . . . . . . . . 50.3 m -112.08 146.36 38.11 Favored 'General case' 0 N--CA 1.496 1.872 0 O-C-N 121.687 -0.633 . . . . 0.0 110.314 -179.811 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 289' ' ' HIS . . . . . . . . . . . . . 83.2 t60 -66.72 -38.79 87.4 Favored 'General case' 0 N--CA 1.5 2.036 0 O-C-N 121.674 -0.641 . . . . 0.0 110.332 179.559 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 290' ' ' SER . . . . . . . . . . . . . 92.1 p -116.12 153.83 31.06 Favored 'General case' 0 N--CA 1.496 1.831 0 O-C-N 121.718 -0.614 . . . . 0.0 110.269 -179.26 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 291' ' ' SER . . . . . . . . . . . . . 89.0 p . . . . . 0 N--CA 1.496 1.844 0 CA-C-O 118.064 -0.969 . . . . 0.0 110.195 -179.603 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' -1' ' ' MET . . . . . . . . . . . . . 85.1 mtp . . . . . 0 N--CA 1.493 1.709 0 CA-C-O 121.0 0.428 . . . . 0.0 110.221 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 0' ' ' GLY . . . . . . . . . . . . . . . -84.03 -174.66 50.49 Favored Glycine 0 N--CA 1.494 2.528 0 N-CA-C 109.481 -1.448 . . . . 0.0 109.481 179.757 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 65.6 mtt -94.49 129.53 41.23 Favored 'General case' 0 N--CA 1.496 1.833 0 O-C-N 121.631 -0.923 . . . . 0.0 110.156 -179.973 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 70.3 m -101.17 167.83 9.96 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.682 -0.636 . . . . 0.0 110.124 -179.898 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 3' ' ' VAL . . . . . 0.453 HG12 ' CE1' ' A' ' 7' ' ' TYR . 65.7 t -66.33 -27.81 41.64 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.131 0 O-C-N 121.792 -0.568 . . . . 0.0 110.249 -179.771 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -55.14 -30.94 60.85 Favored 'General case' 0 N--CA 1.505 2.292 0 O-C-N 121.462 -0.774 . . . . 0.0 110.449 -178.671 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 9.7 m-20 -68.66 -30.87 69.66 Favored 'General case' 0 N--CA 1.499 2.024 0 O-C-N 121.88 -0.513 . . . . 0.0 110.24 174.789 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 96.5 m-85 -95.84 10.1 38.28 Favored 'General case' 0 N--CA 1.497 1.921 0 O-C-N 121.679 -0.638 . . . . 0.0 111.449 -178.398 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 7' ' ' TYR . . . . . 0.453 ' CE1' HG12 ' A' ' 3' ' ' VAL . 3.7 m-30 -67.16 141.81 57.24 Favored 'General case' 0 N--CA 1.501 2.105 0 O-C-N 121.147 -0.971 . . . . 0.0 110.112 174.966 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 8' ' ' GLY . . . . . 0.431 ' O ' HG13 ' A' ' 24' ' ' VAL . . . 82.95 -1.39 88.66 Favored Glycine 0 N--CA 1.498 2.776 0 N-CA-C 110.745 -0.942 . . . . 0.0 110.745 -177.056 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . 0.521 ' OG ' HD12 ' A' ' 25' ' ' ILE . 88.5 p -77.34 141.01 40.09 Favored 'General case' 0 N--CA 1.498 1.972 0 O-C-N 121.125 -1.221 . . . . 0.0 110.509 -179.454 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 10' ' ' ASN . . . . . 0.679 ' CG ' HG22 ' A' ' 24' ' ' VAL . 2.5 m120 -85.16 118.53 24.78 Favored 'General case' 0 N--CA 1.498 1.943 0 O-C-N 121.669 -0.644 . . . . 0.0 109.646 174.323 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . 0.668 HG21 HD11 ' A' ' 25' ' ' ILE . 35.8 m -143.12 160.94 17.6 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.796 0 O-C-N 121.732 -0.605 . . . . 0.0 109.76 -178.746 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . 0.588 ' HB2' HD11 ' A' ' 58' ' ' LEU . 44.6 tt0 -109.43 125.36 52.34 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.575 -0.703 . . . . 0.0 110.16 178.142 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . 0.591 HG22 ' CD2' ' A' ' 55' ' ' LEU . 59.6 t -106.87 123.17 61.74 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.839 0 O-C-N 121.565 -0.709 . . . . 0.0 109.946 -177.629 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.438 HD13 ' HD3' ' A' ' 20' ' ' LYS . 27.6 tp -96.2 128.95 43.58 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.726 -0.609 . . . . 0.0 109.636 175.222 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 82.8 mt -99.04 167.16 10.9 Favored 'General case' 0 N--CA 1.497 1.922 0 O-C-N 121.609 -0.682 . . . . 0.0 110.97 -171.799 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 9.5 p30 -57.77 -22.11 45.23 Favored 'General case' 0 N--CA 1.505 2.294 0 O-C-N 121.76 -0.587 . . . . 0.0 111.39 -179.961 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 24.6 p30 -90.03 21.3 3.75 Favored 'General case' 0 N--CA 1.5 2.063 0 O-C-N 121.59 -0.694 . . . . 0.0 111.163 -177.721 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 74.4 m-20 59.87 28.8 18.35 Favored 'General case' 0 N--CA 1.506 2.36 0 O-C-N 121.339 -0.851 . . . . 0.0 110.813 172.675 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 18.0 m -111.66 133.94 53.57 Favored 'General case' 0 N--CA 1.494 1.769 0 O-C-N 121.494 -0.754 . . . . 0.0 109.573 170.617 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . 0.438 ' HD3' HD13 ' A' ' 14' ' ' LEU . 5.3 ttpm? -109.84 142.15 41.52 Favored 'General case' 0 N--CA 1.494 1.731 0 O-C-N 121.647 -0.658 . . . . 0.0 110.523 -177.114 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -152.99 160.27 43.0 Favored 'General case' 0 N--CA 1.496 1.828 0 O-C-N 121.773 -0.579 . . . . 0.0 110.09 179.562 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . 0.496 ' O ' HD13 ' A' ' 39' ' ' LEU . 30.9 ptt180 -140.28 148.57 41.63 Favored 'General case' 0 N--CA 1.497 1.916 0 O-C-N 121.622 -0.674 . . . . 0.0 110.8 -178.844 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -171.71 171.44 44.08 Favored Glycine 0 N--CA 1.495 2.617 0 N-CA-C 108.701 -1.759 . . . . 0.0 108.701 -176.332 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . 0.679 HG22 ' CG ' ' A' ' 10' ' ' ASN . 39.0 t -94.6 118.84 41.6 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.925 0 O-C-N 121.462 -1.022 . . . . 0.0 109.314 -175.913 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 25' ' ' ILE . . . . . 0.668 HD11 HG21 ' A' ' 11' ' ' VAL . 95.3 mt -63.95 143.41 15.7 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.142 0 O-C-N 121.665 -0.647 . . . . 0.0 110.333 -172.073 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . 0.623 HG21 ' HB2' ' A' ' 38' ' ' ARG . 7.5 p -121.25 -27.01 4.95 Favored 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.721 -0.612 . . . . 0.0 111.336 -179.887 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 27' ' ' ASN . . . . . 0.528 ' O ' HD12 ' A' ' 35' ' ' LEU . 27.2 t30 -162.03 160.67 27.84 Favored 'General case' 0 N--CA 1.499 1.991 0 C-N-CA 119.002 -1.079 . . . . 0.0 111.814 -179.109 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 28' ' ' PHE . . . . . 0.553 ' HE1' HG21 ' A' ' 49' ' ' THR . 83.3 t80 -150.19 126.73 10.86 Favored 'General case' 0 N--CA 1.497 1.901 0 N-CA-C 108.964 -0.754 . . . . 0.0 108.964 170.599 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 21.3 t70 -99.73 130.51 45.95 Favored 'General case' 0 N--CA 1.491 1.597 0 N-CA-C 108.955 -0.757 . . . . 0.0 108.955 -177.431 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 20.1 m -70.31 -51.68 28.4 Favored 'General case' 0 N--CA 1.498 1.946 0 C-N-CA 119.999 -0.681 . . . . 0.0 110.394 -176.9 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 23.1 m -60.07 -41.25 92.02 Favored 'General case' 0 N--CA 1.502 2.17 0 O-C-N 121.619 -0.676 . . . . 0.0 110.829 -174.967 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 29.8 m120 -103.91 -10.14 18.4 Favored 'General case' 0 N--CA 1.496 1.87 0 O-C-N 121.624 -0.673 . . . . 0.0 111.613 -177.662 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 1.8 m 49.91 67.34 0.92 Allowed 'General case' 0 N--CA 1.509 2.51 0 O-C-N 121.098 -1.001 . . . . 0.0 111.07 -175.776 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 34' ' ' ILE . . . . . 1.128 HD12 HG22 ' A' ' 48' ' ' VAL . 47.4 mm -126.69 127.03 69.76 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.167 0 O-C-N 121.597 -0.689 . . . . 0.0 109.479 -176.066 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.528 HD12 ' O ' ' A' ' 27' ' ' ASN . 11.7 tp -115.88 121.61 42.87 Favored 'General case' 0 N--CA 1.494 1.765 0 O-C-N 121.708 -0.62 . . . . 0.0 110.521 -170.432 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 79.5 mt-30 -91.61 134.19 34.9 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.829 -0.544 . . . . 0.0 109.539 173.83 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 0.409 HD23 ' HA ' ' A' ' 25' ' ' ILE . 13.9 mt -117.82 123.81 46.83 Favored 'General case' 0 N--CA 1.493 1.725 0 O-C-N 121.798 -0.564 . . . . 0.0 109.989 174.52 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 38' ' ' ARG . . . . . 0.623 ' HB2' HG21 ' A' ' 26' ' ' THR . 56.6 ttt85 -98.42 107.69 20.2 Favored 'General case' 0 N--CA 1.497 1.878 0 O-C-N 121.63 -0.669 . . . . 0.0 109.756 175.986 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.496 HD13 ' O ' ' A' ' 22' ' ' ARG . 18.9 tp -85.1 150.75 24.63 Favored 'General case' 0 N--CA 1.495 1.797 0 O-C-N 121.697 -0.627 . . . . 0.0 110.993 -173.933 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -63.15 -9.17 9.83 Favored 'General case' 0 N--CA 1.503 2.184 0 O-C-N 121.922 -0.486 . . . . 0.0 111.962 -173.223 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 37.7 t30 -85.01 29.08 0.66 Allowed 'General case' 0 N--CA 1.499 2.018 0 O-C-N 121.146 -0.971 . . . . 0.0 110.952 174.202 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 74.4 m-20 59.67 31.81 21.1 Favored 'General case' 0 N--CA 1.504 2.27 0 O-C-N 121.257 -0.902 . . . . 0.0 110.428 174.176 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 48.9 m -123.92 137.78 54.58 Favored 'General case' 0 N--CA 1.496 1.859 0 O-C-N 121.394 -0.816 . . . . 0.0 110.374 178.836 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 9.0 t -97.55 150.21 21.35 Favored 'General case' 0 N--CA 1.497 1.906 0 O-C-N 121.735 -0.603 . . . . 0.0 110.212 176.244 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 42.1 tttp -149.81 119.16 6.85 Favored 'General case' 0 N--CA 1.496 1.861 0 O-C-N 121.662 -0.649 . . . . 0.0 110.255 178.466 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 90.3 p -96.07 122.63 39.12 Favored 'General case' 0 N--CA 1.495 1.807 0 O-C-N 121.676 -0.64 . . . . 0.0 110.21 178.431 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 82.5 mt -129.27 135.68 61.24 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.845 0 O-C-N 121.565 -0.709 . . . . 0.0 109.328 179.835 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 48' ' ' VAL . . . . . 1.128 HG22 HD12 ' A' ' 34' ' ' ILE . 58.7 t -81.95 127.57 39.5 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.902 0 O-C-N 121.531 -0.731 . . . . 0.0 109.232 179.56 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 49' ' ' THR . . . . . 0.553 HG21 ' HE1' ' A' ' 28' ' ' PHE . 37.4 p -59.41 -24.81 63.78 Favored 'General case' 0 N--CA 1.504 2.273 0 O-C-N 121.659 -0.651 . . . . 0.0 112.055 -170.101 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 73.5 tttt -56.23 -22.78 31.62 Favored 'General case' 0 N--CA 1.503 2.183 0 O-C-N 121.401 -0.812 . . . . 0.0 111.1 -177.161 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 51.4 p30 -83.8 0.92 45.42 Favored 'General case' 0 N--CA 1.499 1.985 0 O-C-N 121.443 -0.786 . . . . 0.0 111.358 176.369 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 96.3 mt -75.99 127.76 37.36 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.089 0 O-C-N 121.162 -0.961 . . . . 0.0 110.084 178.72 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 75.0 tttt -91.76 -32.39 15.41 Favored 'General case' 0 N--CA 1.493 1.711 0 N-CA-C 109.443 -0.577 . . . . 0.0 109.443 169.901 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -161.47 157.29 24.79 Favored 'General case' 0 N--CA 1.497 1.898 0 O-C-N 121.723 -0.611 . . . . 0.0 109.815 -177.037 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . 0.591 ' CD2' HG22 ' A' ' 13' ' ' VAL . 85.2 mt -132.92 148.55 52.28 Favored 'General case' 0 N--CA 1.497 1.904 0 O-C-N 121.65 -0.656 . . . . 0.0 110.462 -179.851 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 6.5 ptm180 -150.76 139.6 20.85 Favored 'General case' 0 N--CA 1.495 1.782 0 O-C-N 121.765 -0.584 . . . . 0.0 109.94 176.335 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 57' ' ' ILE . . . . . 0.471 ' HA ' HG12 ' A' ' 11' ' ' VAL . 67.7 mt -84.98 133.26 29.73 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.872 0 O-C-N 121.522 -0.736 . . . . 0.0 109.671 174.079 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . 0.588 HD11 ' HB2' ' A' ' 12' ' ' GLU . 45.1 mt -83.69 155.61 65.22 Favored Pre-proline 0 N--CA 1.498 1.952 0 O-C-N 121.566 -0.709 . . . . 0.0 110.255 -178.462 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 17.9 Cg_exo -62.56 157.94 44.01 Favored 'Trans proline' 0 N--CA 1.49 1.295 0 O-C-N 123.573 1.301 . . . . 0.0 110.627 178.618 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 65.6 tttt -79.83 139.03 37.34 Favored 'General case' 0 N--CA 1.497 1.917 0 O-C-N 121.758 -0.589 . . . . 0.0 110.036 179.483 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 24.2 p30 -129.08 172.8 11.04 Favored 'General case' 0 N--CA 1.497 1.912 0 O-C-N 121.714 -0.616 . . . . 0.0 110.283 179.977 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 46.7 mt-10 -120.7 99.4 6.51 Favored 'General case' 0 N--CA 1.496 1.871 0 O-C-N 121.707 -0.621 . . . . 0.0 110.27 -179.432 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 63' ' ' ILE . . . . . 0.438 HG22 ' N ' ' A' ' 64' ' ' MET . 46.9 mm 58.14 164.98 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.509 2.495 0 CA-C-O 121.404 0.621 . . . . 0.0 110.783 179.272 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 64' ' ' MET . . . . . 0.438 ' N ' HG22 ' A' ' 63' ' ' ILE . 45.7 mtm 52.19 60.4 13.43 Favored Pre-proline 0 N--CA 1.505 2.287 0 O-C-N 121.403 -0.811 . . . . 0.0 111.093 178.781 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 28.7 Cg_endo -67.6 -38.93 13.08 Favored 'Trans proline' 0 N--CA 1.488 1.167 0 O-C-N 123.502 1.264 . . . . 0.0 110.351 178.727 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 24.9 pttm -139.6 164.95 28.54 Favored 'General case' 0 N--CA 1.496 1.828 0 O-C-N 121.674 -0.641 . . . . 0.0 110.365 179.583 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 43.2 t-20 -64.17 -38.48 91.23 Favored 'General case' 0 N--CA 1.501 2.094 0 O-C-N 121.645 -0.66 . . . . 0.0 110.41 179.586 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 71.93 -75.63 0.74 Allowed Glycine 0 N--CA 1.493 2.477 0 N-CA-C 109.708 -1.357 . . . . 0.0 109.708 179.21 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 24.0 m -65.35 -35.47 81.08 Favored 'General case' 0 N--CA 1.5 2.042 0 O-C-N 121.697 -0.884 . . . . 0.0 110.458 -178.918 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 50.5 tttm 53.49 91.78 0.02 OUTLIER 'General case' 0 N--CA 1.505 2.315 0 O-C-N 121.632 -0.667 . . . . 0.0 110.847 -178.982 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 91.6 p -100.65 169.74 7.5 Favored Pre-proline 0 N--CA 1.495 1.782 0 O-C-N 121.655 -0.653 . . . . 0.0 110.288 -179.084 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 22.2 Cg_exo -61.27 153.59 64.25 Favored 'Trans proline' 0 N--CA 1.49 1.296 0 O-C-N 123.634 1.333 . . . . 0.0 110.743 -179.81 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 8.4 t 57.02 170.34 0.04 OUTLIER 'General case' 0 N--CA 1.506 2.328 0 O-C-N 121.658 -0.651 . . . . 0.0 111.056 -178.79 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 38.1 p -97.37 -30.81 12.72 Favored 'General case' 0 N--CA 1.495 1.796 0 O-C-N 121.614 -0.679 . . . . 0.0 110.531 -179.411 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 91.5 m-20 -101.17 123.13 44.83 Favored 'General case' 0 N--CA 1.495 1.801 0 O-C-N 121.598 -0.689 . . . . 0.0 110.357 -178.665 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 76' ' ' SER . . . . . 0.49 ' HB2' HD11 ' A' ' 79' ' ' LEU . 49.5 m -129.11 149.03 51.09 Favored 'General case' 0 N--CA 1.495 1.786 0 O-C-N 121.722 -0.611 . . . . 0.0 110.13 178.875 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 9.9 t -138.02 156.91 47.33 Favored 'General case' 0 N--CA 1.497 1.875 0 O-C-N 121.7 -0.625 . . . . 0.0 110.514 -179.767 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 56.3 mttm 53.44 37.03 24.65 Favored 'General case' 0 N--CA 1.505 2.304 0 O-C-N 121.562 -0.711 . . . . 0.0 110.997 178.406 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . 0.49 HD11 ' HB2' ' A' ' 76' ' ' SER . 83.9 mt -68.57 -43.55 76.33 Favored 'General case' 0 N--CA 1.499 1.995 0 O-C-N 121.54 -0.725 . . . . 0.0 110.238 179.145 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 75.0 mttt 52.31 32.29 10.73 Favored 'General case' 0 N--CA 1.506 2.354 0 O-C-N 121.62 -0.675 . . . . 0.0 111.0 179.712 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 90.2 p -68.17 -33.14 73.9 Favored 'General case' 0 N--CA 1.498 1.941 0 O-C-N 121.691 -0.63 . . . . 0.0 110.324 -179.226 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -112.28 146.4 38.27 Favored 'General case' 0 N--CA 1.494 1.749 0 O-C-N 121.619 -0.675 . . . . 0.0 110.271 -179.832 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 78.7 mt-10 -112.82 99.05 7.6 Favored 'General case' 0 N--CA 1.496 1.836 0 O-C-N 121.69 -0.631 . . . . 0.0 110.144 179.306 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 10.2 t -141.65 155.4 45.7 Favored 'General case' 0 N--CA 1.496 1.85 0 O-C-N 121.654 -0.654 . . . . 0.0 110.341 179.703 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 49.2 p90 -147.3 161.51 40.83 Favored 'General case' 0 N--CA 1.494 1.748 0 O-C-N 121.69 -0.631 . . . . 0.0 110.321 179.34 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 32.7 t -142.47 135.96 28.95 Favored 'General case' 0 N--CA 1.495 1.777 0 O-C-N 121.741 -0.6 . . . . 0.0 110.138 179.286 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 86.3 p -118.8 27.94 8.59 Favored 'General case' 0 N--CA 1.497 1.887 0 O-C-N 121.624 -0.673 . . . . 0.0 110.614 179.505 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 98.3 mttt -95.25 -68.89 0.78 Allowed 'General case' 0 N--CA 1.496 1.848 0 O-C-N 121.541 -0.724 . . . . 0.0 110.197 -179.727 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 91.6 m-20 -124.95 115.69 20.99 Favored 'General case' 0 N--CA 1.495 1.809 0 O-C-N 121.604 -0.685 . . . . 0.0 110.185 179.525 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 51.4 tttm -66.12 -41.64 90.25 Favored 'General case' 0 N--CA 1.5 2.032 0 O-C-N 121.62 -0.675 . . . . 0.0 110.285 179.615 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 91' ' ' TRP . . . . . . . . . . . . . 64.9 p-90 -145.16 158.73 43.74 Favored 'General case' 0 N--CA 1.497 1.88 0 O-C-N 121.689 -0.632 . . . . 0.0 110.301 -179.929 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 26.2 t -147.98 147.74 29.97 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.596 -0.69 . . . . 0.0 110.228 179.807 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 93' ' ' MET . . . . . . . . . . . . . 22.8 ptm -152.02 33.61 0.53 Allowed 'General case' 0 N--CA 1.496 1.828 0 O-C-N 121.657 -0.652 . . . . 0.0 110.357 179.559 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 . . . . . 0 N--CA 1.494 1.762 0 CA-C-O 117.988 -1.006 . . . . 0.0 110.202 179.979 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' B' B ' 240' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.313 0 N-CA-C 109.531 -1.427 . . . . 0.0 109.531 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' B' B ' 241' ' ' ALA . . . . . . . . . . . . . . . -67.14 -33.19 74.9 Favored 'General case' 0 N--CA 1.499 2.015 0 O-C-N 121.607 -0.937 . . . . 0.0 110.35 179.969 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 242' ' ' THR . . . . . . . . . . . . . 9.7 t -133.08 161.3 34.76 Favored 'General case' 0 N--CA 1.497 1.884 0 O-C-N 121.673 -0.642 . . . . 0.0 110.349 -179.932 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 243' ' ' THR . . . . . . . . . . . . . 21.7 m -93.29 135.38 34.56 Favored 'General case' 0 N--CA 1.495 1.779 0 O-C-N 121.626 -0.671 . . . . 0.0 110.18 -179.832 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 244' ' ' LYS . . . . . . . . . . . . . 35.8 tttp -101.26 33.14 2.99 Favored 'General case' 0 N--CA 1.494 1.763 0 O-C-N 121.66 -0.65 . . . . 0.0 110.26 -179.043 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 245' ' ' GLU . . . . . . . . . . . . . 78.4 mt-10 53.37 100.01 0.01 OUTLIER 'General case' 0 N--CA 1.507 2.393 0 O-C-N 121.688 -0.632 . . . . 0.0 111.16 -179.224 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 246' ' ' LYS . . . . . . . . . . . . . 40.6 tttp -60.19 -32.86 71.48 Favored 'General case' 0 N--CA 1.502 2.157 0 O-C-N 121.56 -0.713 . . . . 0.0 110.496 -179.171 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 247' ' ' ASN . . . . . . . . . . . . . 91.1 m-20 -96.33 137.01 36.03 Favored 'General case' 0 N--CA 1.495 1.81 0 O-C-N 121.708 -0.62 . . . . 0.0 110.06 178.659 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 248' ' ' ILE . . . . . 0.431 HG22 ' N ' ' B' ' 249' ' ' SER . 74.2 mt 57.84 164.09 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.509 2.505 0 O-C-N 121.715 -0.616 . . . . 0.0 110.617 -178.349 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 249' ' ' SER . . . . . 0.431 ' N ' HG22 ' B' ' 248' ' ' ILE . 87.9 p -116.01 157.02 25.28 Favored 'General case' 0 N--CA 1.495 1.819 0 O-C-N 121.426 -0.796 . . . . 0.0 110.335 -179.793 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 250' ' ' VAL . . . . . . . . . . . . . 59.2 t -89.26 137.94 20.26 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.948 0 O-C-N 121.728 -0.607 . . . . 0.0 109.647 179.857 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 251' ' ' ASP . . . . . . . . . . . . . 16.6 t70 -161.81 166.76 25.96 Favored 'General case' 0 N--CA 1.495 1.793 0 O-C-N 121.746 -0.597 . . . . 0.0 110.216 -179.393 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 252' ' ' VAL . . . . . 0.418 HG13 ' N ' ' B' ' 253' ' ' ASP . 11.9 p -162.1 -40.35 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.498 1.964 0 O-C-N 121.769 -0.582 . . . . 0.0 110.426 -179.897 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 253' ' ' ASP . . . . . 0.418 ' N ' HG13 ' B' ' 252' ' ' VAL . 1.2 m-20 52.5 95.78 0.02 OUTLIER 'General case' 0 N--CA 1.505 2.324 0 O-C-N 121.507 -0.745 . . . . 0.0 111.194 179.304 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 254' ' ' ALA . . . . . . . . . . . . . . . -65.95 -31.05 71.74 Favored 'General case' 0 N--CA 1.5 2.07 0 O-C-N 121.686 -0.634 . . . . 0.0 110.403 179.469 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 255' ' ' ASP . . . . . . . . . . . . . 74.4 m-20 -72.55 -29.74 63.83 Favored 'General case' 0 N--CA 1.499 1.989 0 O-C-N 121.653 -0.654 . . . . 0.0 110.254 178.453 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 256' ' ' ALA . . . . . . . . . . . . . . . -63.13 -31.02 72.06 Favored 'General case' 0 N--CA 1.5 2.049 0 O-C-N 121.462 -0.774 . . . . 0.0 110.333 177.935 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 257' ' ' SER . . . . . . . . . . . . . 6.6 t -54.91 -34.93 63.61 Favored 'General case' 0 N--CA 1.503 2.198 0 O-C-N 121.558 -0.714 . . . . 0.0 110.421 176.884 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 258' ' ' SER . . . . . . . . . . . . . 24.8 m -68.09 -32.53 72.91 Favored 'General case' 0 N--CA 1.497 1.908 0 O-C-N 121.864 -0.522 . . . . 0.0 110.239 179.983 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 259' ' ' GLN . . . . . . . . . . . . . 78.1 mt-30 -64.64 -35.03 79.71 Favored 'General case' 0 N--CA 1.5 2.028 0 O-C-N 121.593 -0.692 . . . . 0.0 110.367 179.782 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 260' ' ' LEU . . . . . 0.544 ' HA ' HD12 ' B' ' 263' ' ' LEU . 51.4 mt -65.52 -43.4 90.17 Favored 'General case' 0 N--CA 1.501 2.082 0 O-C-N 121.67 -0.644 . . . . 0.0 110.281 179.045 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 261' ' ' LEU . . . . . . . . . . . . . 21.5 tp -71.05 -36.94 72.5 Favored 'General case' 0 N--CA 1.498 1.932 0 C-N-CA 120.088 -0.645 . . . . 0.0 109.586 174.97 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 262' ' ' SER . . . . . . . . . . . . . 22.6 t -62.25 -35.69 79.73 Favored 'General case' 0 N--CA 1.501 2.09 0 O-C-N 121.714 -0.616 . . . . 0.0 110.438 175.893 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 263' ' ' LEU . . . . . 0.544 HD12 ' HA ' ' B' ' 260' ' ' LEU . 16.2 mt -64.43 -41.46 96.58 Favored 'General case' 0 N--CA 1.5 2.068 0 O-C-N 121.683 -0.635 . . . . 0.0 110.242 179.433 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 264' ' ' LEU . . . . . 0.44 ' CD1' HD11 ' A' ' 55' ' ' LEU . 87.9 mt -62.14 -35.63 79.35 Favored 'General case' 0 N--CA 1.502 2.171 0 O-C-N 121.695 -0.628 . . . . 0.0 110.291 176.563 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 265' ' ' LYS . . . . . . . . . . . . . 57.4 tttm -75.21 -32.23 61.12 Favored 'General case' 0 N--CA 1.498 1.967 0 O-C-N 121.818 -0.551 . . . . 0.0 110.085 178.009 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 266' ' ' SER . . . . . . . . . . . . . 29.1 t -162.62 118.56 1.89 Allowed 'General case' 0 N--CA 1.496 1.843 0 O-C-N 121.679 -0.638 . . . . 0.0 109.956 178.993 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 267' ' ' SER . . . . . . . . . . . . . 24.2 m -67.07 -33.9 76.5 Favored 'General case' 0 N--CA 1.5 2.03 0 O-C-N 121.719 -0.613 . . . . 0.0 110.514 -178.286 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 268' ' ' THR . . . . . . . . . . . . . 21.8 m -65.18 -51.59 60.12 Favored 'General case' 0 N--CA 1.5 2.069 0 O-C-N 121.636 -0.665 . . . . 0.0 110.464 -177.231 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 269' ' ' ALA . . . . . . . . . . . . . . . 46.32 55.75 15.88 Favored Pre-proline 0 N--CA 1.506 2.339 0 O-C-N 121.749 -0.594 . . . . 0.0 111.325 -178.072 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 270' ' ' PRO . . . . . . . . . . . . . 28.0 Cg_endo -67.12 -45.21 4.12 Favored 'Trans proline' 0 N--CA 1.489 1.207 0 O-C-N 123.479 1.252 . . . . 0.0 110.533 -177.758 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 271' ' ' SER . . . . . . . . . . . . . 87.4 p -154.77 174.57 14.86 Favored 'General case' 0 N--CA 1.494 1.772 0 O-C-N 121.687 -0.633 . . . . 0.0 110.325 -178.975 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 272' ' ' ASP . . . . . . . . . . . . . 20.6 t70 -78.05 129.24 35.0 Favored 'General case' 0 N--CA 1.498 1.949 0 O-C-N 121.738 -0.601 . . . . 0.0 109.962 179.678 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 273' ' ' LEU . . . . . 0.426 ' HA ' HD22 ' B' ' 273' ' ' LEU . 0.2 OUTLIER 52.63 80.64 0.09 Allowed 'General case' 0 N--CA 1.506 2.369 0 O-C-N 121.631 -0.668 . . . . 0.0 110.865 -178.654 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' B' B ' 274' ' ' ALA . . . . . . . . . . . . . . . -166.4 154.0 9.9 Favored 'General case' 0 N--CA 1.497 1.909 0 O-C-N 121.528 -0.733 . . . . 0.0 110.011 179.76 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 275' ' ' THR . . . . . . . . . . . . . 7.7 t -68.29 149.12 98.19 Favored Pre-proline 0 N--CA 1.5 2.067 0 C-N-CA 120.251 -0.58 . . . . 0.0 110.232 -179.863 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 276' ' ' PRO . . . . . . . . . . . . . 29.3 Cg_endo -67.51 145.15 69.7 Favored 'Trans proline' 0 N--CA 1.489 1.243 0 O-C-N 123.495 1.26 . . . . 0.0 110.358 179.239 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 277' ' ' GLN . . . . . . . . . . . . . 39.9 mt-30 -127.55 66.1 68.71 Favored Pre-proline 0 N--CA 1.495 1.791 0 O-C-N 121.646 -0.659 . . . . 0.0 110.177 -179.848 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 278' ' ' PRO . . . . . . . . . . . . . 29.9 Cg_endo -67.77 -31.08 32.95 Favored 'Trans proline' 0 N--CA 1.489 1.208 0 O-C-N 123.414 1.218 . . . . 0.0 110.611 179.211 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 279' ' ' SER . . . . . . . . . . . . . 22.8 t -63.56 -35.02 79.1 Favored 'General case' 0 N--CA 1.502 2.135 0 O-C-N 121.598 -0.689 . . . . 0.0 110.631 -178.431 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 280' ' ' THR . . . . . . . . . . . . . 37.8 p -105.17 29.07 6.69 Favored 'General case' 0 N--CA 1.497 1.886 0 O-C-N 121.685 -0.634 . . . . 0.0 110.608 -179.623 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 281' ' ' PHE . . . . . . . . . . . . . 85.1 t80 -131.96 73.11 78.78 Favored Pre-proline 0 N--CA 1.494 1.74 0 O-C-N 121.511 -0.743 . . . . 0.0 110.113 179.485 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 282' ' ' PRO . . . . . . . . . . . . . 29.6 Cg_endo -67.8 124.26 11.68 Favored 'Trans proline' 0 N--CA 1.488 1.168 0 O-C-N 123.49 1.258 . . . . 0.0 110.354 -179.819 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 283' ' ' GLN . . . . . . . . . . . . . 7.9 mt-30 -76.42 -56.27 1.53 Allowed Pre-proline 0 N--CA 1.498 1.927 0 O-C-N 121.661 -0.65 . . . . 0.0 110.634 179.532 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 284' ' ' PRO . . . . . . . . . . . . . 41.4 Cg_endo -73.2 154.8 51.96 Favored 'Trans proline' 0 N--CA 1.487 1.115 0 O-C-N 123.338 1.178 . . . . 0.0 110.401 -178.541 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 285' ' ' PRO . . . . . . . . . . . . . 29.7 Cg_endo -67.97 154.33 73.03 Favored 'Trans proline' 0 N--CA 1.488 1.183 0 O-C-N 123.7 1.368 . . . . 0.0 110.356 179.314 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 286' ' ' VAL . . . . . . . . . . . . . 26.8 m -126.64 157.14 37.7 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.981 0 O-C-N 121.648 -0.658 . . . . 0.0 110.212 179.657 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 287' ' ' GLU . . . . . . . . . . . . . 46.0 tt0 -99.95 137.45 38.39 Favored 'General case' 0 N--CA 1.495 1.808 0 O-C-N 121.68 -0.637 . . . . 0.0 110.171 -179.438 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 288' ' ' SER . . . . . . . . . . . . . 28.6 t -127.33 144.71 51.0 Favored 'General case' 0 N--CA 1.495 1.81 0 O-C-N 121.672 -0.643 . . . . 0.0 110.166 179.701 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 289' ' ' HIS . . . . . . . . . . . . . 83.7 t60 -117.2 129.15 55.75 Favored 'General case' 0 N--CA 1.496 1.845 0 O-C-N 121.637 -0.664 . . . . 0.0 110.153 -179.99 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 290' ' ' SER . . . . . . . . . . . . . 29.8 t -122.6 143.25 49.87 Favored 'General case' 0 N--CA 1.495 1.793 0 O-C-N 121.617 -0.677 . . . . 0.0 110.213 -179.93 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 291' ' ' SER . . . . . . . . . . . . . 10.3 t . . . . . 0 N--CA 1.494 1.767 0 CA-C-O 117.995 -1.002 . . . . 0.0 110.223 179.977 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' -1' ' ' MET . . . . . . . . . . . . . 23.1 ptt? . . . . . 0 N--CA 1.496 1.84 0 CA-C-O 121.029 0.442 . . . . 0.0 110.232 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 0' ' ' GLY . . . . . . . . . . . . . . . 170.15 -175.46 44.14 Favored Glycine 0 N--CA 1.494 2.538 0 N-CA-C 109.472 -1.451 . . . . 0.0 109.472 179.955 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 74.9 mtm -124.66 156.61 37.25 Favored 'General case' 0 N--CA 1.495 1.788 0 O-C-N 121.701 -0.882 . . . . 0.0 110.227 179.708 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 66.2 m -100.99 172.33 7.09 Favored 'General case' 0 N--CA 1.495 1.786 0 O-C-N 121.771 -0.581 . . . . 0.0 110.181 -179.812 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 3' ' ' VAL . . . . . 0.472 HG12 ' CE1' ' A' ' 7' ' ' TYR . 69.5 t -66.46 -27.82 41.51 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.048 0 O-C-N 121.652 -0.655 . . . . 0.0 110.254 -179.265 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -55.17 -31.27 61.23 Favored 'General case' 0 N--CA 1.504 2.273 0 O-C-N 121.499 -0.751 . . . . 0.0 110.42 -178.891 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 74.5 m-20 -68.63 -31.33 70.4 Favored 'General case' 0 N--CA 1.499 1.99 0 O-C-N 121.883 -0.511 . . . . 0.0 110.131 174.714 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 87.4 m-85 -95.59 10.05 38.07 Favored 'General case' 0 N--CA 1.497 1.887 0 O-C-N 121.641 -0.662 . . . . 0.0 111.398 -179.573 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 7' ' ' TYR . . . . . 0.472 ' CE1' HG12 ' A' ' 3' ' ' VAL . 3.1 m-30 -67.24 144.05 56.16 Favored 'General case' 0 N--CA 1.502 2.128 0 O-C-N 121.154 -0.966 . . . . 0.0 110.042 175.52 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 8' ' ' GLY . . . . . 0.429 ' O ' HG13 ' A' ' 24' ' ' VAL . . . 82.06 0.71 89.88 Favored Glycine 0 N--CA 1.497 2.717 0 N-CA-C 110.483 -1.047 . . . . 0.0 110.483 -175.766 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . 0.478 ' OG ' HD12 ' A' ' 25' ' ' ILE . 89.2 p -77.75 141.04 39.52 Favored 'General case' 0 N--CA 1.497 1.889 0 O-C-N 121.079 -1.248 . . . . 0.0 110.514 -178.851 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 10' ' ' ASN . . . . . 0.699 ' CG ' HG22 ' A' ' 24' ' ' VAL . 2.6 m120 -85.08 120.2 26.32 Favored 'General case' 0 N--CA 1.497 1.92 0 O-C-N 121.665 -0.647 . . . . 0.0 109.495 173.532 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . 0.71 HG21 HD11 ' A' ' 25' ' ' ILE . 35.5 m -143.5 162.93 16.21 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.78 0 O-C-N 121.715 -0.616 . . . . 0.0 109.566 -178.838 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . 0.463 ' HB2' HD11 ' A' ' 58' ' ' LEU . 33.3 tt0 -109.4 127.87 54.7 Favored 'General case' 0 N--CA 1.494 1.729 0 C-N-CA 119.896 -0.722 . . . . 0.0 109.952 177.539 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . 0.592 HG22 ' CD2' ' A' ' 55' ' ' LEU . 60.5 t -106.92 124.1 62.4 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.863 0 O-C-N 121.673 -0.642 . . . . 0.0 109.808 -179.67 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 15.4 tp -96.03 125.96 40.94 Favored 'General case' 0 N--CA 1.494 1.749 0 O-C-N 121.761 -0.587 . . . . 0.0 109.47 175.144 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 83.1 mt -97.44 163.17 12.99 Favored 'General case' 0 N--CA 1.498 1.937 0 O-C-N 121.553 -0.717 . . . . 0.0 111.054 -172.594 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 24.9 p30 -59.21 -21.64 59.81 Favored 'General case' 0 N--CA 1.505 2.294 0 O-C-N 121.722 -0.611 . . . . 0.0 111.489 -177.961 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 25.5 p30 -92.19 23.52 3.79 Favored 'General case' 0 N--CA 1.498 1.959 0 O-C-N 121.532 -0.73 . . . . 0.0 110.977 -176.571 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 74.4 m-20 60.18 28.63 18.22 Favored 'General case' 0 N--CA 1.504 2.265 0 O-C-N 121.414 -0.804 . . . . 0.0 110.836 173.07 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 43.2 m -107.99 134.94 50.18 Favored 'General case' 0 N--CA 1.495 1.793 0 O-C-N 121.491 -0.755 . . . . 0.0 109.567 170.395 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 37.4 ttmt -109.64 137.73 47.04 Favored 'General case' 0 N--CA 1.494 1.761 0 O-C-N 121.756 -0.59 . . . . 0.0 110.345 -176.137 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -153.05 158.86 42.58 Favored 'General case' 0 N--CA 1.496 1.836 0 O-C-N 121.686 -0.634 . . . . 0.0 110.498 -179.782 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . 0.49 ' O ' HD13 ' A' ' 39' ' ' LEU . 42.9 ptt85 -144.02 150.88 38.92 Favored 'General case' 0 N--CA 1.496 1.836 0 O-C-N 121.683 -0.635 . . . . 0.0 110.5 178.838 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -171.64 171.42 44.06 Favored Glycine 0 N--CA 1.494 2.535 0 N-CA-C 108.872 -1.691 . . . . 0.0 108.872 -174.493 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . 0.699 HG22 ' CG ' ' A' ' 10' ' ' ASN . 38.5 t -94.49 117.17 37.58 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.933 0 O-C-N 121.522 -0.987 . . . . 0.0 109.402 -176.519 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 25' ' ' ILE . . . . . 0.71 HD11 HG21 ' A' ' 11' ' ' VAL . 92.0 mt -63.93 143.16 15.94 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.154 0 O-C-N 121.642 -0.661 . . . . 0.0 110.397 -172.157 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . 0.607 HG21 ' HB2' ' A' ' 38' ' ' ARG . 7.8 p -121.21 -26.76 5.01 Favored 'General case' 0 N--CA 1.495 1.785 0 O-C-N 121.685 -0.634 . . . . 0.0 111.245 -179.669 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 7.6 t30 -161.94 156.9 23.01 Favored 'General case' 0 N--CA 1.5 2.051 0 C-N-CA 118.88 -1.128 . . . . 0.0 111.726 -178.17 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 28' ' ' PHE . . . . . 0.528 ' CE1' HG21 ' A' ' 49' ' ' THR . 62.8 t80 -150.07 123.56 9.07 Favored 'General case' 0 N--CA 1.498 1.949 0 N-CA-C 109.373 -0.602 . . . . 0.0 109.373 170.433 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 17.8 t70 -99.3 127.06 45.26 Favored 'General case' 0 N--CA 1.492 1.638 0 N-CA-C 109.162 -0.681 . . . . 0.0 109.162 -178.541 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 22.6 t -64.68 -43.53 93.23 Favored 'General case' 0 N--CA 1.5 2.044 0 O-C-N 121.72 -0.612 . . . . 0.0 110.907 -174.709 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 21.1 m -59.7 -48.09 83.06 Favored 'General case' 0 N--CA 1.502 2.166 0 O-C-N 121.539 -0.726 . . . . 0.0 110.984 -173.444 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 91.5 m-20 -106.99 -0.31 23.15 Favored 'General case' 0 N--CA 1.498 1.966 0 O-C-N 121.613 -0.679 . . . . 0.0 111.675 -179.364 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 45.2 p 45.26 67.02 0.78 Allowed 'General case' 0 N--CA 1.507 2.391 0 O-C-N 121.494 -0.754 . . . . 0.0 111.212 -174.986 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 34' ' ' ILE . . . . . 0.976 HD12 HG22 ' A' ' 48' ' ' VAL . 41.3 mm -114.48 125.86 71.88 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.963 0 O-C-N 121.629 -0.669 . . . . 0.0 109.213 -176.047 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 10.2 tp -115.75 118.84 34.16 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.604 -0.685 . . . . 0.0 110.416 -169.554 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 99.3 mt-30 -91.38 133.13 35.72 Favored 'General case' 0 N--CA 1.49 1.528 0 N-CA-C 109.381 -0.6 . . . . 0.0 109.381 173.731 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 14.6 mt -117.88 123.8 46.76 Favored 'General case' 0 N--CA 1.494 1.753 0 O-C-N 121.837 -0.539 . . . . 0.0 109.945 175.107 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 38' ' ' ARG . . . . . 0.607 ' HB2' HG21 ' A' ' 26' ' ' THR . 72.5 ttt180 -97.36 105.01 17.08 Favored 'General case' 0 N--CA 1.495 1.813 0 O-C-N 121.672 -0.643 . . . . 0.0 109.783 176.001 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.49 HD13 ' O ' ' A' ' 22' ' ' ARG . 22.0 tp -85.16 154.3 22.1 Favored 'General case' 0 N--CA 1.494 1.765 0 O-C-N 121.716 -0.615 . . . . 0.0 111.075 -173.624 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -65.54 -6.48 10.94 Favored 'General case' 0 N--CA 1.503 2.179 0 O-C-N 121.955 -0.466 . . . . 0.0 112.149 -169.961 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 49.4 p-10 -86.17 29.15 0.76 Allowed 'General case' 0 N--CA 1.5 2.064 0 O-C-N 121.12 -0.987 . . . . 0.0 110.873 174.199 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 74.3 m-20 57.65 29.68 17.66 Favored 'General case' 0 N--CA 1.504 2.24 0 O-C-N 121.252 -0.905 . . . . 0.0 110.36 177.126 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 37.8 m -120.62 137.87 54.2 Favored 'General case' 0 N--CA 1.496 1.852 0 O-C-N 121.458 -0.776 . . . . 0.0 110.397 178.996 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 9.7 t -97.47 150.99 20.45 Favored 'General case' 0 N--CA 1.497 1.878 0 O-C-N 121.76 -0.588 . . . . 0.0 110.222 176.46 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 40.9 tttp -148.61 119.14 7.42 Favored 'General case' 0 N--CA 1.497 1.886 0 O-C-N 121.591 -0.693 . . . . 0.0 110.269 178.05 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 91.0 p -96.59 122.12 39.16 Favored 'General case' 0 N--CA 1.494 1.736 0 O-C-N 121.635 -0.666 . . . . 0.0 110.284 179.027 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 82.8 mt -129.32 133.94 64.65 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.909 0 O-C-N 121.628 -0.67 . . . . 0.0 109.422 178.974 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 48' ' ' VAL . . . . . 0.976 HG22 HD12 ' A' ' 34' ' ' ILE . 60.3 t -82.0 127.9 39.2 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.959 0 C-N-CA 120.103 -0.639 . . . . 0.0 109.404 179.41 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 49' ' ' THR . . . . . 0.528 HG21 ' CE1' ' A' ' 28' ' ' PHE . 37.5 p -57.86 -24.83 59.35 Favored 'General case' 0 N--CA 1.505 2.3 0 O-C-N 121.734 -0.604 . . . . 0.0 112.281 -165.869 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 16.6 pttp -56.14 -22.47 28.74 Favored 'General case' 0 N--CA 1.506 2.337 0 O-C-N 121.515 -0.741 . . . . 0.0 111.238 -176.016 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 10.3 p30 -82.01 -1.06 47.0 Favored 'General case' 0 N--CA 1.5 2.046 0 C-N-CA 119.889 -0.724 . . . . 0.0 111.194 176.398 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 89.6 mt -77.37 130.24 36.48 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.082 0 O-C-N 121.223 -0.923 . . . . 0.0 110.129 177.812 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 40.4 tttp -91.53 -31.73 15.83 Favored 'General case' 0 N--CA 1.494 1.766 0 O-C-N 121.772 -0.58 . . . . 0.0 109.496 168.778 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 5.3 m-20 -164.27 159.64 20.19 Favored 'General case' 0 N--CA 1.5 2.052 0 O-C-N 121.832 -0.542 . . . . 0.0 110.063 -177.869 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . 0.592 ' CD2' HG22 ' A' ' 13' ' ' VAL . 83.1 mt -132.99 150.21 52.18 Favored 'General case' 0 N--CA 1.495 1.802 0 O-C-N 121.752 -0.592 . . . . 0.0 110.395 -179.44 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 19.9 ptp180 -150.39 141.39 22.96 Favored 'General case' 0 N--CA 1.495 1.803 0 O-C-N 121.7 -0.625 . . . . 0.0 109.998 175.336 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 57' ' ' ILE . . . . . 0.507 ' HA ' HG12 ' A' ' 11' ' ' VAL . 67.0 mt -85.15 133.21 29.89 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.822 0 O-C-N 121.541 -0.724 . . . . 0.0 109.884 173.702 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . 0.463 HD11 ' HB2' ' A' ' 12' ' ' GLU . 25.2 mt -82.11 159.44 65.27 Favored Pre-proline 0 N--CA 1.497 1.901 0 O-C-N 121.652 -0.655 . . . . 0.0 110.095 -179.337 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 22.1 Cg_endo -65.33 149.33 88.44 Favored 'Trans proline' 0 N--CA 1.49 1.286 0 O-C-N 123.736 1.387 . . . . 0.0 110.583 -177.685 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 39.1 tttp -126.4 138.46 53.55 Favored 'General case' 0 N--CA 1.496 1.853 0 O-C-N 121.729 -0.607 . . . . 0.0 110.089 179.724 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 30.4 m120 53.38 -179.22 0.02 OUTLIER 'General case' 0 N--CA 1.506 2.326 0 O-C-N 121.607 -0.683 . . . . 0.0 111.099 -179.85 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 27.8 tp10 -126.78 142.44 51.54 Favored 'General case' 0 N--CA 1.495 1.797 0 O-C-N 121.607 -0.683 . . . . 0.0 110.22 -179.748 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 50.8 mm -68.89 -38.71 79.0 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.055 0 O-C-N 121.626 -0.671 . . . . 0.0 109.816 -179.569 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 64' ' ' MET . . . . . . . . . . . . . 41.3 mtm 55.52 173.01 0.04 OUTLIER Pre-proline 0 N--CA 1.507 2.422 0 O-C-N 121.704 -0.623 . . . . 0.0 111.203 -179.67 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 17.5 Cg_exo -63.72 156.37 57.95 Favored 'Trans proline' 0 N--CA 1.491 1.339 0 O-C-N 123.474 1.249 . . . . 0.0 110.485 179.234 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 74.4 mttt -88.53 134.03 33.98 Favored 'General case' 0 N--CA 1.497 1.918 0 O-C-N 121.721 -0.612 . . . . 0.0 110.08 -179.904 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 91.7 m-20 -132.95 161.19 34.95 Favored 'General case' 0 N--CA 1.496 1.831 0 O-C-N 121.713 -0.617 . . . . 0.0 110.184 -179.742 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . -96.05 53.11 1.63 Allowed Glycine 0 N--CA 1.495 2.598 0 N-CA-C 109.493 -1.443 . . . . 0.0 109.493 179.588 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 69' ' ' THR . . . . . 0.538 HG23 ' O ' ' A' ' 69' ' ' THR . 5.3 t -115.06 84.66 2.12 Favored 'General case' 0 N--CA 1.499 2.024 0 O-C-N 121.684 -0.892 . . . . 0.0 110.345 -179.364 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 55.0 mttm -93.53 154.57 17.81 Favored 'General case' 0 N--CA 1.496 1.86 0 O-C-N 121.63 -0.669 . . . . 0.0 110.17 -179.983 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 4.1 m -68.81 166.49 26.8 Favored Pre-proline 0 N--CA 1.498 1.958 0 O-C-N 121.665 -0.647 . . . . 0.0 110.23 -179.851 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 23.4 Cg_exo -60.63 -31.37 92.09 Favored 'Trans proline' 0 N--CA 1.491 1.364 0 O-C-N 123.662 1.348 . . . . 0.0 110.729 -179.386 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 29.8 t -123.42 134.15 53.99 Favored 'General case' 0 N--CA 1.494 1.74 0 O-C-N 121.64 -0.663 . . . . 0.0 110.204 179.133 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 40.0 p -129.75 162.73 27.75 Favored 'General case' 0 N--CA 1.495 1.8 0 O-C-N 121.693 -0.63 . . . . 0.0 110.179 179.941 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 15.9 t-20 -64.55 -35.54 81.31 Favored 'General case' 0 N--CA 1.5 2.03 0 O-C-N 121.66 -0.65 . . . . 0.0 110.316 179.303 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 30.4 t -118.69 143.57 46.77 Favored 'General case' 0 N--CA 1.494 1.768 0 O-C-N 121.723 -0.611 . . . . 0.0 110.195 179.753 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 40.2 p -121.58 165.35 15.82 Favored 'General case' 0 N--CA 1.496 1.845 0 O-C-N 121.625 -0.672 . . . . 0.0 110.152 -179.915 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 51.2 mttp -63.47 -37.82 88.75 Favored 'General case' 0 N--CA 1.501 2.081 0 O-C-N 121.575 -0.703 . . . . 0.0 110.406 -179.757 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . 0.46 HD23 ' C ' ' A' ' 79' ' ' LEU . 7.8 tt -110.22 124.48 51.67 Favored 'General case' 0 N--CA 1.494 1.77 0 O-C-N 121.716 -0.615 . . . . 0.0 110.092 178.901 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 56.2 tttm -137.96 133.73 34.07 Favored 'General case' 0 N--CA 1.495 1.783 0 O-C-N 121.652 -0.655 . . . . 0.0 110.179 -179.778 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 98.5 p -121.56 151.47 40.3 Favored 'General case' 0 N--CA 1.496 1.829 0 O-C-N 121.72 -0.612 . . . . 0.0 110.204 179.229 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -151.04 155.78 39.73 Favored 'General case' 0 N--CA 1.494 1.769 0 O-C-N 121.68 -0.637 . . . . 0.0 110.286 -179.823 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 42.8 tt0 -103.63 145.06 30.6 Favored 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.763 -0.586 . . . . 0.0 110.057 179.561 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 23.7 m -107.15 141.79 37.87 Favored 'General case' 0 N--CA 1.495 1.803 0 O-C-N 121.665 -0.647 . . . . 0.0 110.295 -178.807 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 96.9 m-85 -117.14 154.73 30.55 Favored 'General case' 0 N--CA 1.496 1.85 0 O-C-N 121.677 -0.639 . . . . 0.0 110.128 179.876 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 49.6 m -112.19 143.02 43.94 Favored 'General case' 0 N--CA 1.495 1.799 0 O-C-N 121.693 -0.629 . . . . 0.0 110.081 179.469 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 81.6 p -103.89 -56.49 2.19 Favored 'General case' 0 N--CA 1.495 1.775 0 O-C-N 121.678 -0.639 . . . . 0.0 110.425 -178.761 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 73.1 mttt -114.67 135.39 54.2 Favored 'General case' 0 N--CA 1.496 1.838 0 O-C-N 121.642 -0.661 . . . . 0.0 110.331 -178.631 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 91.8 m-20 -135.44 31.06 3.17 Favored 'General case' 0 N--CA 1.496 1.866 0 O-C-N 121.667 -0.646 . . . . 0.0 110.327 178.595 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -110.24 32.38 5.19 Favored 'General case' 0 N--CA 1.495 1.821 0 O-C-N 121.613 -0.679 . . . . 0.0 110.286 -178.975 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 91' ' ' TRP . . . . . . . . . . . . . 97.1 m95 -87.98 -54.07 4.42 Favored 'General case' 0 N--CA 1.498 1.953 0 O-C-N 121.61 -0.681 . . . . 0.0 110.178 -179.701 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 28.7 t -135.42 142.11 45.57 Favored 'General case' 0 N--CA 1.495 1.789 0 O-C-N 121.611 -0.68 . . . . 0.0 110.246 -179.965 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 93' ' ' MET . . . . . . . . . . . . . 65.5 mtt -65.95 -34.86 79.07 Favored 'General case' 0 N--CA 1.5 2.057 0 O-C-N 121.628 -0.67 . . . . 0.0 110.289 179.558 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 17.2 t70 . . . . . 0 N--CA 1.495 1.782 0 CA-C-O 118.021 -0.99 . . . . 0.0 110.138 -179.976 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' B' B ' 240' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.217 0 N-CA-C 109.585 -1.406 . . . . 0.0 109.585 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' B' B ' 241' ' ' ALA . . . . . . . . . . . . . . . -67.49 -34.06 76.38 Favored 'General case' 0 N--CA 1.499 1.975 0 O-C-N 121.687 -0.89 . . . . 0.0 110.222 -179.874 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 242' ' ' THR . . . . . . . . . . . . . 24.5 m -66.6 -39.19 88.28 Favored 'General case' 0 N--CA 1.499 2.022 0 O-C-N 121.627 -0.671 . . . . 0.0 110.211 179.941 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 243' ' ' THR . . . . . . . . . . . . . 15.6 m 51.9 83.61 0.05 Allowed 'General case' 0 N--CA 1.506 2.326 0 O-C-N 121.63 -0.669 . . . . 0.0 111.027 -179.513 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 244' ' ' LYS . . . . . . . . . . . . . 67.9 tttt -66.31 -44.25 83.97 Favored 'General case' 0 N--CA 1.501 2.079 0 O-C-N 121.611 -0.681 . . . . 0.0 110.306 -179.976 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 245' ' ' GLU . . . . . . . . . . . . . 46.3 mt-10 -136.4 143.32 43.92 Favored 'General case' 0 N--CA 1.494 1.762 0 O-C-N 121.65 -0.656 . . . . 0.0 110.197 179.646 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 246' ' ' LYS . . . . . . . . . . . . . 33.6 tttp -107.67 30.14 6.57 Favored 'General case' 0 N--CA 1.497 1.884 0 O-C-N 121.744 -0.598 . . . . 0.0 110.322 179.203 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 247' ' ' ASN . . . . . . . . . . . . . 41.9 t-20 -131.83 126.62 34.76 Favored 'General case' 0 N--CA 1.495 1.822 0 O-C-N 121.635 -0.665 . . . . 0.0 110.161 -179.676 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 248' ' ' ILE . . . . . . . . . . . . . 10.4 tt -162.75 49.15 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.497 1.894 0 O-C-N 121.648 -0.658 . . . . 0.0 110.041 179.908 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 249' ' ' SER . . . . . . . . . . . . . 60.0 p -153.17 -61.02 0.14 Allowed 'General case' 0 N--CA 1.495 1.8 0 O-C-N 121.594 -0.691 . . . . 0.0 110.278 179.833 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 250' ' ' VAL . . . . . 0.479 ' CG1' HG22 ' B' ' 252' ' ' VAL . 61.9 t -90.17 133.67 31.4 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.946 0 O-C-N 121.595 -0.69 . . . . 0.0 109.824 -179.471 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 251' ' ' ASP . . . . . . . . . . . . . 74.4 m-20 -79.99 -32.23 39.78 Favored 'General case' 0 N--CA 1.499 2.024 0 O-C-N 121.716 -0.615 . . . . 0.0 110.305 179.467 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 252' ' ' VAL . . . . . 0.479 HG22 ' CG1' ' B' ' 250' ' ' VAL . 35.3 m -78.86 -165.88 0.07 OUTLIER 'Isoleucine or valine' 0 N--CA 1.501 2.107 0 O-C-N 121.67 -0.644 . . . . 0.0 110.091 179.948 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 253' ' ' ASP . . . . . . . . . . . . . 9.8 p-10 -160.54 75.14 0.55 Allowed 'General case' 0 N--CA 1.496 1.848 0 O-C-N 121.561 -0.712 . . . . 0.0 110.275 -179.704 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 254' ' ' ALA . . . . . . . . . . . . . . . -66.89 -24.61 66.13 Favored 'General case' 0 N--CA 1.501 2.118 0 O-C-N 121.626 -0.672 . . . . 0.0 110.774 179.465 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 255' ' ' ASP . . . . . . . . . . . . . 74.4 m-20 -70.94 -32.45 69.35 Favored 'General case' 0 N--CA 1.499 2.003 0 O-C-N 121.468 -0.77 . . . . 0.0 110.147 -177.975 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 256' ' ' ALA . . . . . . . . . . . . . . . -65.27 -49.96 67.57 Favored 'General case' 0 N--CA 1.501 2.089 0 O-C-N 121.649 -0.657 . . . . 0.0 110.173 177.58 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 257' ' ' SER . . . . . . . . . . . . . 44.9 t -57.18 -40.62 77.69 Favored 'General case' 0 N--CA 1.502 2.16 0 O-C-N 121.636 -0.665 . . . . 0.0 110.563 178.702 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 258' ' ' SER . . . . . . . . . . . . . 83.9 p -69.54 -30.76 68.66 Favored 'General case' 0 N--CA 1.498 1.945 0 C-N-CA 120.359 -0.536 . . . . 0.0 110.295 -178.724 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 259' ' ' GLN . . . . . . . . . . . . . 46.4 tt0 -63.25 -37.81 88.7 Favored 'General case' 0 N--CA 1.501 2.091 0 O-C-N 121.614 -0.679 . . . . 0.0 110.378 179.373 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 260' ' ' LEU . . . . . 0.504 ' HA ' HD12 ' B' ' 263' ' ' LEU . 83.3 mt -66.09 -42.45 89.28 Favored 'General case' 0 N--CA 1.5 2.041 0 O-C-N 121.67 -0.644 . . . . 0.0 110.249 179.627 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 261' ' ' LEU . . . . . 0.436 HD12 HD12 ' A' ' 55' ' ' LEU . 22.5 tp -70.32 -38.14 74.84 Favored 'General case' 0 N--CA 1.497 1.921 0 O-C-N 121.679 -0.638 . . . . 0.0 109.772 176.292 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 262' ' ' SER . . . . . . . . . . . . . 69.7 m -62.51 -35.87 80.75 Favored 'General case' 0 N--CA 1.501 2.097 0 O-C-N 121.767 -0.583 . . . . 0.0 110.533 176.916 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 263' ' ' LEU . . . . . 0.504 HD12 ' HA ' ' B' ' 260' ' ' LEU . 21.4 mt -64.59 -42.77 95.36 Favored 'General case' 0 N--CA 1.501 2.116 0 O-C-N 121.602 -0.686 . . . . 0.0 110.235 -179.822 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 264' ' ' LEU . . . . . . . . . . . . . 86.5 mt -62.48 -36.34 82.18 Favored 'General case' 0 N--CA 1.502 2.129 0 O-C-N 121.702 -0.623 . . . . 0.0 110.435 177.938 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 265' ' ' LYS . . . . . . . . . . . . . 28.1 mtpt -76.51 -26.68 55.52 Favored 'General case' 0 N--CA 1.498 1.937 0 O-C-N 121.799 -0.563 . . . . 0.0 110.539 179.068 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 266' ' ' SER . . . . . . . . . . . . . 32.6 m 52.32 32.46 11.05 Favored 'General case' 0 N--CA 1.506 2.333 0 O-C-N 121.485 -0.759 . . . . 0.0 110.986 -179.367 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 267' ' ' SER . . . . . . . . . . . . . 92.1 p -128.22 159.6 34.71 Favored 'General case' 0 N--CA 1.495 1.796 0 O-C-N 121.676 -0.64 . . . . 0.0 110.066 178.882 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 268' ' ' THR . . . . . 0.433 HG22 ' H ' ' B' ' 269' ' ' ALA . 3.1 m 56.96 172.7 0.04 OUTLIER 'General case' 0 N--CA 1.508 2.464 0 O-C-N 121.557 -0.714 . . . . 0.0 110.645 -179.0 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 269' ' ' ALA . . . . . 0.755 ' HB3' ' HD3' ' B' ' 270' ' ' PRO . . . -170.18 -60.82 0.0 OUTLIER Pre-proline 0 N--CA 1.499 1.998 0 O-C-N 121.48 -0.762 . . . . 0.0 110.423 179.723 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 270' ' ' PRO . . . . . 0.755 ' HD3' ' HB3' ' B' ' 269' ' ' ALA . 29.9 Cg_endo -68.09 125.58 13.24 Favored 'Trans proline' 0 N--CA 1.488 1.194 0 O-C-N 123.151 1.08 . . . . 0.0 110.327 179.676 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 271' ' ' SER . . . . . . . . . . . . . 89.1 p -68.49 -32.25 72.1 Favored 'General case' 0 N--CA 1.5 2.026 0 O-C-N 121.736 -0.602 . . . . 0.0 110.351 179.928 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 272' ' ' ASP . . . . . . . . . . . . . 20.0 t70 -95.95 143.39 27.18 Favored 'General case' 0 N--CA 1.495 1.805 0 O-C-N 121.652 -0.655 . . . . 0.0 110.176 -179.687 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 273' ' ' LEU . . . . . 0.412 ' HA ' HD22 ' B' ' 273' ' ' LEU . 0.2 OUTLIER 53.52 95.93 0.02 OUTLIER 'General case' 0 N--CA 1.506 2.345 0 O-C-N 121.67 -0.644 . . . . 0.0 111.008 179.953 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' B' B ' 274' ' ' ALA . . . . . . . . . . . . . . . -166.0 119.24 1.12 Allowed 'General case' 0 N--CA 1.496 1.838 0 O-C-N 121.588 -0.695 . . . . 0.0 110.071 179.669 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 275' ' ' THR . . . . . . . . . . . . . 35.6 p -127.39 92.19 44.12 Favored Pre-proline 0 N--CA 1.495 1.814 0 O-C-N 121.783 -0.573 . . . . 0.0 110.198 -179.578 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 276' ' ' PRO . . . . . . . . . . . . . 22.5 Cg_endo -66.1 -25.39 51.12 Favored 'Trans proline' 0 N--CA 1.489 1.225 0 O-C-N 123.542 1.285 . . . . 0.0 111.168 -179.18 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 277' ' ' GLN . . . . . . . . . . . . . 3.9 mp0 -62.81 -58.74 15.08 Favored Pre-proline 0 N--CA 1.502 2.128 0 O-C-N 121.258 -0.901 . . . . 0.0 110.811 -177.243 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 278' ' ' PRO . . . . . . . . . . . . . 30.8 Cg_endo -68.16 -31.29 29.89 Favored 'Trans proline' 0 N--CA 1.488 1.189 0 O-C-N 123.148 1.078 . . . . 0.0 110.535 179.296 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 279' ' ' SER . . . . . . . . . . . . . 49.0 m -68.01 160.19 29.23 Favored 'General case' 0 N--CA 1.499 1.995 0 O-C-N 121.594 -0.691 . . . . 0.0 110.283 -179.851 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 280' ' ' THR . . . . . . . . . . . . . 9.9 t -130.62 164.85 24.06 Favored 'General case' 0 N--CA 1.498 1.935 0 O-C-N 121.666 -0.646 . . . . 0.0 110.302 -179.492 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 281' ' ' PHE . . . . . 0.418 ' CB ' ' CD ' ' B' ' 282' ' ' PRO . 2.9 m-85 -166.92 -61.62 0.01 OUTLIER Pre-proline 0 N--CA 1.498 1.959 0 O-C-N 121.677 -0.64 . . . . 0.0 110.543 -178.11 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 282' ' ' PRO . . . . . 0.418 ' CD ' ' CB ' ' B' ' 281' ' ' PHE . 28.2 Cg_endo -66.95 -30.27 39.82 Favored 'Trans proline' 0 N--CA 1.49 1.315 0 O-C-N 123.145 1.076 . . . . 0.0 110.829 -179.328 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 283' ' ' GLN . . . . . . . . . . . . . 28.2 mt-30 -65.8 -57.95 12.63 Favored Pre-proline 0 N--CA 1.5 2.033 0 O-C-N 121.483 -0.76 . . . . 0.0 110.679 -177.831 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 284' ' ' PRO . . . . . . . . . . . . . 32.4 Cg_endo -68.91 162.66 40.61 Favored 'Trans proline' 0 N--CA 1.488 1.151 0 O-C-N 123.183 1.096 . . . . 0.0 110.251 178.838 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 285' ' ' PRO . . . . . . . . . . . . . 21.4 Cg_exo -61.7 139.98 83.74 Favored 'Trans proline' 0 N--CA 1.49 1.288 0 O-C-N 123.573 1.302 . . . . 0.0 110.64 -179.83 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 286' ' ' VAL . . . . . . . . . . . . . 12.6 p -134.42 144.19 35.82 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.882 0 O-C-N 121.783 -0.573 . . . . 0.0 110.198 179.989 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 287' ' ' GLU . . . . . . . . . . . . . 54.5 mt-10 -102.16 147.08 27.06 Favored 'General case' 0 N--CA 1.495 1.776 0 O-C-N 121.712 -0.618 . . . . 0.0 110.244 179.69 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 288' ' ' SER . . . . . . . . . . . . . 30.2 t -125.62 143.94 50.8 Favored 'General case' 0 N--CA 1.497 1.89 0 O-C-N 121.78 -0.575 . . . . 0.0 110.206 -179.807 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 289' ' ' HIS . . . . . . . . . . . . . 48.5 p-80 -125.33 145.9 49.82 Favored 'General case' 0 N--CA 1.497 1.891 0 O-C-N 121.658 -0.651 . . . . 0.0 110.256 179.762 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 290' ' ' SER . . . . . . . . . . . . . 49.5 m -120.05 148.0 44.12 Favored 'General case' 0 N--CA 1.495 1.808 0 O-C-N 121.685 -0.634 . . . . 0.0 110.227 -179.839 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 291' ' ' SER . . . . . . . . . . . . . 9.0 t . . . . . 0 N--CA 1.494 1.764 0 CA-C-O 118.038 -0.982 . . . . 0.0 110.203 -179.982 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' -1' ' ' MET . . . . . . . . . . . . . 85.4 mtp . . . . . 0 N--CA 1.494 1.757 0 CA-C-O 120.991 0.424 . . . . 0.0 110.145 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 0' ' ' GLY . . . . . . . . . . . . . . . -143.32 -126.33 2.01 Favored Glycine 0 N--CA 1.494 2.558 0 N-CA-C 109.509 -1.436 . . . . 0.0 109.509 -179.962 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 65.3 mtt -105.92 147.86 28.29 Favored 'General case' 0 N--CA 1.495 1.782 0 O-C-N 121.674 -0.898 . . . . 0.0 110.275 179.938 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 68.4 m -100.98 172.46 7.01 Favored 'General case' 0 N--CA 1.495 1.782 0 O-C-N 121.774 -0.579 . . . . 0.0 110.256 -179.651 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 3' ' ' VAL . . . . . 0.437 HG12 ' CE1' ' A' ' 7' ' ' TYR . 67.3 t -66.45 -27.78 41.4 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.085 0 O-C-N 121.676 -0.64 . . . . 0.0 110.379 -178.98 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -54.91 -30.67 58.9 Favored 'General case' 0 N--CA 1.505 2.296 0 O-C-N 121.451 -0.781 . . . . 0.0 110.538 -177.906 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 74.5 m-20 -69.01 -30.55 68.95 Favored 'General case' 0 N--CA 1.499 1.982 0 O-C-N 121.827 -0.546 . . . . 0.0 110.321 175.018 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 97.2 m-85 -95.49 10.12 37.64 Favored 'General case' 0 N--CA 1.497 1.898 0 O-C-N 121.628 -0.67 . . . . 0.0 111.512 -178.208 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 7' ' ' TYR . . . . . 0.437 ' CE1' HG12 ' A' ' 3' ' ' VAL . 3.8 m-30 -67.18 140.25 57.46 Favored 'General case' 0 N--CA 1.502 2.156 0 O-C-N 121.158 -0.964 . . . . 0.0 110.134 174.735 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 83.15 -2.04 87.66 Favored Glycine 0 N--CA 1.498 2.79 0 N-CA-C 110.67 -0.972 . . . . 0.0 110.67 -176.118 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 67.1 m -75.31 140.95 43.43 Favored 'General case' 0 N--CA 1.497 1.902 0 O-C-N 121.11 -1.229 . . . . 0.0 110.554 -179.536 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 10' ' ' ASN . . . . . 0.695 ' OD1' HG22 ' A' ' 24' ' ' VAL . 4.3 m-80 -85.63 117.82 24.76 Favored 'General case' 0 N--CA 1.497 1.893 0 N-CA-C 109.492 -0.558 . . . . 0.0 109.492 173.525 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . 0.48 HG12 ' HA ' ' A' ' 57' ' ' ILE . 35.3 m -142.55 162.32 18.52 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.889 0 O-C-N 121.675 -0.641 . . . . 0.0 109.746 179.591 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . 0.617 ' HB2' HD11 ' A' ' 58' ' ' LEU . 45.3 tt0 -109.41 129.98 55.52 Favored 'General case' 0 N--CA 1.492 1.65 0 C-N-CA 119.851 -0.74 . . . . 0.0 109.887 176.069 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . 0.566 HG22 ' CD2' ' A' ' 55' ' ' LEU . 60.3 t -106.74 125.58 62.67 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.714 0 O-C-N 121.725 -0.61 . . . . 0.0 109.831 179.731 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.473 HD13 ' HG2' ' A' ' 20' ' ' LYS . 28.6 tp -95.82 126.28 40.97 Favored 'General case' 0 N--CA 1.493 1.707 0 N-CA-C 109.128 -0.693 . . . . 0.0 109.128 175.225 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 87.1 mt -95.85 168.05 10.88 Favored 'General case' 0 N--CA 1.496 1.839 0 O-C-N 121.689 -0.632 . . . . 0.0 111.087 -172.989 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 24.3 p30 -58.15 -21.86 48.77 Favored 'General case' 0 N--CA 1.507 2.39 0 O-C-N 121.835 -0.54 . . . . 0.0 111.583 -176.896 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 44.0 p-10 -92.2 22.79 4.19 Favored 'General case' 0 N--CA 1.498 1.973 0 O-C-N 121.561 -0.712 . . . . 0.0 110.968 -176.636 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 74.3 m-20 58.75 27.52 16.08 Favored 'General case' 0 N--CA 1.505 2.298 0 O-C-N 121.364 -0.835 . . . . 0.0 110.662 175.77 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 51.1 m -106.86 142.01 37.17 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.473 -0.767 . . . . 0.0 109.568 172.645 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . 0.473 ' HG2' HD13 ' A' ' 14' ' ' LEU . 94.6 mttt -109.62 146.42 34.78 Favored 'General case' 0 N--CA 1.496 1.83 0 O-C-N 121.611 -0.681 . . . . 0.0 110.646 -176.183 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -153.11 151.16 29.86 Favored 'General case' 0 N--CA 1.497 1.877 0 O-C-N 121.825 -0.547 . . . . 0.0 109.991 175.277 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . 0.489 ' O ' HD13 ' A' ' 39' ' ' LEU . 31.0 ptt180 -140.02 146.17 38.69 Favored 'General case' 0 N--CA 1.499 2.001 0 O-C-N 121.568 -0.707 . . . . 0.0 110.654 -179.853 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -171.77 171.49 44.13 Favored Glycine 0 N--CA 1.495 2.609 0 N-CA-C 108.768 -1.733 . . . . 0.0 108.768 -174.378 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . 0.695 HG22 ' OD1' ' A' ' 10' ' ' ASN . 25.2 t -94.55 120.1 43.48 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.907 0 O-C-N 121.49 -1.006 . . . . 0.0 109.34 -176.119 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 25' ' ' ILE . . . . . 0.458 HD11 HG21 ' A' ' 11' ' ' VAL . 87.2 mt -63.45 143.33 15.72 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.24 0 O-C-N 121.479 -0.763 . . . . 0.0 110.462 -172.729 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . 0.624 HG21 ' HB2' ' A' ' 38' ' ' ARG . 6.7 p -121.15 -28.73 4.67 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.671 -0.643 . . . . 0.0 111.329 179.079 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 26.9 t30 -161.97 158.78 25.67 Favored 'General case' 0 N--CA 1.499 2.004 0 O-C-N 120.985 -1.072 . . . . 0.0 111.661 -177.095 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 28' ' ' PHE . . . . . 0.519 ' HE1' HG21 ' A' ' 49' ' ' THR . 84.3 t80 -150.08 126.86 11.03 Favored 'General case' 0 N--CA 1.497 1.882 0 N-CA-C 109.132 -0.692 . . . . 0.0 109.132 170.78 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 21.3 t70 -100.53 130.92 46.67 Favored 'General case' 0 N--CA 1.491 1.581 0 N-CA-C 109.04 -0.726 . . . . 0.0 109.04 -176.772 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 20.9 m -69.29 -49.99 50.87 Favored 'General case' 0 N--CA 1.498 1.946 0 C-N-CA 120.062 -0.655 . . . . 0.0 110.504 -176.679 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 22.6 m -59.76 -42.72 93.88 Favored 'General case' 0 N--CA 1.502 2.135 0 O-C-N 121.648 -0.658 . . . . 0.0 110.84 -174.478 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 29.6 m120 -103.71 -10.1 18.61 Favored 'General case' 0 N--CA 1.496 1.873 0 O-C-N 121.667 -0.646 . . . . 0.0 111.553 -178.069 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 1.8 m 49.88 67.38 0.91 Allowed 'General case' 0 N--CA 1.507 2.424 0 O-C-N 121.103 -0.998 . . . . 0.0 110.87 -174.795 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 34' ' ' ILE . . . . . 1.106 HD12 HG22 ' A' ' 48' ' ' VAL . 47.4 mm -125.43 126.86 71.25 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.006 0 O-C-N 121.557 -0.715 . . . . 0.0 109.469 -176.061 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.422 HD12 ' HB2' ' A' ' 28' ' ' PHE . 6.7 tp -115.85 120.03 37.93 Favored 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.678 -0.639 . . . . 0.0 110.335 -169.237 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 99.5 mt-30 -90.98 134.68 34.29 Favored 'General case' 0 N--CA 1.492 1.63 0 C-N-CA 120.268 -0.573 . . . . 0.0 109.477 175.386 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 0.442 HD23 ' HA ' ' A' ' 25' ' ' ILE . 17.2 mt -117.82 123.87 46.98 Favored 'General case' 0 N--CA 1.495 1.781 0 O-C-N 121.854 -0.529 . . . . 0.0 110.023 174.818 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 38' ' ' ARG . . . . . 0.624 ' HB2' HG21 ' A' ' 26' ' ' THR . 74.9 ttt-85 -97.26 108.5 21.25 Favored 'General case' 0 N--CA 1.497 1.88 0 O-C-N 121.756 -0.59 . . . . 0.0 109.778 175.215 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.489 HD13 ' O ' ' A' ' 22' ' ' ARG . 17.8 tp -85.28 151.67 23.88 Favored 'General case' 0 N--CA 1.495 1.797 0 O-C-N 121.703 -0.623 . . . . 0.0 110.981 -174.206 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -62.99 -9.25 9.31 Favored 'General case' 0 N--CA 1.503 2.193 0 O-C-N 121.965 -0.459 . . . . 0.0 111.895 -172.668 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 30.1 m120 -85.38 29.05 0.69 Allowed 'General case' 0 N--CA 1.499 1.981 0 O-C-N 121.086 -1.009 . . . . 0.0 110.95 174.33 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 74.4 m-20 59.33 31.15 20.92 Favored 'General case' 0 N--CA 1.505 2.302 0 O-C-N 121.136 -0.978 . . . . 0.0 110.366 174.378 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 48.7 m -122.81 137.93 54.79 Favored 'General case' 0 N--CA 1.495 1.795 0 O-C-N 121.42 -0.8 . . . . 0.0 110.395 179.121 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 9.0 t -97.19 149.41 22.04 Favored 'General case' 0 N--CA 1.498 1.949 0 O-C-N 121.814 -0.554 . . . . 0.0 110.233 176.77 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 74.7 tttt -149.89 119.2 6.83 Favored 'General case' 0 N--CA 1.494 1.755 0 O-C-N 121.602 -0.687 . . . . 0.0 110.255 178.515 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 88.7 p -95.0 123.97 38.78 Favored 'General case' 0 N--CA 1.496 1.828 0 O-C-N 121.694 -0.629 . . . . 0.0 110.175 179.214 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 82.4 mt -129.32 134.47 63.71 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.9 0 N-CA-C 109.246 -0.649 . . . . 0.0 109.246 -179.967 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 48' ' ' VAL . . . . . 1.106 HG22 HD12 ' A' ' 34' ' ' ILE . 63.1 t -82.11 127.59 39.49 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.891 0 O-C-N 121.574 -0.704 . . . . 0.0 109.268 179.668 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 49' ' ' THR . . . . . 0.519 HG21 ' HE1' ' A' ' 28' ' ' PHE . 38.6 p -59.97 -24.93 64.82 Favored 'General case' 0 N--CA 1.503 2.216 0 O-C-N 121.592 -0.692 . . . . 0.0 112.065 -171.141 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 80.8 mttt -56.82 -25.29 55.65 Favored 'General case' 0 N--CA 1.502 2.174 0 O-C-N 121.445 -0.784 . . . . 0.0 111.03 -176.405 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 6.3 p30 -84.62 5.2 28.91 Favored 'General case' 0 N--CA 1.498 1.947 0 C-N-CA 119.726 -0.79 . . . . 0.0 111.441 176.318 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 98.6 mt -75.56 127.94 37.12 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.146 0 O-C-N 121.136 -0.977 . . . . 0.0 109.92 175.972 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 40.0 tttp -91.92 -32.76 15.15 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.782 -0.573 . . . . 0.0 109.528 168.942 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -161.46 156.82 24.12 Favored 'General case' 0 N--CA 1.499 1.977 0 O-C-N 121.76 -0.587 . . . . 0.0 109.958 -176.936 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . 0.566 ' CD2' HG22 ' A' ' 13' ' ' VAL . 86.2 mt -133.05 150.09 52.14 Favored 'General case' 0 N--CA 1.497 1.922 0 O-C-N 121.639 -0.663 . . . . 0.0 110.517 -179.425 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 20.1 ptp180 -151.86 142.85 23.09 Favored 'General case' 0 N--CA 1.495 1.81 0 O-C-N 121.741 -0.599 . . . . 0.0 110.065 175.518 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 57' ' ' ILE . . . . . 0.48 ' HA ' HG12 ' A' ' 11' ' ' VAL . 66.5 mt -86.49 133.19 30.41 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.912 0 O-C-N 121.558 -0.714 . . . . 0.0 109.835 173.428 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . 0.617 HD11 ' HB2' ' A' ' 12' ' ' GLU . 50.8 mt -85.19 123.18 73.64 Favored Pre-proline 0 N--CA 1.497 1.924 0 O-C-N 121.583 -0.698 . . . . 0.0 110.091 179.41 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 29.4 Cg_endo -67.95 150.82 78.25 Favored 'Trans proline' 0 N--CA 1.487 1.13 0 O-C-N 123.233 1.122 . . . . 0.0 110.19 176.744 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 60.0 mttm -88.18 139.06 30.89 Favored 'General case' 0 N--CA 1.497 1.877 0 O-C-N 121.657 -0.652 . . . . 0.0 110.147 -179.676 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 90.8 m-20 -65.25 -38.39 90.19 Favored 'General case' 0 N--CA 1.5 2.028 0 O-C-N 121.737 -0.602 . . . . 0.0 110.415 -179.095 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 78.3 mt-10 52.01 -166.43 0.05 Allowed 'General case' 0 N--CA 1.507 2.404 0 O-C-N 121.647 -0.658 . . . . 0.0 110.828 179.983 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 33.5 pt -105.67 147.66 11.07 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.969 0 O-C-N 121.521 -0.737 . . . . 0.0 110.096 178.113 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 64' ' ' MET . . . . . . . . . . . . . 36.6 ttm 51.65 56.68 16.38 Favored Pre-proline 0 N--CA 1.506 2.326 0 O-C-N 121.596 -0.69 . . . . 0.0 110.663 -176.517 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 29.3 Cg_endo -67.39 155.29 71.01 Favored 'Trans proline' 0 N--CA 1.488 1.193 0 O-C-N 123.543 1.286 . . . . 0.0 110.537 -177.986 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 18.6 tptm 54.02 57.19 6.19 Favored 'General case' 0 N--CA 1.506 2.343 0 O-C-N 121.621 -0.674 . . . . 0.0 110.856 179.072 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 16.4 t-20 -63.28 -40.2 96.71 Favored 'General case' 0 N--CA 1.501 2.122 0 O-C-N 121.434 -0.791 . . . . 0.0 110.268 179.171 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . -95.98 179.45 35.32 Favored Glycine 0 N--CA 1.495 2.568 0 N-CA-C 109.284 -1.527 . . . . 0.0 109.284 177.888 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 9.8 t -138.38 147.49 43.46 Favored 'General case' 0 N--CA 1.496 1.867 0 O-C-N 121.659 -0.906 . . . . 0.0 110.421 179.444 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 60.1 tttt -107.51 -44.97 4.16 Favored 'General case' 0 N--CA 1.495 1.781 0 O-C-N 121.75 -0.593 . . . . 0.0 110.089 178.713 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 20.9 m 53.1 65.14 6.17 Favored Pre-proline 0 N--CA 1.504 2.256 0 O-C-N 121.61 -0.681 . . . . 0.0 110.902 179.625 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 27.9 Cg_endo -67.08 145.45 73.4 Favored 'Trans proline' 0 N--CA 1.489 1.212 0 O-C-N 123.416 1.219 . . . . 0.0 110.297 178.486 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 26.1 t -110.75 28.99 8.15 Favored 'General case' 0 N--CA 1.497 1.885 0 O-C-N 121.698 -0.626 . . . . 0.0 110.615 -179.17 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 24.4 m -68.81 -42.96 76.56 Favored 'General case' 0 N--CA 1.499 2.023 0 O-C-N 121.514 -0.741 . . . . 0.0 110.071 179.029 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 91.6 m-20 -131.84 143.9 50.51 Favored 'General case' 0 N--CA 1.495 1.815 0 O-C-N 121.735 -0.603 . . . . 0.0 110.136 179.193 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 50.6 m -121.84 146.17 47.35 Favored 'General case' 0 N--CA 1.495 1.813 0 O-C-N 121.716 -0.615 . . . . 0.0 110.201 -179.716 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 40.0 p -124.45 155.51 38.76 Favored 'General case' 0 N--CA 1.496 1.828 0 O-C-N 121.71 -0.619 . . . . 0.0 110.213 179.319 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 72.1 mttt -97.91 -40.05 8.68 Favored 'General case' 0 N--CA 1.495 1.797 0 O-C-N 121.71 -0.619 . . . . 0.0 110.284 179.993 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 15.1 tp -106.59 137.45 44.57 Favored 'General case' 0 N--CA 1.494 1.775 0 O-C-N 121.707 -0.62 . . . . 0.0 110.246 -179.014 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 96.4 mttt -82.51 155.04 24.76 Favored 'General case' 0 N--CA 1.497 1.881 0 O-C-N 121.59 -0.694 . . . . 0.0 110.01 178.747 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 48.7 m -114.08 140.11 48.74 Favored 'General case' 0 N--CA 1.495 1.81 0 O-C-N 121.629 -0.67 . . . . 0.0 110.309 -178.612 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -163.17 -63.17 0.04 OUTLIER 'General case' 0 N--CA 1.495 1.807 0 O-C-N 121.72 -0.612 . . . . 0.0 109.944 178.749 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 35.6 tt0 -127.54 141.4 51.66 Favored 'General case' 0 N--CA 1.495 1.781 0 O-C-N 121.723 -0.611 . . . . 0.0 109.977 178.025 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 36.9 p -103.46 30.05 5.24 Favored 'General case' 0 N--CA 1.496 1.85 0 O-C-N 121.629 -0.669 . . . . 0.0 110.586 -177.665 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 57.5 t80 -142.04 128.65 20.29 Favored 'General case' 0 N--CA 1.493 1.711 0 O-C-N 121.507 -0.745 . . . . 0.0 110.304 179.822 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 50.2 m -130.87 146.78 52.4 Favored 'General case' 0 N--CA 1.495 1.816 0 O-C-N 121.689 -0.632 . . . . 0.0 110.195 179.057 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 2.9 m -154.98 -67.45 0.13 Allowed 'General case' 0 N--CA 1.495 1.786 0 O-C-N 121.664 -0.648 . . . . 0.0 110.256 179.339 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 56.6 tttt -162.17 34.17 0.12 Allowed 'General case' 0 N--CA 1.494 1.753 0 O-C-N 121.58 -0.7 . . . . 0.0 110.135 179.884 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 89.2 m-20 53.21 40.32 31.08 Favored 'General case' 0 N--CA 1.505 2.319 0 O-C-N 121.477 -0.764 . . . . 0.0 110.87 179.905 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 52.1 mtmt -65.45 -34.98 79.56 Favored 'General case' 0 N--CA 1.499 2.019 0 O-C-N 121.59 -0.694 . . . . 0.0 110.443 -179.143 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 91' ' ' TRP . . . . . . . . . . . . . 12.7 m-90 -84.27 -53.38 5.53 Favored 'General case' 0 N--CA 1.497 1.919 0 O-C-N 121.701 -0.624 . . . . 0.0 110.321 -178.814 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 29.4 t -125.83 132.75 52.17 Favored 'General case' 0 N--CA 1.496 1.837 0 O-C-N 121.598 -0.689 . . . . 0.0 110.241 179.935 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 93' ' ' MET . . . . . . . . . . . . . 65.4 mtt -67.13 -35.66 80.21 Favored 'General case' 0 N--CA 1.499 2.018 0 O-C-N 121.624 -0.672 . . . . 0.0 110.296 179.954 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 3.8 p30 . . . . . 0 N--CA 1.496 1.872 0 CA-C-O 117.954 -1.022 . . . . 0.0 110.28 -179.637 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' B' B ' 240' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.325 0 N-CA-C 109.517 -1.433 . . . . 0.0 109.517 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' B' B ' 241' ' ' ALA . . . . . . . . . . . . . . . -69.64 145.75 52.2 Favored 'General case' 0 N--CA 1.498 1.956 0 O-C-N 121.714 -0.874 . . . . 0.0 110.118 179.969 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 242' ' ' THR . . . . . . . . . . . . . 38.1 p -107.33 29.88 6.74 Favored 'General case' 0 N--CA 1.495 1.82 0 O-C-N 121.696 -0.627 . . . . 0.0 110.495 -179.741 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 243' ' ' THR . . . . . . . . . . . . . 9.8 t -136.14 152.6 50.99 Favored 'General case' 0 N--CA 1.496 1.847 0 O-C-N 121.567 -0.708 . . . . 0.0 110.336 179.855 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 244' ' ' LYS . . . . . . . . . . . . . 33.7 pttt -139.49 146.83 40.47 Favored 'General case' 0 N--CA 1.495 1.821 0 O-C-N 121.727 -0.608 . . . . 0.0 110.434 179.946 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 245' ' ' GLU . . . . . . . . . . . . . 12.3 pt-20 -136.61 142.47 43.3 Favored 'General case' 0 N--CA 1.497 1.884 0 O-C-N 121.682 -0.636 . . . . 0.0 110.285 179.159 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 246' ' ' LYS . . . . . . . . . . . . . 24.2 mmmt -107.43 120.23 41.61 Favored 'General case' 0 N--CA 1.495 1.79 0 O-C-N 121.657 -0.652 . . . . 0.0 110.254 -179.679 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 247' ' ' ASN . . . . . . . . . . . . . 15.0 t-20 52.78 38.2 25.88 Favored 'General case' 0 N--CA 1.506 2.341 0 O-C-N 121.621 -0.674 . . . . 0.0 110.988 179.17 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 248' ' ' ILE . . . . . 0.503 HG22 ' O ' ' B' ' 248' ' ' ILE . 68.6 mt 52.29 59.77 0.29 Allowed 'Isoleucine or valine' 0 N--CA 1.507 2.392 0 O-C-N 121.522 -0.736 . . . . 0.0 110.421 -179.143 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 249' ' ' SER . . . . . 0.422 ' C ' HG13 ' B' ' 250' ' ' VAL . 50.3 m -118.14 152.09 36.31 Favored 'General case' 0 N--CA 1.495 1.8 0 O-C-N 121.554 -0.716 . . . . 0.0 110.246 -179.133 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 250' ' ' VAL . . . . . 0.53 HG23 ' O ' ' B' ' 250' ' ' VAL . 29.3 m -150.16 81.81 0.08 OUTLIER 'Isoleucine or valine' 0 N--CA 1.498 1.929 0 CA-C-O 121.387 0.613 . . . . 0.0 110.11 -179.57 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 251' ' ' ASP . . . . . . . . . . . . . 74.5 m-20 -81.64 133.77 35.4 Favored 'General case' 0 N--CA 1.497 1.911 0 O-C-N 121.513 -0.742 . . . . 0.0 110.169 179.775 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 252' ' ' VAL . . . . . . . . . . . . . 94.7 t 56.2 -86.6 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.508 2.435 0 O-C-N 121.829 -0.544 . . . . 0.0 110.735 -179.33 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 253' ' ' ASP . . . . . . . . . . . . . 74.7 m-20 51.89 52.2 14.97 Favored 'General case' 0 N--CA 1.506 2.351 0 O-C-N 121.006 -1.058 . . . . 0.0 110.969 -178.435 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 254' ' ' ALA . . . . . . . . . . . . . . . -66.02 -31.77 72.86 Favored 'General case' 0 N--CA 1.501 2.094 0 O-C-N 121.524 -0.735 . . . . 0.0 110.393 -179.128 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 255' ' ' ASP . . . . . . . . . . . . . 11.6 p-10 -72.01 -35.42 69.43 Favored 'General case' 0 N--CA 1.499 1.993 0 O-C-N 121.58 -0.7 . . . . 0.0 110.198 179.415 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 256' ' ' ALA . . . . . . . . . . . . . . . -65.02 -42.78 94.11 Favored 'General case' 0 N--CA 1.501 2.079 0 O-C-N 121.651 -0.655 . . . . 0.0 110.186 178.325 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 257' ' ' SER . . . . . . . . . . . . . 43.2 t -55.19 -35.39 64.78 Favored 'General case' 0 N--CA 1.503 2.195 0 O-C-N 121.66 -0.65 . . . . 0.0 110.499 177.998 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 258' ' ' SER . . . . . . . . . . . . . 25.2 m -68.89 -30.87 69.45 Favored 'General case' 0 N--CA 1.498 1.968 0 C-N-CA 120.436 -0.506 . . . . 0.0 110.389 -179.769 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 259' ' ' GLN . . . . . . . . . . . . . 48.9 tt0 -63.56 -39.98 95.81 Favored 'General case' 0 N--CA 1.501 2.108 0 O-C-N 121.589 -0.694 . . . . 0.0 110.43 -179.903 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 260' ' ' LEU . . . . . 0.513 ' HA ' HD12 ' B' ' 263' ' ' LEU . 83.7 mt -67.37 -43.53 81.18 Favored 'General case' 0 N--CA 1.5 2.055 0 O-C-N 121.609 -0.682 . . . . 0.0 110.247 -179.661 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 261' ' ' LEU . . . . . . . . . . . . . 17.1 tp -70.38 -36.77 74.33 Favored 'General case' 0 N--CA 1.498 1.962 0 O-C-N 121.634 -0.666 . . . . 0.0 109.629 177.078 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 262' ' ' SER . . . . . . . . . . . . . 22.8 t -62.79 -35.84 81.2 Favored 'General case' 0 N--CA 1.501 2.076 0 O-C-N 121.776 -0.578 . . . . 0.0 110.565 176.671 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 263' ' ' LEU . . . . . 0.513 HD12 ' HA ' ' B' ' 260' ' ' LEU . 19.9 mt -64.55 -44.6 90.28 Favored 'General case' 0 N--CA 1.501 2.078 0 O-C-N 121.598 -0.689 . . . . 0.0 110.247 -179.331 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 264' ' ' LEU . . . . . 0.477 ' CD1' HD11 ' A' ' 55' ' ' LEU . 86.3 mt -62.42 -34.72 77.31 Favored 'General case' 0 N--CA 1.502 2.158 0 O-C-N 121.762 -0.586 . . . . 0.0 110.566 177.872 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 265' ' ' LYS . . . . . . . . . . . . . 81.3 tttt -75.66 -40.71 55.64 Favored 'General case' 0 N--CA 1.498 1.945 0 O-C-N 121.7 -0.625 . . . . 0.0 110.115 -179.048 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 266' ' ' SER . . . . . . . . . . . . . 85.9 p -163.11 165.84 24.17 Favored 'General case' 0 N--CA 1.496 1.828 0 O-C-N 121.637 -0.665 . . . . 0.0 110.2 -179.696 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 267' ' ' SER . . . . . . . . . . . . . 91.1 p -143.36 163.49 32.9 Favored 'General case' 0 N--CA 1.495 1.8 0 O-C-N 121.73 -0.607 . . . . 0.0 110.269 179.73 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 268' ' ' THR . . . . . . . . . . . . . 23.8 m -95.82 137.69 34.53 Favored 'General case' 0 N--CA 1.494 1.772 0 O-C-N 121.668 -0.645 . . . . 0.0 110.159 179.881 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 269' ' ' ALA . . . . . . . . . . . . . . . 48.72 65.88 6.48 Favored Pre-proline 0 N--CA 1.506 2.358 0 O-C-N 121.693 -0.629 . . . . 0.0 111.139 -178.177 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 270' ' ' PRO . . . . . . . . . . . . . 27.0 Cg_endo -66.78 135.6 38.95 Favored 'Trans proline' 0 N--CA 1.488 1.161 0 O-C-N 123.525 1.276 . . . . 0.0 110.476 -178.963 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 271' ' ' SER . . . . . . . . . . . . . 29.4 t -148.2 139.89 23.76 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.674 -0.642 . . . . 0.0 110.142 179.061 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 272' ' ' ASP . . . . . . . . . . . . . 2.6 p30 -161.04 32.57 0.14 Allowed 'General case' 0 N--CA 1.496 1.861 0 O-C-N 121.696 -0.627 . . . . 0.0 110.489 179.859 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 273' ' ' LEU . . . . . . . . . . . . . 21.3 tp -83.18 126.32 32.5 Favored 'General case' 0 N--CA 1.497 1.876 0 O-C-N 121.631 -0.668 . . . . 0.0 110.097 179.848 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 274' ' ' ALA . . . . . . . . . . . . . . . 49.68 92.72 0.02 OUTLIER 'General case' 0 N--CA 1.506 2.357 0 O-C-N 121.741 -0.6 . . . . 0.0 111.304 -178.862 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 275' ' ' THR . . . . . . . . . . . . . 8.2 t -125.27 149.64 64.72 Favored Pre-proline 0 N--CA 1.498 1.927 0 O-C-N 121.57 -0.706 . . . . 0.0 110.161 -179.837 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 276' ' ' PRO . . . . . . . . . . . . . 28.7 Cg_endo -67.34 148.14 79.27 Favored 'Trans proline' 0 N--CA 1.489 1.235 0 O-C-N 123.52 1.274 . . . . 0.0 110.413 179.567 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 277' ' ' GLN . . . . . . . . . . . . . 24.2 tt0 -123.72 88.17 52.17 Favored Pre-proline 0 N--CA 1.495 1.782 0 O-C-N 121.696 -0.628 . . . . 0.0 110.168 179.692 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 278' ' ' PRO . . . . . . . . . . . . . 21.2 Cg_exo -61.97 144.9 96.89 Favored 'Trans proline' 0 N--CA 1.49 1.318 0 O-C-N 123.49 1.258 . . . . 0.0 110.693 -179.6 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 279' ' ' SER . . . . . . . . . . . . . 35.1 t -142.1 -59.59 0.46 Allowed 'General case' 0 N--CA 1.495 1.818 0 O-C-N 121.719 -0.613 . . . . 0.0 110.225 179.96 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 280' ' ' THR . . . . . . . . . . . . . 45.5 p -127.09 32.04 5.15 Favored 'General case' 0 N--CA 1.495 1.813 0 O-C-N 121.64 -0.663 . . . . 0.0 110.358 -179.84 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 281' ' ' PHE . . . . . 0.408 ' N ' ' HD2' ' B' ' 282' ' ' PRO . 2.6 m-85 -66.36 -57.1 13.45 Favored Pre-proline 0 N--CA 1.498 1.936 0 O-C-N 121.6 -0.687 . . . . 0.0 110.7 -179.549 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 282' ' ' PRO . . . . . 0.408 ' HD2' ' N ' ' B' ' 281' ' ' PHE . 29.1 Cg_endo -68.36 -32.68 25.39 Favored 'Trans proline' 0 N--CA 1.487 1.138 0 O-C-N 123.277 1.146 . . . . 0.0 110.57 -177.44 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 283' ' ' GLN . . . . . . . . . . . . . 71.6 mt-30 -144.67 153.23 54.4 Favored Pre-proline 0 N--CA 1.494 1.735 0 O-C-N 121.615 -0.678 . . . . 0.0 110.33 179.448 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 284' ' ' PRO . . . . . . . . . . . . . 38.0 Cg_endo -71.82 156.91 56.21 Favored 'Trans proline' 0 N--CA 1.486 1.064 0 O-C-N 123.684 1.36 . . . . 0.0 110.309 179.428 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 285' ' ' PRO . . . . . . . . . . . . . 29.2 Cg_endo -67.66 144.32 65.58 Favored 'Trans proline' 0 N--CA 1.488 1.193 0 O-C-N 123.679 1.357 . . . . 0.0 110.315 178.894 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 286' ' ' VAL . . . . . . . . . . . . . 61.2 t -117.54 131.32 70.61 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.919 0 O-C-N 121.648 -0.658 . . . . 0.0 109.724 -179.776 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 287' ' ' GLU . . . . . . . . . . . . . 41.8 tt0 -120.88 134.93 55.29 Favored 'General case' 0 N--CA 1.495 1.796 0 O-C-N 121.654 -0.653 . . . . 0.0 110.047 179.256 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 288' ' ' SER . . . . . . . . . . . . . 32.3 t -143.16 140.03 30.61 Favored 'General case' 0 N--CA 1.494 1.736 0 O-C-N 121.691 -0.63 . . . . 0.0 110.288 179.637 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 289' ' ' HIS . . . . . . . . . . . . . 99.3 m-70 -95.3 -62.3 1.33 Allowed 'General case' 0 N--CA 1.495 1.808 0 O-C-N 121.702 -0.624 . . . . 0.0 110.191 179.499 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 290' ' ' SER . . . . . . . . . . . . . 31.1 m -66.06 -34.49 78.18 Favored 'General case' 0 N--CA 1.5 2.06 0 O-C-N 121.68 -0.637 . . . . 0.0 110.32 179.547 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 291' ' ' SER . . . . . . . . . . . . . 10.9 m . . . . . 0 N--CA 1.505 2.282 0 CA-C-O 117.997 -1.002 . . . . 0.0 111.074 -179.901 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' -1' ' ' MET . . . . . . . . . . . . . 13.0 tpt . . . . . 0 N--CA 1.492 1.627 0 CA-C-O 121.118 0.485 . . . . 0.0 110.153 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 0' ' ' GLY . . . . . . . . . . . . . . . -75.55 142.97 29.74 Favored Glycine 0 N--CA 1.495 2.625 0 N-CA-C 109.39 -1.484 . . . . 0.0 109.39 179.215 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 90.0 mtp -123.76 141.13 52.31 Favored 'General case' 0 N--CA 1.496 1.845 0 O-C-N 121.71 -0.876 . . . . 0.0 110.28 -179.59 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 65.5 m -101.01 163.42 12.29 Favored 'General case' 0 N--CA 1.494 1.77 0 O-C-N 121.678 -0.639 . . . . 0.0 109.976 178.433 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 3' ' ' VAL . . . . . 0.466 HG12 ' CE1' ' A' ' 7' ' ' TYR . 69.3 t -66.81 -27.82 41.09 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.082 0 O-C-N 121.596 -0.69 . . . . 0.0 110.097 179.823 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -55.21 -30.62 60.33 Favored 'General case' 0 N--CA 1.504 2.25 0 O-C-N 121.401 -0.812 . . . . 0.0 110.313 179.711 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -68.17 -31.48 71.06 Favored 'General case' 0 N--CA 1.498 1.948 0 O-C-N 121.847 -0.533 . . . . 0.0 110.151 174.533 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 88.2 m-85 -95.73 9.53 40.08 Favored 'General case' 0 N--CA 1.497 1.888 0 O-C-N 121.711 -0.618 . . . . 0.0 111.342 179.869 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 7' ' ' TYR . . . . . 0.466 ' CE1' HG12 ' A' ' 3' ' ' VAL . 3.5 m-30 -67.3 142.15 56.94 Favored 'General case' 0 N--CA 1.501 2.123 0 O-C-N 121.181 -0.949 . . . . 0.0 110.113 174.324 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 8' ' ' GLY . . . . . 0.425 ' O ' HG13 ' A' ' 24' ' ' VAL . . . 82.45 -0.2 89.32 Favored Glycine 0 N--CA 1.498 2.769 0 N-CA-C 110.648 -0.981 . . . . 0.0 110.648 -176.746 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . 0.554 ' OG ' HD12 ' A' ' 25' ' ' ILE . 84.5 p -77.4 137.37 38.68 Favored 'General case' 0 N--CA 1.497 1.909 0 O-C-N 121.081 -1.247 . . . . 0.0 110.478 179.32 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 12.1 t-20 -84.05 119.09 24.54 Favored 'General case' 0 N--CA 1.497 1.923 0 O-C-N 121.644 -0.66 . . . . 0.0 109.45 172.944 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . 0.576 HG12 ' HA ' ' A' ' 57' ' ' ILE . 35.6 m -142.64 164.0 17.39 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.63 0 O-C-N 121.829 -0.545 . . . . 0.0 109.541 -179.166 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . 0.434 ' HB2' HD11 ' A' ' 58' ' ' LEU . 35.6 tt0 -109.32 129.13 55.53 Favored 'General case' 0 N--CA 1.493 1.687 0 C-N-CA 119.929 -0.708 . . . . 0.0 109.916 177.183 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . 0.46 HG22 HD23 ' A' ' 55' ' ' LEU . 61.4 t -106.69 127.92 61.78 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.713 0 O-C-N 121.581 -0.7 . . . . 0.0 109.818 179.763 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 29.9 tp -95.94 128.33 42.74 Favored 'General case' 0 N--CA 1.493 1.718 0 N-CA-C 109.26 -0.644 . . . . 0.0 109.26 176.511 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 86.1 mt -95.02 160.94 14.34 Favored 'General case' 0 N--CA 1.495 1.813 0 O-C-N 121.615 -0.678 . . . . 0.0 111.015 -173.687 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 24.3 p30 -58.05 -21.87 47.56 Favored 'General case' 0 N--CA 1.506 2.343 0 O-C-N 121.819 -0.55 . . . . 0.0 111.571 -178.166 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 38.3 p-10 -93.28 24.02 4.1 Favored 'General case' 0 N--CA 1.497 1.923 0 O-C-N 121.507 -0.745 . . . . 0.0 110.782 -177.378 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 74.2 m-20 59.24 27.88 17.04 Favored 'General case' 0 N--CA 1.505 2.311 0 O-C-N 121.437 -0.789 . . . . 0.0 110.661 175.812 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 50.8 m -103.65 142.3 34.55 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.551 -0.718 . . . . 0.0 109.517 172.182 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 96.5 mttt -109.6 142.75 40.28 Favored 'General case' 0 N--CA 1.494 1.77 0 O-C-N 121.633 -0.667 . . . . 0.0 110.581 -175.806 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -153.07 152.82 31.77 Favored 'General case' 0 N--CA 1.497 1.897 0 O-C-N 121.725 -0.609 . . . . 0.0 110.304 176.376 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . 0.508 ' O ' HD13 ' A' ' 39' ' ' LEU . 32.9 ptt180 -144.08 149.13 36.11 Favored 'General case' 0 N--CA 1.498 1.951 0 O-C-N 121.691 -0.631 . . . . 0.0 110.519 177.574 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -171.77 171.46 44.11 Favored Glycine 0 N--CA 1.496 2.656 0 N-CA-C 108.954 -1.658 . . . . 0.0 108.954 -176.365 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . 0.425 HG13 ' O ' ' A' ' 8' ' ' GLY . 46.7 t -94.62 119.32 42.44 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.909 0 O-C-N 121.444 -1.033 . . . . 0.0 109.298 -177.27 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 25' ' ' ILE . . . . . 0.644 ' HA ' HD23 ' A' ' 37' ' ' LEU . 95.8 mt -64.39 143.59 15.56 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.179 0 O-C-N 121.69 -0.631 . . . . 0.0 110.601 -171.312 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . 0.603 HG21 ' HB2' ' A' ' 38' ' ' ARG . 7.9 p -121.17 -26.91 5.0 Favored 'General case' 0 N--CA 1.494 1.758 0 O-C-N 121.779 -0.575 . . . . 0.0 111.258 178.988 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 27' ' ' ASN . . . . . 0.478 ' O ' HD12 ' A' ' 35' ' ' LEU . 6.4 t30 -161.9 159.25 26.5 Favored 'General case' 0 N--CA 1.499 2.02 0 C-N-CA 118.969 -1.092 . . . . 0.0 111.671 -179.08 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 28' ' ' PHE . . . . . 0.523 ' HE1' HG21 ' A' ' 49' ' ' THR . 75.6 t80 -150.13 125.93 10.42 Favored 'General case' 0 N--CA 1.497 1.876 0 N-CA-C 109.089 -0.708 . . . . 0.0 109.089 170.478 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 17.9 t70 -99.64 130.61 45.88 Favored 'General case' 0 N--CA 1.491 1.605 0 N-CA-C 108.981 -0.748 . . . . 0.0 108.981 -177.395 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 34.7 m -69.64 -50.94 39.46 Favored 'General case' 0 N--CA 1.498 1.944 0 C-N-CA 120.01 -0.676 . . . . 0.0 110.534 -176.349 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 5.4 t -59.58 -42.74 93.21 Favored 'General case' 0 N--CA 1.502 2.138 0 O-C-N 121.477 -0.764 . . . . 0.0 110.791 -174.818 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 28.6 m120 -103.27 -10.06 19.03 Favored 'General case' 0 N--CA 1.497 1.893 0 O-C-N 121.573 -0.705 . . . . 0.0 111.446 -177.416 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 1.8 m 49.72 67.29 0.92 Allowed 'General case' 0 N--CA 1.507 2.407 0 O-C-N 121.054 -1.029 . . . . 0.0 111.08 -175.202 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 34' ' ' ILE . . . . . 1.13 HD12 HG22 ' A' ' 48' ' ' VAL . 47.6 mm -124.91 126.19 70.9 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.092 0 O-C-N 121.595 -0.691 . . . . 0.0 109.438 -175.899 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.478 HD12 ' O ' ' A' ' 27' ' ' ASN . 11.5 tp -115.86 121.07 41.28 Favored 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.596 -0.69 . . . . 0.0 110.622 -169.897 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 58.1 mt-30 -91.78 133.83 35.28 Favored 'General case' 0 N--CA 1.491 1.618 0 N-CA-C 109.435 -0.58 . . . . 0.0 109.435 173.49 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 0.644 HD23 ' HA ' ' A' ' 25' ' ' ILE . 90.5 mt -117.96 123.8 46.66 Favored 'General case' 0 N--CA 1.497 1.884 0 O-C-N 121.801 -0.562 . . . . 0.0 109.921 174.963 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 38' ' ' ARG . . . . . 0.603 ' HB2' HG21 ' A' ' 26' ' ' THR . 64.9 ttt180 -96.07 105.06 17.05 Favored 'General case' 0 N--CA 1.497 1.877 0 O-C-N 121.682 -0.636 . . . . 0.0 109.777 175.99 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.508 HD13 ' O ' ' A' ' 22' ' ' ARG . 20.1 tp -85.0 155.31 21.62 Favored 'General case' 0 N--CA 1.495 1.791 0 O-C-N 121.701 -0.624 . . . . 0.0 110.951 -173.692 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -68.63 -2.99 10.31 Favored 'General case' 0 N--CA 1.503 2.178 0 O-C-N 121.943 -0.473 . . . . 0.0 112.203 -169.494 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 43.3 p-10 -86.91 25.78 1.25 Allowed 'General case' 0 N--CA 1.499 1.994 0 O-C-N 121.004 -1.06 . . . . 0.0 110.853 173.637 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 7.8 t70 61.74 28.07 17.25 Favored 'General case' 0 N--CA 1.504 2.267 0 O-C-N 121.115 -0.991 . . . . 0.0 110.484 178.717 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 36.7 m -120.54 137.93 54.13 Favored 'General case' 0 N--CA 1.496 1.87 0 O-C-N 121.396 -0.815 . . . . 0.0 110.431 -179.893 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 8.7 t -97.86 151.01 20.67 Favored 'General case' 0 N--CA 1.496 1.864 0 O-C-N 121.719 -0.613 . . . . 0.0 110.172 175.98 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 70.3 tttt -149.44 119.13 7.0 Favored 'General case' 0 N--CA 1.496 1.847 0 O-C-N 121.612 -0.68 . . . . 0.0 110.27 178.762 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 88.4 p -95.71 122.8 38.88 Favored 'General case' 0 N--CA 1.495 1.801 0 O-C-N 121.713 -0.617 . . . . 0.0 110.208 179.057 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 81.7 mt -129.39 136.48 59.27 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.813 0 O-C-N 121.584 -0.697 . . . . 0.0 109.385 179.64 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 48' ' ' VAL . . . . . 1.13 HG22 HD12 ' A' ' 34' ' ' ILE . 57.8 t -81.8 127.53 39.52 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.896 0 N-CA-C 109.1 -0.704 . . . . 0.0 109.1 178.276 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 49' ' ' THR . . . . . 0.523 HG21 ' HE1' ' A' ' 28' ' ' PHE . 42.2 p -59.49 -25.74 64.7 Favored 'General case' 0 N--CA 1.504 2.229 0 O-C-N 121.558 -0.714 . . . . 0.0 112.071 -169.029 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 19.2 tptm -57.93 -23.39 53.3 Favored 'General case' 0 N--CA 1.502 2.154 0 O-C-N 121.512 -0.742 . . . . 0.0 111.346 -174.95 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 9.8 p30 -80.95 -4.32 54.61 Favored 'General case' 0 N--CA 1.499 2.02 0 C-N-CA 119.734 -0.786 . . . . 0.0 110.993 176.135 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 52' ' ' ILE . . . . . 0.794 HG21 HD11 ' A' ' 55' ' ' LEU . 85.5 mt -80.57 135.58 24.98 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.056 0 O-C-N 121.209 -0.932 . . . . 0.0 110.127 178.329 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 62.0 tttt -91.32 -30.66 16.45 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.84 -0.537 . . . . 0.0 109.62 169.567 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . 0.404 ' HA ' HD13 ' B' ' 261' ' ' LEU . 1.7 m-20 -165.31 159.97 17.78 Favored 'General case' 0 N--CA 1.502 2.156 0 O-C-N 121.833 -0.542 . . . . 0.0 110.505 -176.53 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . 0.794 HD11 HG21 ' A' ' 52' ' ' ILE . 4.4 mp -132.96 157.37 45.34 Favored 'General case' 0 N--CA 1.496 1.845 0 O-C-N 121.726 -0.609 . . . . 0.0 110.227 177.179 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 7.9 ptm180 -150.61 146.58 26.61 Favored 'General case' 0 N--CA 1.495 1.813 0 O-C-N 121.634 -0.666 . . . . 0.0 109.672 174.538 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 57' ' ' ILE . . . . . 0.576 ' HA ' HG12 ' A' ' 11' ' ' VAL . 55.9 mt -86.04 133.31 29.96 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.876 0 O-C-N 121.508 -0.745 . . . . 0.0 109.952 175.49 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . 0.434 HD11 ' HB2' ' A' ' 12' ' ' GLU . 79.2 mt -83.63 151.93 62.54 Favored Pre-proline 0 N--CA 1.498 1.942 0 O-C-N 121.589 -0.695 . . . . 0.0 110.076 -178.932 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 33.2 Cg_endo -69.26 113.23 3.22 Favored 'Trans proline' 0 N--CA 1.487 1.134 0 O-C-N 123.523 1.275 . . . . 0.0 110.384 -178.531 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 48.6 tttm -161.93 89.24 0.71 Allowed 'General case' 0 N--CA 1.495 1.811 0 O-C-N 121.655 -0.653 . . . . 0.0 110.072 178.006 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 24.3 p30 -161.37 36.35 0.14 Allowed 'General case' 0 N--CA 1.497 1.902 0 O-C-N 121.606 -0.684 . . . . 0.0 110.313 -179.706 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 79.2 mt-10 -90.47 136.03 33.32 Favored 'General case' 0 N--CA 1.496 1.871 0 O-C-N 121.689 -0.632 . . . . 0.0 110.161 -179.332 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 82.1 mt -119.75 131.28 72.67 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.996 0 O-C-N 121.719 -0.613 . . . . 0.0 109.635 179.799 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 64' ' ' MET . . . . . . . . . . . . . 35.1 mtt 52.0 58.53 15.5 Favored Pre-proline 0 N--CA 1.505 2.316 0 O-C-N 121.581 -0.699 . . . . 0.0 111.014 179.842 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 28.1 Cg_endo -67.79 -54.89 0.3 Allowed 'Trans proline' 0 N--CA 1.488 1.154 0 O-C-N 123.51 1.268 . . . . 0.0 110.39 179.845 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 62.4 mttm -100.07 -36.73 9.25 Favored 'General case' 0 N--CA 1.494 1.772 0 O-C-N 121.607 -0.683 . . . . 0.0 110.255 179.567 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 91.6 m-20 -107.47 138.81 43.0 Favored 'General case' 0 N--CA 1.496 1.839 0 O-C-N 121.751 -0.593 . . . . 0.0 110.142 -179.673 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . -179.09 -113.41 0.38 Allowed Glycine 0 N--CA 1.494 2.511 0 N-CA-C 109.525 -1.43 . . . . 0.0 109.525 179.992 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 24.5 m -68.64 -38.01 80.13 Favored 'General case' 0 N--CA 1.498 1.954 0 O-C-N 121.717 -0.872 . . . . 0.0 110.145 178.886 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 45.0 mmtm -66.02 -41.39 91.03 Favored 'General case' 0 N--CA 1.5 2.061 0 O-C-N 121.74 -0.6 . . . . 0.0 110.545 -178.786 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 4.7 m -145.31 159.32 49.17 Favored Pre-proline 0 N--CA 1.495 1.824 0 O-C-N 121.679 -0.638 . . . . 0.0 110.244 -179.215 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 22.2 Cg_exo -61.05 140.39 89.5 Favored 'Trans proline' 0 N--CA 1.49 1.323 0 O-C-N 123.611 1.322 . . . . 0.0 110.743 -179.701 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 17.4 t -89.3 -31.44 17.84 Favored 'General case' 0 N--CA 1.497 1.88 0 O-C-N 121.718 -0.614 . . . . 0.0 110.379 179.645 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 9.8 t -129.09 161.75 29.3 Favored 'General case' 0 N--CA 1.497 1.893 0 O-C-N 121.656 -0.653 . . . . 0.0 110.321 -179.816 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 91.3 m-20 -92.28 145.21 24.66 Favored 'General case' 0 N--CA 1.496 1.873 0 O-C-N 121.711 -0.618 . . . . 0.0 110.17 -179.502 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 50.9 m -116.34 153.09 32.62 Favored 'General case' 0 N--CA 1.495 1.798 0 O-C-N 121.641 -0.662 . . . . 0.0 110.119 -179.662 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 24.0 m -64.14 -38.19 90.17 Favored 'General case' 0 N--CA 1.501 2.105 0 O-C-N 121.654 -0.654 . . . . 0.0 110.389 -179.357 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 71.7 tttt -65.01 -42.36 94.53 Favored 'General case' 0 N--CA 1.5 2.067 0 O-C-N 121.653 -0.654 . . . . 0.0 110.294 179.709 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER 52.37 94.24 0.02 OUTLIER 'General case' 0 N--CA 1.505 2.305 0 O-C-N 121.629 -0.67 . . . . 0.0 111.174 179.561 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 98.6 mttt -89.74 104.44 17.0 Favored 'General case' 0 N--CA 1.497 1.906 0 O-C-N 121.716 -0.615 . . . . 0.0 110.112 179.702 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 86.4 p -160.24 174.51 14.11 Favored 'General case' 0 N--CA 1.494 1.76 0 O-C-N 121.692 -0.63 . . . . 0.0 110.205 -179.848 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -94.67 143.28 26.56 Favored 'General case' 0 N--CA 1.495 1.798 0 O-C-N 121.734 -0.604 . . . . 0.0 110.1 179.198 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 54.6 mt-10 -101.36 141.67 33.89 Favored 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.676 -0.64 . . . . 0.0 110.309 -179.044 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 24.6 m -127.94 142.25 51.3 Favored 'General case' 0 N--CA 1.495 1.793 0 O-C-N 121.729 -0.607 . . . . 0.0 110.103 179.48 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 70.4 t80 -103.66 130.93 51.2 Favored 'General case' 0 N--CA 1.494 1.771 0 O-C-N 121.645 -0.659 . . . . 0.0 110.203 179.735 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 30.6 t -124.01 146.97 48.18 Favored 'General case' 0 N--CA 1.495 1.814 0 O-C-N 121.693 -0.629 . . . . 0.0 110.189 -179.803 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 87.3 p -92.95 156.8 16.69 Favored 'General case' 0 N--CA 1.496 1.831 0 O-C-N 121.684 -0.635 . . . . 0.0 110.199 179.954 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 49.8 mttm -96.06 136.25 36.77 Favored 'General case' 0 N--CA 1.496 1.852 0 O-C-N 121.672 -0.643 . . . . 0.0 110.152 -179.827 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 17.3 t-20 -107.22 104.37 13.98 Favored 'General case' 0 N--CA 1.495 1.782 0 O-C-N 121.729 -0.607 . . . . 0.0 110.136 179.82 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 35.2 ttmt -95.21 -61.7 1.43 Allowed 'General case' 0 N--CA 1.494 1.761 0 O-C-N 121.659 -0.65 . . . . 0.0 110.259 179.652 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 91' ' ' TRP . . . . . . . . . . . . . 98.0 m95 -114.16 141.93 46.89 Favored 'General case' 0 N--CA 1.495 1.783 0 O-C-N 121.634 -0.666 . . . . 0.0 110.175 -179.919 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 8.0 t -133.34 33.61 3.57 Favored 'General case' 0 N--CA 1.494 1.77 0 O-C-N 121.737 -0.602 . . . . 0.0 110.274 179.81 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 93' ' ' MET . . . . . . . . . . . . . 90.2 mtp -65.03 -35.71 82.05 Favored 'General case' 0 N--CA 1.5 2.044 0 O-C-N 121.555 -0.716 . . . . 0.0 110.406 -179.683 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 18.6 t70 . . . . . 0 N--CA 1.505 2.294 0 CA-C-O 118.048 -0.977 . . . . 0.0 110.944 -179.901 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' B' B ' 240' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.292 0 N-CA-C 109.566 -1.413 . . . . 0.0 109.566 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' B' B ' 241' ' ' ALA . . . . . . . . . . . . . . . -104.68 145.49 30.27 Favored 'General case' 0 N--CA 1.494 1.768 0 O-C-N 121.594 -0.945 . . . . 0.0 110.186 179.972 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 242' ' ' THR . . . . . . . . . . . . . 40.4 p -121.75 159.56 26.4 Favored 'General case' 0 N--CA 1.496 1.829 0 O-C-N 121.689 -0.632 . . . . 0.0 110.238 179.711 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 243' ' ' THR . . . . . . . . . . . . . 24.8 m -124.43 137.42 54.45 Favored 'General case' 0 N--CA 1.495 1.812 0 O-C-N 121.643 -0.661 . . . . 0.0 110.19 -179.542 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 244' ' ' LYS . . . . . . . . . . . . . 54.8 mttm -103.85 146.23 28.95 Favored 'General case' 0 N--CA 1.495 1.787 0 O-C-N 121.654 -0.654 . . . . 0.0 110.083 179.233 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 245' ' ' GLU . . . . . . . . . . . . . 25.7 tp10 59.63 156.8 0.03 OUTLIER 'General case' 0 N--CA 1.508 2.444 0 O-C-N 121.672 -0.643 . . . . 0.0 110.762 -177.905 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 246' ' ' LYS . . . . . . . . . . . . . 48.4 mttp -88.57 124.69 34.29 Favored 'General case' 0 N--CA 1.497 1.907 0 O-C-N 121.525 -0.734 . . . . 0.0 110.188 179.98 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 247' ' ' ASN . . . . . . . . . . . . . 63.2 t30 -82.71 -34.15 27.37 Favored 'General case' 0 N--CA 1.497 1.919 0 O-C-N 121.679 -0.638 . . . . 0.0 110.196 179.585 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 248' ' ' ILE . . . . . . . . . . . . . 82.7 mt 53.4 76.77 0.08 OUTLIER 'Isoleucine or valine' 0 N--CA 1.506 2.364 0 O-C-N 121.485 -0.76 . . . . 0.0 110.411 -179.519 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 249' ' ' SER . . . . . . . . . . . . . 88.3 p -67.38 -30.24 69.97 Favored 'General case' 0 N--CA 1.501 2.083 0 O-C-N 121.602 -0.686 . . . . 0.0 110.416 179.409 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 250' ' ' VAL . . . . . . . . . . . . . 60.6 t -88.58 147.91 4.9 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.992 0 O-C-N 121.615 -0.678 . . . . 0.0 109.643 179.861 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 251' ' ' ASP . . . . . 0.615 ' CG ' ' HB2' ' B' ' 254' ' ' ALA . 6.8 t0 66.27 -65.03 0.2 Allowed 'General case' 0 N--CA 1.509 2.484 0 O-C-N 121.987 -0.445 . . . . 0.0 110.899 -177.22 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 252' ' ' VAL . . . . . . . . . . . . . 38.3 t 60.28 117.37 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.509 2.509 0 O-C-N 121.626 -0.671 . . . . 0.0 110.648 -179.384 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 253' ' ' ASP . . . . . . . . . . . . . 74.3 m-20 52.77 47.32 24.93 Favored 'General case' 0 N--CA 1.506 2.344 0 O-C-N 121.559 -0.713 . . . . 0.0 110.766 -178.848 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 254' ' ' ALA . . . . . 0.615 ' HB2' ' CG ' ' B' ' 251' ' ' ASP . . . -68.09 -31.31 70.85 Favored 'General case' 0 N--CA 1.498 1.972 0 O-C-N 121.681 -0.637 . . . . 0.0 110.474 179.435 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 255' ' ' ASP . . . . . . . . . . . . . 74.3 m-20 -72.52 -32.18 65.93 Favored 'General case' 0 N--CA 1.499 1.995 0 O-C-N 121.663 -0.648 . . . . 0.0 110.443 -177.544 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 256' ' ' ALA . . . . . . . . . . . . . . . -63.52 -50.09 70.93 Favored 'General case' 0 N--CA 1.502 2.157 0 O-C-N 121.439 -0.788 . . . . 0.0 110.393 -178.264 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 257' ' ' SER . . . . . . . . . . . . . 24.2 m -56.34 -36.11 68.38 Favored 'General case' 0 N--CA 1.503 2.204 0 O-C-N 121.691 -0.631 . . . . 0.0 110.521 177.44 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 258' ' ' SER . . . . . . . . . . . . . 22.7 t -69.46 -38.25 77.66 Favored 'General case' 0 N--CA 1.498 1.925 0 C-N-CA 120.481 -0.487 . . . . 0.0 110.317 -179.04 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 259' ' ' GLN . . . . . . . . . . . . . 88.7 mm-40 -64.73 -35.44 81.07 Favored 'General case' 0 N--CA 1.501 2.087 0 O-C-N 121.6 -0.687 . . . . 0.0 110.407 -179.748 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 260' ' ' LEU . . . . . . . . . . . . . 83.6 mt -67.56 -38.62 84.38 Favored 'General case' 0 N--CA 1.498 1.971 0 O-C-N 121.639 -0.663 . . . . 0.0 110.27 179.269 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 261' ' ' LEU . . . . . 0.61 HD13 HD12 ' A' ' 55' ' ' LEU . 47.9 tp -67.99 -39.89 83.19 Favored 'General case' 0 N--CA 1.498 1.957 0 O-C-N 121.57 -0.706 . . . . 0.0 109.994 178.668 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 262' ' ' SER . . . . . . . . . . . . . 21.0 m -63.18 -40.65 98.14 Favored 'General case' 0 N--CA 1.5 2.072 0 O-C-N 121.695 -0.628 . . . . 0.0 110.488 177.323 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 263' ' ' LEU . . . . . . . . . . . . . 51.5 mt -65.51 -42.63 91.88 Favored 'General case' 0 N--CA 1.501 2.083 0 O-C-N 121.715 -0.615 . . . . 0.0 110.23 179.327 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 264' ' ' LEU . . . . . 0.531 ' CD1' HD13 ' A' ' 55' ' ' LEU . 60.8 mt -62.41 -34.95 77.75 Favored 'General case' 0 N--CA 1.501 2.092 0 O-C-N 121.708 -0.62 . . . . 0.0 110.454 178.053 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 265' ' ' LYS . . . . . . . . . . . . . 51.2 tttm -76.11 -41.15 51.13 Favored 'General case' 0 N--CA 1.498 1.936 0 O-C-N 121.688 -0.632 . . . . 0.0 109.953 179.255 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 266' ' ' SER . . . . . . . . . . . . . 58.3 m 51.5 -174.35 0.02 OUTLIER 'General case' 0 N--CA 1.506 2.347 0 O-C-N 121.775 -0.578 . . . . 0.0 111.326 179.75 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 267' ' ' SER . . . . . . . . . . . . . 95.2 p -136.83 162.84 32.11 Favored 'General case' 0 N--CA 1.495 1.79 0 O-C-N 121.694 -0.629 . . . . 0.0 110.086 179.323 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 268' ' ' THR . . . . . . . . . . . . . 39.3 p -75.33 135.88 40.86 Favored 'General case' 0 N--CA 1.498 1.932 0 O-C-N 121.656 -0.652 . . . . 0.0 110.059 -179.437 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 269' ' ' ALA . . . . . . . . . . . . . . . -170.02 162.2 6.64 Favored Pre-proline 0 N--CA 1.498 1.935 0 O-C-N 121.571 -0.705 . . . . 0.0 109.962 179.761 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 270' ' ' PRO . . . . . . . . . . . . . 17.2 Cg_exo -63.31 126.05 16.97 Favored 'Trans proline' 0 N--CA 1.49 1.284 0 O-C-N 123.603 1.317 . . . . 0.0 110.573 179.473 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 271' ' ' SER . . . . . . . . . . . . . 3.1 m -95.99 -33.36 12.17 Favored 'General case' 0 N--CA 1.496 1.852 0 O-C-N 121.632 -0.667 . . . . 0.0 110.289 179.112 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 272' ' ' ASP . . . . . . . . . . . . . 11.4 p-10 -128.55 -163.75 1.31 Allowed 'General case' 0 N--CA 1.496 1.871 0 O-C-N 121.601 -0.687 . . . . 0.0 110.15 -179.136 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 273' ' ' LEU . . . . . . . . . . . . . 44.4 mt 54.5 101.79 0.01 OUTLIER 'General case' 0 N--CA 1.507 2.392 0 O-C-N 121.71 -0.619 . . . . 0.0 111.297 179.894 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 274' ' ' ALA . . . . . . . . . . . . . . . 55.66 99.46 0.02 OUTLIER 'General case' 0 N--CA 1.505 2.286 0 O-C-N 121.607 -0.683 . . . . 0.0 111.045 179.889 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 275' ' ' THR . . . . . . . . . . . . . 22.5 m -119.88 91.16 44.97 Favored Pre-proline 0 N--CA 1.496 1.825 0 O-C-N 121.814 -0.554 . . . . 0.0 110.001 178.431 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 276' ' ' PRO . . . . . . . . . . . . . 18.5 Cg_endo -64.01 -30.8 66.54 Favored 'Trans proline' 0 N--CA 1.491 1.335 0 O-C-N 123.457 1.24 . . . . 0.0 110.736 -177.589 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 277' ' ' GLN . . . . . . . . . . . . . 50.0 mm-40 -81.56 152.26 69.6 Favored Pre-proline 0 N--CA 1.497 1.884 0 O-C-N 121.624 -0.673 . . . . 0.0 110.088 179.559 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 278' ' ' PRO . . . . . . . . . . . . . 28.4 Cg_endo -67.3 136.17 39.34 Favored 'Trans proline' 0 N--CA 1.487 1.133 0 O-C-N 123.599 1.315 . . . . 0.0 110.365 -179.845 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 279' ' ' SER . . . . . . . . . . . . . 88.6 p -149.47 162.35 40.31 Favored 'General case' 0 N--CA 1.495 1.802 0 O-C-N 121.763 -0.586 . . . . 0.0 110.289 -179.628 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 280' ' ' THR . . . . . . . . . . . . . 9.7 t -134.68 158.19 44.73 Favored 'General case' 0 N--CA 1.497 1.877 0 O-C-N 121.711 -0.618 . . . . 0.0 110.3 179.08 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 281' ' ' PHE . . . . . . . . . . . . . 24.3 p90 -76.92 147.7 77.76 Favored Pre-proline 0 N--CA 1.499 1.991 0 O-C-N 121.624 -0.672 . . . . 0.0 110.109 -179.225 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 282' ' ' PRO . . . . . . . . . . . . . 37.5 Cg_endo -70.62 152.25 64.71 Favored 'Trans proline' 0 N--CA 1.487 1.114 0 O-C-N 123.515 1.271 . . . . 0.0 110.198 179.644 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 283' ' ' GLN . . . . . . . . . . . . . 7.9 mt-30 -89.52 -52.37 0.34 Allowed Pre-proline 0 N--CA 1.499 1.986 0 O-C-N 121.635 -0.666 . . . . 0.0 111.326 -176.312 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 284' ' ' PRO . . . . . 0.417 ' N ' ' CD ' ' B' ' 285' ' ' PRO . 26.9 Cg_exo -54.32 -48.1 23.32 Favored 'Trans proline' 0 N--CA 1.493 1.472 0 O-C-N 123.053 1.028 . . . . 0.0 112.055 -174.439 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 285' ' ' PRO . . . . . 0.417 ' CD ' ' N ' ' B' ' 284' ' ' PRO . 19.8 Cg_exo -62.21 100.62 0.22 Allowed 'Trans proline' 0 N--CA 1.493 1.451 0 O-C-N 123.091 1.048 . . . . 0.0 110.785 -177.65 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 286' ' ' VAL . . . . . . . . . . . . . 57.6 t -70.34 -34.94 60.33 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.099 0 O-C-N 121.717 -0.614 . . . . 0.0 109.647 178.273 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 287' ' ' GLU . . . . . . . . . . . . . 77.6 mt-10 54.06 177.31 0.02 OUTLIER 'General case' 0 N--CA 1.506 2.368 0 O-C-N 121.686 -0.634 . . . . 0.0 111.222 -179.48 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 288' ' ' SER . . . . . . . . . . . . . 3.5 m -99.49 -36.16 9.65 Favored 'General case' 0 N--CA 1.494 1.773 0 O-C-N 121.571 -0.706 . . . . 0.0 110.409 -178.889 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 289' ' ' HIS . . . . . . . . . . . . . 76.9 m80 -115.76 139.02 50.56 Favored 'General case' 0 N--CA 1.496 1.84 0 O-C-N 121.672 -0.643 . . . . 0.0 110.277 -178.165 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 290' ' ' SER . . . . . . . . . . . . . 33.2 t -130.83 142.6 50.4 Favored 'General case' 0 N--CA 1.496 1.844 0 O-C-N 121.765 -0.585 . . . . 0.0 110.123 179.033 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 291' ' ' SER . . . . . . . . . . . . . 3.5 t . . . . . 0 N--CA 1.495 1.814 0 CA-C-O 118.037 -0.983 . . . . 0.0 110.166 -179.925 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' -1' ' ' MET . . . . . . . . . . . . . 22.9 ttt . . . . . 0 N--CA 1.492 1.649 0 CA-C-O 121.065 0.459 . . . . 0.0 110.257 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 0' ' ' GLY . . . . . . . . . . . . . . . 91.26 168.03 41.35 Favored Glycine 0 N--CA 1.493 2.478 0 N-CA-C 109.535 -1.426 . . . . 0.0 109.535 -179.875 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 65.6 mtt -136.36 158.67 43.86 Favored 'General case' 0 N--CA 1.495 1.791 0 O-C-N 121.637 -0.919 . . . . 0.0 110.275 179.989 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 70.5 m -101.04 170.58 8.18 Favored 'General case' 0 N--CA 1.494 1.768 0 O-C-N 121.658 -0.651 . . . . 0.0 110.067 178.809 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 3' ' ' VAL . . . . . 0.43 HG11 ' CB ' ' A' ' 28' ' ' PHE . 51.0 t -64.7 -28.33 44.56 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.207 0 O-C-N 121.625 -0.672 . . . . 0.0 110.245 -179.283 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -56.09 -32.55 64.26 Favored 'General case' 0 N--CA 1.503 2.215 0 O-C-N 121.479 -0.763 . . . . 0.0 110.35 179.609 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 9.7 m-20 -68.8 -35.63 77.25 Favored 'General case' 0 N--CA 1.498 1.958 0 O-C-N 121.862 -0.524 . . . . 0.0 109.932 175.725 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 6' ' ' PHE . . . . . 0.402 ' CD1' HD21 ' B' ' 260' ' ' LEU . 97.0 m-85 -97.94 10.08 41.17 Favored 'General case' 0 N--CA 1.497 1.891 0 O-C-N 121.723 -0.611 . . . . 0.0 111.24 178.904 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -67.51 128.2 35.56 Favored 'General case' 0 N--CA 1.5 2.047 0 O-C-N 121.294 -0.879 . . . . 0.0 109.927 179.134 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 8' ' ' GLY . . . . . 0.466 ' O ' HG13 ' A' ' 24' ' ' VAL . . . 82.27 -0.33 88.99 Favored Glycine 0 N--CA 1.496 2.694 0 N-CA-C 110.616 -0.994 . . . . 0.0 110.616 -174.976 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 32.0 t -77.17 137.69 39.03 Favored 'General case' 0 N--CA 1.498 1.93 0 O-C-N 121.144 -1.21 . . . . 0.0 110.432 177.599 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 14.6 t-20 -83.96 119.23 24.65 Favored 'General case' 0 N--CA 1.498 1.953 0 O-C-N 121.671 -0.643 . . . . 0.0 109.782 174.642 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . 0.521 HG12 ' HA ' ' A' ' 57' ' ' ILE . 34.6 m -143.01 161.83 17.54 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.811 0 N-CA-C 109.567 -0.531 . . . . 0.0 109.567 -179.854 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . 0.451 ' HB2' HD11 ' A' ' 58' ' ' LEU . 35.4 tt0 -109.41 129.59 55.54 Favored 'General case' 0 N--CA 1.493 1.685 0 C-N-CA 119.87 -0.732 . . . . 0.0 110.126 178.448 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . 0.562 HG22 ' CD2' ' A' ' 55' ' ' LEU . 58.9 t -106.74 127.65 62.08 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.772 0 O-C-N 121.68 -0.638 . . . . 0.0 109.827 -179.402 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 28.5 tp -95.86 126.05 40.85 Favored 'General case' 0 N--CA 1.494 1.746 0 N-CA-C 109.077 -0.712 . . . . 0.0 109.077 174.485 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 86.7 mt -96.01 166.93 11.53 Favored 'General case' 0 N--CA 1.495 1.794 0 C-N-CA 120.087 -0.645 . . . . 0.0 111.166 -172.496 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 24.1 p30 -58.4 -21.82 51.82 Favored 'General case' 0 N--CA 1.505 2.323 0 O-C-N 121.82 -0.55 . . . . 0.0 111.668 -177.029 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 42.5 p-10 -92.73 23.45 4.11 Favored 'General case' 0 N--CA 1.498 1.966 0 O-C-N 121.576 -0.703 . . . . 0.0 110.811 -176.041 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 74.4 m-20 58.85 27.29 15.93 Favored 'General case' 0 N--CA 1.507 2.379 0 O-C-N 121.558 -0.714 . . . . 0.0 110.608 175.805 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 50.5 m -106.96 145.44 32.25 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.526 -0.734 . . . . 0.0 109.575 172.831 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 98.1 mttt -109.61 147.72 32.55 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.59 -0.694 . . . . 0.0 110.571 -176.345 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -153.08 153.97 33.91 Favored 'General case' 0 N--CA 1.497 1.911 0 O-C-N 121.796 -0.565 . . . . 0.0 110.254 176.204 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 33.0 ptt180 -142.69 150.35 40.04 Favored 'General case' 0 N--CA 1.496 1.842 0 O-C-N 121.648 -0.658 . . . . 0.0 110.308 178.364 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . 0.425 ' HA2' HD13 ' A' ' 39' ' ' LEU . . . -171.9 171.17 43.98 Favored Glycine 0 N--CA 1.492 2.429 0 N-CA-C 109.167 -1.573 . . . . 0.0 109.167 -179.871 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . 0.466 HG13 ' O ' ' A' ' 8' ' ' GLY . 45.2 t -94.61 126.65 46.99 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.88 0 O-C-N 121.7 -0.882 . . . . 0.0 109.237 176.363 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 25' ' ' ILE . . . . . 0.468 ' HA ' HD23 ' A' ' 37' ' ' LEU . 47.7 mt -61.73 138.0 22.94 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.249 0 O-C-N 121.57 -0.706 . . . . 0.0 110.854 -170.373 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . 0.671 HG21 ' HB2' ' A' ' 38' ' ' ARG . 13.2 p -121.24 -19.65 7.0 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.9 -0.5 . . . . 0.0 111.515 -179.937 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 33.0 t30 -165.98 158.18 14.47 Favored 'General case' 0 N--CA 1.504 2.25 0 O-C-N 120.826 -1.172 . . . . 0.0 111.922 176.221 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 28' ' ' PHE . . . . . 0.43 ' CB ' HG11 ' A' ' 3' ' ' VAL . 65.0 t80 -150.3 120.7 7.37 Favored 'General case' 0 N--CA 1.495 1.818 0 N-CA-C 109.166 -0.679 . . . . 0.0 109.166 173.431 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 17.9 t70 -97.81 127.42 43.75 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.593 -0.692 . . . . 0.0 109.212 -177.713 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 22.1 m -66.41 -46.53 76.24 Favored 'General case' 0 N--CA 1.499 2.0 0 O-C-N 121.524 -0.735 . . . . 0.0 110.772 -175.174 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 21.1 m -58.92 -47.36 85.3 Favored 'General case' 0 N--CA 1.502 2.174 0 O-C-N 121.602 -0.686 . . . . 0.0 110.957 -173.796 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 92.4 m-20 -106.29 -3.22 21.45 Favored 'General case' 0 N--CA 1.497 1.889 0 O-C-N 121.536 -0.727 . . . . 0.0 111.711 -178.188 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 15.3 m 49.14 67.15 0.92 Allowed 'General case' 0 N--CA 1.507 2.419 0 O-C-N 121.049 -1.032 . . . . 0.0 110.907 -174.314 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 34' ' ' ILE . . . . . 1.067 HD12 HG22 ' A' ' 48' ' ' VAL . 43.7 mm -114.64 125.78 72.04 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.936 0 O-C-N 121.545 -0.722 . . . . 0.0 109.21 -175.55 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 14.5 tp -115.98 119.03 34.6 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.609 -0.682 . . . . 0.0 110.47 -169.858 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 55.4 mt-30 -91.04 131.94 36.32 Favored 'General case' 0 N--CA 1.491 1.593 0 N-CA-C 109.182 -0.673 . . . . 0.0 109.182 170.838 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 0.468 HD23 ' HA ' ' A' ' 25' ' ' ILE . 49.4 mt -117.73 123.49 46.17 Favored 'General case' 0 N--CA 1.493 1.707 0 C-N-CA 120.177 -0.609 . . . . 0.0 110.041 175.926 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 38' ' ' ARG . . . . . 0.671 ' HB2' HG21 ' A' ' 26' ' ' THR . 57.2 ttt85 -105.0 104.95 14.78 Favored 'General case' 0 N--CA 1.495 1.782 0 O-C-N 121.77 -0.582 . . . . 0.0 110.076 173.877 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.425 HD13 ' HA2' ' A' ' 23' ' ' GLY . 65.3 tp -83.29 157.23 22.71 Favored 'General case' 0 N--CA 1.497 1.923 0 O-C-N 121.626 -0.671 . . . . 0.0 110.669 -176.344 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -67.89 -2.94 8.28 Favored 'General case' 0 N--CA 1.503 2.193 0 O-C-N 121.823 -0.548 . . . . 0.0 112.208 -170.819 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 29.9 m120 -86.63 29.21 0.8 Allowed 'General case' 0 N--CA 1.498 1.971 0 O-C-N 121.05 -1.031 . . . . 0.0 110.789 173.591 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 73.7 m-20 60.33 31.47 20.42 Favored 'General case' 0 N--CA 1.506 2.334 0 O-C-N 121.164 -0.96 . . . . 0.0 110.258 175.699 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 68.1 m -126.05 144.72 50.61 Favored 'General case' 0 N--CA 1.494 1.755 0 O-C-N 121.477 -0.765 . . . . 0.0 110.112 177.873 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 9.8 t -128.17 147.82 50.58 Favored 'General case' 0 N--CA 1.496 1.828 0 O-C-N 121.653 -0.654 . . . . 0.0 109.919 179.604 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . 0.778 ' HE2' HD11 ' A' ' 47' ' ' ILE . 6.0 ttpm? -150.38 130.04 13.15 Favored 'General case' 0 N--CA 1.495 1.82 0 O-C-N 121.716 -0.615 . . . . 0.0 110.505 -177.369 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 88.5 p -95.89 123.47 39.49 Favored 'General case' 0 N--CA 1.494 1.77 0 O-C-N 121.683 -0.635 . . . . 0.0 110.396 179.748 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 47' ' ' ILE . . . . . 0.778 HD11 ' HE2' ' A' ' 45' ' ' LYS . 80.6 mt -129.31 138.25 54.86 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.889 0 N-CA-C 109.19 -0.67 . . . . 0.0 109.19 177.647 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 48' ' ' VAL . . . . . 1.067 HG22 HD12 ' A' ' 34' ' ' ILE . 67.9 t -82.05 127.65 39.43 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.876 0 O-C-N 121.6 -0.687 . . . . 0.0 109.183 177.766 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 49' ' ' THR . . . . . 0.47 ' HB ' HD22 ' B' ' 264' ' ' LEU . 47.3 p -58.13 -24.92 60.59 Favored 'General case' 0 N--CA 1.505 2.283 0 O-C-N 121.539 -0.726 . . . . 0.0 111.964 -169.142 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 31.5 tttp -56.92 -26.87 60.17 Favored 'General case' 0 N--CA 1.502 2.131 0 O-C-N 121.529 -0.732 . . . . 0.0 110.963 -177.08 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 4.7 p30 -85.21 7.37 22.23 Favored 'General case' 0 N--CA 1.499 1.99 0 C-N-CA 119.677 -0.809 . . . . 0.0 111.353 176.538 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 98.2 mt -75.04 125.59 34.78 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.111 0 O-C-N 121.119 -0.988 . . . . 0.0 109.878 175.186 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 50.4 tttm -92.16 -31.34 15.52 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.812 -0.555 . . . . 0.0 109.718 170.68 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . 0.405 ' HA ' HD22 ' B' ' 261' ' ' LEU . 1.0 OUTLIER -161.11 153.38 20.17 Favored 'General case' 0 N--CA 1.499 1.991 0 O-C-N 121.699 -0.626 . . . . 0.0 110.072 -176.418 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . 0.562 ' CD2' HG22 ' A' ' 13' ' ' VAL . 85.2 mt -132.92 149.92 52.2 Favored 'General case' 0 N--CA 1.497 1.925 0 O-C-N 121.745 -0.597 . . . . 0.0 110.523 -179.311 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 4.9 ptm180 -152.27 140.86 20.79 Favored 'General case' 0 N--CA 1.496 1.869 0 O-C-N 121.783 -0.573 . . . . 0.0 109.856 175.118 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 57' ' ' ILE . . . . . 0.521 ' HA ' HG12 ' A' ' 11' ' ' VAL . 59.3 mt -85.28 133.3 29.73 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.863 0 O-C-N 121.428 -0.795 . . . . 0.0 109.856 174.667 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . 0.451 HD11 ' HB2' ' A' ' 12' ' ' GLU . 83.1 mt -82.87 159.92 62.07 Favored Pre-proline 0 N--CA 1.498 1.942 0 O-C-N 121.631 -0.668 . . . . 0.0 110.051 -179.09 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 19.6 Cg_endo -64.53 145.29 87.21 Favored 'Trans proline' 0 N--CA 1.489 1.233 0 O-C-N 123.64 1.337 . . . . 0.0 110.563 -178.699 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 18.9 tptm -125.55 148.55 48.87 Favored 'General case' 0 N--CA 1.496 1.855 0 O-C-N 121.72 -0.612 . . . . 0.0 110.164 -179.775 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 37.0 t30 -90.15 134.34 34.34 Favored 'General case' 0 N--CA 1.496 1.845 0 O-C-N 121.603 -0.686 . . . . 0.0 110.21 -179.306 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 75.0 mm-40 -97.66 177.88 5.34 Favored 'General case' 0 N--CA 1.496 1.835 0 O-C-N 121.656 -0.652 . . . . 0.0 110.166 -179.638 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 63' ' ' ILE . . . . . 0.514 HG23 ' O ' ' A' ' 63' ' ' ILE . 16.2 tt -138.94 64.26 0.21 Allowed 'Isoleucine or valine' 0 N--CA 1.497 1.916 0 O-C-N 121.719 -0.613 . . . . 0.0 110.211 -179.148 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 64' ' ' MET . . . . . . . . . . . . . 2.9 ptt? 37.25 54.1 3.12 Favored Pre-proline 0 N--CA 1.513 2.692 0 N-CA-C 112.709 0.633 . . . . 0.0 112.709 179.153 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 23.3 Cg_endo -65.47 -30.5 52.52 Favored 'Trans proline' 0 N--CA 1.49 1.265 0 O-C-N 123.393 1.207 . . . . 0.0 110.602 -179.761 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 27.0 mtpp -91.23 156.0 18.15 Favored 'General case' 0 N--CA 1.496 1.842 0 O-C-N 121.595 -0.691 . . . . 0.0 110.153 179.917 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 17.0 t-20 -94.61 130.48 41.04 Favored 'General case' 0 N--CA 1.496 1.836 0 O-C-N 121.691 -0.63 . . . . 0.0 110.261 -179.042 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 81.48 33.46 28.14 Favored Glycine 0 N--CA 1.495 2.598 0 N-CA-C 109.714 -1.354 . . . . 0.0 109.714 179.872 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 24.7 m -128.96 137.12 51.19 Favored 'General case' 0 N--CA 1.495 1.796 0 O-C-N 121.653 -0.91 . . . . 0.0 110.097 179.444 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 53.8 mttp -111.45 117.54 33.34 Favored 'General case' 0 N--CA 1.496 1.843 0 O-C-N 121.714 -0.616 . . . . 0.0 110.218 179.787 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -77.15 -56.43 1.24 Allowed Pre-proline 0 N--CA 1.496 1.867 0 O-C-N 121.696 -0.628 . . . . 0.0 110.626 179.265 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 38.0 Cg_endo -72.41 154.89 55.87 Favored 'Trans proline' 0 N--CA 1.486 1.062 0 O-C-N 123.337 1.177 . . . . 0.0 110.376 -177.756 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 23.0 t -64.34 -33.02 74.87 Favored 'General case' 0 N--CA 1.502 2.142 0 O-C-N 121.685 -0.634 . . . . 0.0 110.418 179.751 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 10.0 t -130.74 152.74 49.76 Favored 'General case' 0 N--CA 1.496 1.828 0 O-C-N 121.673 -0.642 . . . . 0.0 110.366 179.718 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 12.6 t-20 -117.66 115.66 25.52 Favored 'General case' 0 N--CA 1.495 1.819 0 O-C-N 121.739 -0.601 . . . . 0.0 110.104 -179.554 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 30.3 t -122.05 120.41 34.25 Favored 'General case' 0 N--CA 1.496 1.835 0 O-C-N 121.716 -0.615 . . . . 0.0 110.259 -179.928 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 69.6 p 44.25 30.26 0.44 Allowed 'General case' 0 N--CA 1.51 2.563 0 CA-C-O 120.972 0.415 . . . . 0.0 111.969 177.975 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 18.6 tptm -68.83 -44.81 72.67 Favored 'General case' 0 N--CA 1.498 1.97 0 O-C-N 121.531 -0.731 . . . . 0.0 110.117 -179.388 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 82.8 mt -110.21 134.56 52.1 Favored 'General case' 0 N--CA 1.496 1.853 0 O-C-N 121.651 -0.655 . . . . 0.0 110.254 -179.924 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 52.4 pttt -65.42 -32.12 73.58 Favored 'General case' 0 N--CA 1.498 1.971 0 O-C-N 121.599 -0.688 . . . . 0.0 110.653 179.631 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 23.4 t -63.86 -37.8 88.73 Favored 'General case' 0 N--CA 1.502 2.141 0 O-C-N 121.662 -0.649 . . . . 0.0 110.503 -178.838 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -113.14 29.98 7.56 Favored 'General case' 0 N--CA 1.496 1.849 0 O-C-N 121.659 -0.65 . . . . 0.0 110.484 179.931 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 41.1 tt0 -69.56 -38.08 77.27 Favored 'General case' 0 N--CA 1.499 2.001 0 O-C-N 121.583 -0.698 . . . . 0.0 110.167 -179.968 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 42.0 p -77.88 -35.57 50.71 Favored 'General case' 0 N--CA 1.498 1.966 0 O-C-N 121.677 -0.64 . . . . 0.0 110.351 -179.034 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 99.1 m-85 -121.64 132.46 54.67 Favored 'General case' 0 N--CA 1.496 1.847 0 O-C-N 121.696 -0.627 . . . . 0.0 110.314 -179.568 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 11.3 t -101.03 -51.88 3.42 Favored 'General case' 0 N--CA 1.494 1.768 0 O-C-N 121.737 -0.602 . . . . 0.0 110.233 178.906 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 50.4 m -129.4 147.6 51.23 Favored 'General case' 0 N--CA 1.496 1.865 0 O-C-N 121.718 -0.614 . . . . 0.0 110.185 179.562 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 25.3 mmmt -127.37 144.1 51.11 Favored 'General case' 0 N--CA 1.496 1.859 0 O-C-N 121.672 -0.643 . . . . 0.0 110.163 179.704 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 29.8 m120 -106.38 119.95 40.6 Favored 'General case' 0 N--CA 1.495 1.813 0 O-C-N 121.677 -0.639 . . . . 0.0 110.1 179.276 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 52.4 mttp -94.75 -68.97 0.77 Allowed 'General case' 0 N--CA 1.495 1.795 0 O-C-N 121.719 -0.613 . . . . 0.0 110.321 -179.263 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 91' ' ' TRP . . . . . . . . . . . . . 86.6 t90 -133.33 133.21 42.23 Favored 'General case' 0 N--CA 1.495 1.777 0 O-C-N 121.525 -0.734 . . . . 0.0 110.269 -179.185 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 3.7 m -151.24 -70.84 0.17 Allowed 'General case' 0 N--CA 1.495 1.786 0 O-C-N 121.729 -0.607 . . . . 0.0 110.119 178.355 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 93' ' ' MET . . . . . . . . . . . . . 89.1 mmm -70.98 -38.77 72.75 Favored 'General case' 0 N--CA 1.499 2.005 0 O-C-N 121.63 -0.669 . . . . 0.0 110.087 178.966 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 2.6 p30 . . . . . 0 N--CA 1.498 1.952 0 CA-C-O 118.078 -0.963 . . . . 0.0 110.219 -179.659 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' B' B ' 240' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.267 0 N-CA-C 109.532 -1.427 . . . . 0.0 109.532 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' B' B ' 241' ' ' ALA . . . . . . . . . . . . . . . -148.02 157.99 43.81 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.692 -0.887 . . . . 0.0 110.262 -179.995 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 242' ' ' THR . . . . . . . . . . . . . 51.5 p -127.11 158.02 38.13 Favored 'General case' 0 N--CA 1.496 1.871 0 O-C-N 121.613 -0.679 . . . . 0.0 110.181 -179.847 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 243' ' ' THR . . . . . 0.469 HG22 ' O ' ' B' ' 243' ' ' THR . 15.5 m 51.84 29.85 6.42 Favored 'General case' 0 N--CA 1.506 2.345 0 O-C-N 121.655 -0.653 . . . . 0.0 111.197 -179.518 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 244' ' ' LYS . . . . . . . . . . . . . 17.0 ttmm -112.27 -48.73 3.01 Favored 'General case' 0 N--CA 1.496 1.834 0 O-C-N 121.641 -0.662 . . . . 0.0 110.202 179.669 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 245' ' ' GLU . . . . . . . . . . . . . 45.7 tt0 -100.84 140.39 35.19 Favored 'General case' 0 N--CA 1.494 1.757 0 O-C-N 121.721 -0.612 . . . . 0.0 110.227 -179.446 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 246' ' ' LYS . . . . . . . . . . . . . 72.5 tttt -92.49 140.42 29.59 Favored 'General case' 0 N--CA 1.495 1.812 0 O-C-N 121.718 -0.614 . . . . 0.0 110.146 179.76 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 247' ' ' ASN . . . . . . . . . . . . . 17.4 t-20 -94.4 114.76 26.85 Favored 'General case' 0 N--CA 1.495 1.821 0 O-C-N 121.738 -0.601 . . . . 0.0 110.165 -179.801 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 248' ' ' ILE . . . . . 0.414 HG23 ' N ' ' B' ' 249' ' ' SER . 7.1 tp -163.48 -40.24 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.498 1.951 0 O-C-N 121.692 -0.63 . . . . 0.0 110.502 -179.585 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 249' ' ' SER . . . . . 0.414 ' N ' HG23 ' B' ' 248' ' ' ILE . 87.0 p -69.18 170.71 9.59 Favored 'General case' 0 N--CA 1.498 1.964 0 O-C-N 121.516 -0.74 . . . . 0.0 110.245 -179.984 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 250' ' ' VAL . . . . . . . . . . . . . 28.6 m -149.02 161.23 5.26 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.98 0 O-C-N 121.658 -0.651 . . . . 0.0 109.989 -179.466 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 251' ' ' ASP . . . . . . . . . . . . . 74.5 m-20 52.3 -176.93 0.02 OUTLIER 'General case' 0 N--CA 1.506 2.366 0 O-C-N 121.614 -0.679 . . . . 0.0 111.195 -179.028 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 252' ' ' VAL . . . . . 0.441 HG12 ' N ' ' B' ' 253' ' ' ASP . 42.3 t 57.54 165.46 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.51 2.569 0 O-C-N 121.767 -0.583 . . . . 0.0 110.718 -179.008 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 253' ' ' ASP . . . . . 0.551 ' OD2' ' HB2' ' B' ' 256' ' ' ALA . 11.4 p-10 -162.28 146.03 11.89 Favored 'General case' 0 N--CA 1.497 1.879 0 O-C-N 121.383 -0.823 . . . . 0.0 110.42 178.506 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 254' ' ' ALA . . . . . . . . . . . . . . . -67.49 -27.92 67.41 Favored 'General case' 0 N--CA 1.499 2.016 0 O-C-N 121.684 -0.635 . . . . 0.0 110.781 -179.398 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 255' ' ' ASP . . . . . . . . . . . . . 26.1 t0 -71.24 -32.33 68.64 Favored 'General case' 0 N--CA 1.498 1.972 0 O-C-N 121.542 -0.724 . . . . 0.0 110.306 -177.362 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 256' ' ' ALA . . . . . 0.551 ' HB2' ' OD2' ' B' ' 253' ' ' ASP . . . -64.26 -47.13 80.76 Favored 'General case' 0 N--CA 1.5 2.07 0 O-C-N 121.563 -0.711 . . . . 0.0 110.353 179.896 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 257' ' ' SER . . . . . . . . . . . . . 49.0 m -55.64 -35.76 66.29 Favored 'General case' 0 N--CA 1.503 2.21 0 O-C-N 121.678 -0.639 . . . . 0.0 110.482 178.181 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 258' ' ' SER . . . . . . . . . . . . . 25.1 m -69.29 -31.79 70.52 Favored 'General case' 0 N--CA 1.497 1.892 0 O-C-N 121.864 -0.523 . . . . 0.0 110.351 -179.937 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 259' ' ' GLN . . . . . . . . . . . . . 58.2 tp60 -62.65 -40.04 95.78 Favored 'General case' 0 N--CA 1.501 2.1 0 O-C-N 121.601 -0.687 . . . . 0.0 110.494 -178.665 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 260' ' ' LEU . . . . . 0.488 ' HA ' HD12 ' B' ' 263' ' ' LEU . 82.8 mt -68.83 -43.04 76.36 Favored 'General case' 0 N--CA 1.499 1.996 0 O-C-N 121.691 -0.631 . . . . 0.0 110.293 179.958 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 261' ' ' LEU . . . . . 0.405 HD22 ' HA ' ' A' ' 54' ' ' ASP . 17.6 tp -69.24 -36.22 76.94 Favored 'General case' 0 N--CA 1.498 1.941 0 O-C-N 121.586 -0.696 . . . . 0.0 109.768 177.87 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 262' ' ' SER . . . . . . . . . . . . . 22.7 t -62.33 -37.33 85.22 Favored 'General case' 0 N--CA 1.501 2.105 0 O-C-N 121.762 -0.586 . . . . 0.0 110.424 176.864 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 263' ' ' LEU . . . . . 0.488 HD12 ' HA ' ' B' ' 260' ' ' LEU . 33.0 mt -64.93 -41.72 95.3 Favored 'General case' 0 N--CA 1.5 2.068 0 O-C-N 121.726 -0.609 . . . . 0.0 110.31 179.552 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 264' ' ' LEU . . . . . 0.505 ' CD1' HD11 ' A' ' 55' ' ' LEU . 86.4 mt -62.05 -33.4 74.31 Favored 'General case' 0 N--CA 1.503 2.182 0 O-C-N 121.671 -0.643 . . . . 0.0 110.49 177.261 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 265' ' ' LYS . . . . . . . . . . . . . 79.5 mttt -75.17 -29.71 60.51 Favored 'General case' 0 N--CA 1.499 2.004 0 O-C-N 121.663 -0.648 . . . . 0.0 110.51 179.615 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 266' ' ' SER . . . . . . . . . . . . . 83.6 p -77.46 158.37 30.02 Favored 'General case' 0 N--CA 1.497 1.913 0 O-C-N 121.521 -0.737 . . . . 0.0 110.157 -179.824 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 267' ' ' SER . . . . . . . . . . . . . 10.5 t -92.69 -41.5 10.13 Favored 'General case' 0 N--CA 1.495 1.805 0 O-C-N 121.689 -0.632 . . . . 0.0 110.446 -178.155 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 268' ' ' THR . . . . . . . . . . . . . 39.9 p -126.82 151.17 48.66 Favored 'General case' 0 N--CA 1.496 1.835 0 O-C-N 121.636 -0.665 . . . . 0.0 110.323 -179.355 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 269' ' ' ALA . . . . . . . . . . . . . . . -72.89 159.75 84.56 Favored Pre-proline 0 N--CA 1.498 1.953 0 C-N-CA 120.351 -0.54 . . . . 0.0 110.095 178.762 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 270' ' ' PRO . . . . . . . . . . . . . 20.7 Cg_exo -61.73 -32.55 86.51 Favored 'Trans proline' 0 N--CA 1.492 1.387 0 O-C-N 123.627 1.33 . . . . 0.0 110.654 178.986 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 271' ' ' SER . . . . . . . . . . . . . 50.0 m -126.11 150.38 48.25 Favored 'General case' 0 N--CA 1.496 1.86 0 O-C-N 121.736 -0.603 . . . . 0.0 110.229 179.969 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 272' ' ' ASP . . . . . . . . . . . . . 74.4 m-20 -70.67 143.18 51.46 Favored 'General case' 0 N--CA 1.498 1.97 0 O-C-N 121.711 -0.618 . . . . 0.0 110.107 179.413 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 273' ' ' LEU . . . . . 0.515 ' O ' HG23 ' B' ' 275' ' ' THR . 83.1 mt 56.48 -82.74 0.01 OUTLIER 'General case' 0 N--CA 1.506 2.352 0 O-C-N 121.943 -0.473 . . . . 0.0 111.279 -178.574 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 274' ' ' ALA . . . . . . . . . . . . . . . 51.84 36.52 18.28 Favored 'General case' 0 N--CA 1.506 2.362 0 O-C-N 121.16 -0.963 . . . . 0.0 111.017 -178.755 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 275' ' ' THR . . . . . 0.515 HG23 ' O ' ' B' ' 273' ' ' LEU . 22.6 p -125.01 78.51 66.18 Favored Pre-proline 0 N--CA 1.495 1.821 0 O-C-N 121.567 -0.708 . . . . 0.0 110.127 179.355 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 276' ' ' PRO . . . . . . . . . . . . . 29.4 Cg_endo -67.82 155.46 69.78 Favored 'Trans proline' 0 N--CA 1.487 1.113 0 O-C-N 123.486 1.256 . . . . 0.0 110.412 179.672 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 277' ' ' GLN . . . . . . . . . . . . . 34.1 mt-30 -86.9 162.44 44.22 Favored Pre-proline 0 N--CA 1.497 1.895 0 O-C-N 121.689 -0.632 . . . . 0.0 110.134 179.662 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 278' ' ' PRO . . . . . . . . . . . . . 25.2 Cg_endo -66.35 138.85 52.33 Favored 'Trans proline' 0 N--CA 1.488 1.173 0 O-C-N 123.622 1.327 . . . . 0.0 110.415 -179.339 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 279' ' ' SER . . . . . . . . . . . . . 24.7 m -66.4 -34.12 77.24 Favored 'General case' 0 N--CA 1.499 2.008 0 O-C-N 121.661 -0.65 . . . . 0.0 110.313 -179.957 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 280' ' ' THR . . . . . . . . . . . . . 9.7 t -135.39 161.87 34.21 Favored 'General case' 0 N--CA 1.496 1.866 0 O-C-N 121.67 -0.644 . . . . 0.0 110.419 -179.292 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 281' ' ' PHE . . . . . . . . . . . . . 17.1 p90 -68.41 154.9 93.68 Favored Pre-proline 0 N--CA 1.498 1.97 0 O-C-N 121.722 -0.611 . . . . 0.0 110.25 179.818 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 282' ' ' PRO . . . . . . . . . . . . . 28.7 Cg_endo -67.26 -43.82 5.66 Favored 'Trans proline' 0 N--CA 1.488 1.196 0 O-C-N 123.711 1.374 . . . . 0.0 110.477 -179.322 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 283' ' ' GLN . . . . . . . . . . . . . 15.6 mt-30 -141.58 160.14 57.71 Favored Pre-proline 0 N--CA 1.494 1.762 0 O-C-N 121.652 -0.655 . . . . 0.0 110.211 179.681 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 284' ' ' PRO . . . . . . . . . . . . . 15.9 Cg_exo -64.32 154.87 68.87 Favored 'Trans proline' 0 N--CA 1.488 1.201 0 O-C-N 123.591 1.311 . . . . 0.0 110.536 -179.807 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 285' ' ' PRO . . . . . . . . . . . . . 33.0 Cg_endo -69.22 173.9 9.81 Favored 'Trans proline' 0 N--CA 1.488 1.193 0 O-C-N 123.713 1.375 . . . . 0.0 110.243 178.8 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 286' ' ' VAL . . . . . . . . . . . . . 13.4 p -128.0 137.34 57.8 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.885 0 O-C-N 121.731 -0.606 . . . . 0.0 110.107 179.617 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 287' ' ' GLU . . . . . . . . . . . . . 46.3 mt-10 -71.95 -36.54 69.91 Favored 'General case' 0 N--CA 1.499 2.018 0 O-C-N 121.645 -0.66 . . . . 0.0 110.359 -178.594 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 288' ' ' SER . . . . . . . . . . . . . 30.8 t -110.91 143.72 41.1 Favored 'General case' 0 N--CA 1.495 1.823 0 O-C-N 121.61 -0.681 . . . . 0.0 110.297 -178.676 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 289' ' ' HIS . . . . . . . . . . . . . 30.5 p80 -125.12 152.21 44.71 Favored 'General case' 0 N--CA 1.495 1.814 0 O-C-N 121.744 -0.597 . . . . 0.0 110.228 179.757 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 290' ' ' SER . . . . . . . . . . . . . 38.7 t 52.22 30.38 7.75 Favored 'General case' 0 N--CA 1.505 2.325 0 O-C-N 121.599 -0.688 . . . . 0.0 111.088 -179.637 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 291' ' ' SER . . . . . . . . . . . . . 29.5 t . . . . . 0 N--CA 1.494 1.765 0 CA-C-O 117.957 -1.021 . . . . 0.0 110.231 -179.819 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' -1' ' ' MET . . . . . . . . . . . . . 61.1 mtt . . . . . 0 N--CA 1.493 1.678 0 CA-C-O 121.02 0.438 . . . . 0.0 110.213 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 0' ' ' GLY . . . . . . . . . . . . . . . -85.09 -176.88 50.83 Favored Glycine 0 N--CA 1.493 2.49 0 N-CA-C 109.612 -1.395 . . . . 0.0 109.612 -179.923 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 24.8 ptm -124.02 52.25 1.48 Allowed 'General case' 0 N--CA 1.498 1.965 0 O-C-N 121.643 -0.916 . . . . 0.0 110.2 179.86 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 73.1 m -97.39 175.83 6.11 Favored 'General case' 0 N--CA 1.494 1.751 0 O-C-N 121.611 -0.681 . . . . 0.0 110.285 -178.387 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 3' ' ' VAL . . . . . 0.424 HG12 ' CE1' ' A' ' 7' ' ' TYR . 83.2 t -67.74 -27.64 38.78 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.095 0 O-C-N 121.754 -0.591 . . . . 0.0 110.251 -179.407 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -54.99 -30.33 59.12 Favored 'General case' 0 N--CA 1.505 2.281 0 O-C-N 121.446 -0.783 . . . . 0.0 110.533 -178.196 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 74.5 m-20 -68.74 -30.69 69.36 Favored 'General case' 0 N--CA 1.499 1.998 0 O-C-N 121.82 -0.55 . . . . 0.0 110.298 174.859 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 96.0 m-85 -95.59 10.03 38.14 Favored 'General case' 0 N--CA 1.497 1.903 0 O-C-N 121.538 -0.726 . . . . 0.0 111.485 -178.24 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 7' ' ' TYR . . . . . 0.424 ' CE1' HG12 ' A' ' 3' ' ' VAL . 3.6 m-30 -67.3 138.6 56.95 Favored 'General case' 0 N--CA 1.501 2.095 0 O-C-N 121.154 -0.966 . . . . 0.0 110.166 174.27 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 83.3 -2.27 87.35 Favored Glycine 0 N--CA 1.498 2.8 0 N-CA-C 110.757 -0.937 . . . . 0.0 110.757 -177.289 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 27.7 t -76.24 138.2 40.44 Favored 'General case' 0 N--CA 1.497 1.878 0 O-C-N 121.117 -1.225 . . . . 0.0 110.446 179.581 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 10' ' ' ASN . . . . . 0.684 ' CG ' HG22 ' A' ' 24' ' ' VAL . 2.5 m120 -83.4 118.37 23.67 Favored 'General case' 0 N--CA 1.498 1.937 0 O-C-N 121.629 -0.669 . . . . 0.0 109.411 173.882 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . 0.594 HG21 HD11 ' A' ' 25' ' ' ILE . 35.2 m -143.21 161.0 17.42 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.836 0 O-C-N 121.812 -0.555 . . . . 0.0 109.638 -178.361 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . 0.566 ' HB2' HD11 ' A' ' 58' ' ' LEU . 40.6 tt0 -109.48 126.02 53.08 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.481 -0.762 . . . . 0.0 110.111 178.075 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . 0.588 HG22 ' CD2' ' A' ' 55' ' ' LEU . 60.0 t -106.81 124.4 62.44 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.782 0 O-C-N 121.663 -0.648 . . . . 0.0 110.005 -178.521 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 21.9 tp -95.96 129.27 43.26 Favored 'General case' 0 N--CA 1.494 1.758 0 O-C-N 121.697 -0.627 . . . . 0.0 109.495 174.073 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 85.9 mt -98.86 167.24 10.88 Favored 'General case' 0 N--CA 1.495 1.803 0 O-C-N 121.607 -0.683 . . . . 0.0 111.052 -172.75 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 9.6 p30 -57.95 -22.35 48.63 Favored 'General case' 0 N--CA 1.505 2.313 0 O-C-N 121.832 -0.543 . . . . 0.0 111.555 -177.412 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 43.5 p-10 -92.46 23.28 4.05 Favored 'General case' 0 N--CA 1.498 1.97 0 O-C-N 121.428 -0.795 . . . . 0.0 110.847 -176.823 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 58.77 27.83 16.52 Favored 'General case' 0 N--CA 1.505 2.279 0 O-C-N 121.498 -0.751 . . . . 0.0 110.714 175.194 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 50.8 m -105.54 133.98 49.4 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.531 -0.731 . . . . 0.0 109.542 171.754 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 33.0 ttmt -109.81 141.86 41.88 Favored 'General case' 0 N--CA 1.495 1.799 0 O-C-N 121.714 -0.616 . . . . 0.0 110.46 -176.044 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -153.12 156.09 37.99 Favored 'General case' 0 N--CA 1.496 1.836 0 O-C-N 121.625 -0.672 . . . . 0.0 110.267 178.941 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . 0.5 ' O ' HD13 ' A' ' 39' ' ' LEU . 31.1 ptt180 -140.55 146.58 38.25 Favored 'General case' 0 N--CA 1.497 1.9 0 O-C-N 121.623 -0.673 . . . . 0.0 110.558 179.832 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -171.73 171.48 44.11 Favored Glycine 0 N--CA 1.495 2.589 0 N-CA-C 108.829 -1.709 . . . . 0.0 108.829 -175.132 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . 0.684 HG22 ' CG ' ' A' ' 10' ' ' ASN . 39.8 t -94.56 120.54 44.13 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.874 0 O-C-N 121.419 -1.048 . . . . 0.0 109.309 -175.904 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 25' ' ' ILE . . . . . 0.648 ' HA ' HD23 ' A' ' 37' ' ' LEU . 75.2 mt -64.31 141.98 17.47 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.102 0 O-C-N 121.545 -0.722 . . . . 0.0 110.402 -172.093 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . 0.645 HG21 ' HB2' ' A' ' 38' ' ' ARG . 5.7 p -121.26 -26.44 5.06 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.653 -0.654 . . . . 0.0 111.345 -179.949 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 27' ' ' ASN . . . . . 0.51 ' O ' HD12 ' A' ' 35' ' ' LEU . 2.1 t-20 -162.09 160.41 27.34 Favored 'General case' 0 N--CA 1.5 2.053 0 C-N-CA 118.877 -1.129 . . . . 0.0 111.872 -179.244 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 28' ' ' PHE . . . . . 0.534 ' HE1' HG21 ' A' ' 49' ' ' THR . 85.0 t80 -150.01 126.57 10.9 Favored 'General case' 0 N--CA 1.497 1.904 0 N-CA-C 109.116 -0.698 . . . . 0.0 109.116 169.436 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 26.7 t0 -99.77 130.4 45.97 Favored 'General case' 0 N--CA 1.491 1.599 0 N-CA-C 109.064 -0.717 . . . . 0.0 109.064 -177.019 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 22.8 t -68.85 -50.15 52.39 Favored 'General case' 0 N--CA 1.498 1.962 0 C-N-CA 120.037 -0.665 . . . . 0.0 110.597 -176.662 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 19.8 m -59.7 -42.55 93.26 Favored 'General case' 0 N--CA 1.502 2.146 0 O-C-N 121.614 -0.679 . . . . 0.0 110.915 -174.366 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 91.4 m-20 -103.97 -10.08 18.38 Favored 'General case' 0 N--CA 1.497 1.921 0 O-C-N 121.565 -0.709 . . . . 0.0 111.66 -178.136 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 3.0 m 50.09 67.21 0.95 Allowed 'General case' 0 N--CA 1.508 2.443 0 O-C-N 121.0 -1.062 . . . . 0.0 110.943 -174.345 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 34' ' ' ILE . . . . . 1.122 HD12 HG22 ' A' ' 48' ' ' VAL . 47.4 mm -124.72 126.95 72.36 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.072 0 O-C-N 121.541 -0.724 . . . . 0.0 109.469 -175.711 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.51 HD12 ' O ' ' A' ' 27' ' ' ASN . 11.7 tp -115.78 120.57 39.73 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.675 -0.641 . . . . 0.0 110.501 -169.851 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 99.1 mt-30 -91.06 134.66 34.33 Favored 'General case' 0 N--CA 1.491 1.607 0 N-CA-C 109.39 -0.596 . . . . 0.0 109.39 174.24 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 0.648 HD23 ' HA ' ' A' ' 25' ' ' ILE . 88.8 mt -117.87 123.8 46.75 Favored 'General case' 0 N--CA 1.497 1.915 0 O-C-N 121.772 -0.58 . . . . 0.0 109.896 173.527 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 38' ' ' ARG . . . . . 0.645 ' HB2' HG21 ' A' ' 26' ' ' THR . 73.3 ttt-85 -97.11 109.09 21.91 Favored 'General case' 0 N--CA 1.497 1.877 0 O-C-N 121.699 -0.626 . . . . 0.0 109.8 175.863 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.5 HD13 ' O ' ' A' ' 22' ' ' ARG . 17.6 tp -85.07 150.63 24.73 Favored 'General case' 0 N--CA 1.494 1.774 0 O-C-N 121.706 -0.621 . . . . 0.0 110.928 -173.91 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -62.3 -10.39 10.86 Favored 'General case' 0 N--CA 1.504 2.233 0 O-C-N 121.907 -0.495 . . . . 0.0 111.892 -173.059 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 39.7 t30 -85.16 29.14 0.67 Allowed 'General case' 0 N--CA 1.499 2.008 0 O-C-N 121.151 -0.968 . . . . 0.0 110.94 174.651 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 74.3 m-20 59.68 31.69 21.03 Favored 'General case' 0 N--CA 1.505 2.307 0 O-C-N 121.213 -0.929 . . . . 0.0 110.424 174.031 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 52.2 m -123.3 137.91 54.74 Favored 'General case' 0 N--CA 1.495 1.797 0 O-C-N 121.413 -0.805 . . . . 0.0 110.348 178.609 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 8.9 t -98.06 149.5 22.42 Favored 'General case' 0 N--CA 1.497 1.902 0 O-C-N 121.694 -0.629 . . . . 0.0 110.274 176.937 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 78.0 tttt -149.72 119.16 6.89 Favored 'General case' 0 N--CA 1.495 1.805 0 O-C-N 121.577 -0.702 . . . . 0.0 110.33 177.897 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 88.7 p -95.52 123.98 39.33 Favored 'General case' 0 N--CA 1.494 1.767 0 O-C-N 121.673 -0.642 . . . . 0.0 110.24 179.009 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 81.4 mt -129.35 135.3 62.05 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.838 0 O-C-N 121.621 -0.674 . . . . 0.0 109.311 179.555 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 48' ' ' VAL . . . . . 1.122 HG22 HD12 ' A' ' 34' ' ' ILE . 59.7 t -82.21 127.59 39.49 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.883 0 O-C-N 121.581 -0.699 . . . . 0.0 109.265 179.122 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 49' ' ' THR . . . . . 0.534 HG21 ' HE1' ' A' ' 28' ' ' PHE . 37.7 p -59.21 -24.95 63.57 Favored 'General case' 0 N--CA 1.504 2.25 0 O-C-N 121.611 -0.681 . . . . 0.0 112.06 -169.721 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 57.9 mttm -56.55 -22.91 36.5 Favored 'General case' 0 N--CA 1.503 2.213 0 O-C-N 121.466 -0.771 . . . . 0.0 110.991 -176.833 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 51.0 p30 -83.98 1.26 44.49 Favored 'General case' 0 N--CA 1.499 1.995 0 O-C-N 121.406 -0.809 . . . . 0.0 111.288 176.376 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 99.0 mt -75.63 126.66 36.63 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.066 0 O-C-N 121.171 -0.956 . . . . 0.0 110.042 178.883 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 37.6 ttpt -93.08 -29.27 15.88 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.851 -0.53 . . . . 0.0 109.893 170.562 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 5.1 m-20 -164.07 155.86 16.57 Favored 'General case' 0 N--CA 1.5 2.056 0 O-C-N 121.748 -0.595 . . . . 0.0 109.952 -178.251 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . 0.588 ' CD2' HG22 ' A' ' 13' ' ' VAL . 82.7 mt -132.89 149.69 52.23 Favored 'General case' 0 N--CA 1.496 1.849 0 O-C-N 121.645 -0.659 . . . . 0.0 110.62 -178.804 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 9.5 ptp85 -151.43 144.55 24.63 Favored 'General case' 0 N--CA 1.496 1.838 0 O-C-N 121.71 -0.619 . . . . 0.0 110.083 174.438 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 57' ' ' ILE . . . . . 0.482 ' HA ' HG12 ' A' ' 11' ' ' VAL . 66.6 mt -86.33 133.16 30.43 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.745 0 O-C-N 121.523 -0.736 . . . . 0.0 109.66 171.697 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . 0.566 HD11 ' HB2' ' A' ' 12' ' ' GLU . 61.8 mt -83.05 138.29 42.78 Favored Pre-proline 0 N--CA 1.497 1.884 0 O-C-N 121.626 -0.671 . . . . 0.0 109.981 -179.781 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 32.3 Cg_endo -68.54 -32.49 24.62 Favored 'Trans proline' 0 N--CA 1.489 1.23 0 O-C-N 123.511 1.269 . . . . 0.0 110.512 -178.995 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 18.3 tptm -84.29 134.75 34.51 Favored 'General case' 0 N--CA 1.497 1.891 0 O-C-N 121.644 -0.66 . . . . 0.0 110.237 -178.881 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 24.3 p30 -140.3 -175.69 4.35 Favored 'General case' 0 N--CA 1.496 1.858 0 O-C-N 121.708 -0.62 . . . . 0.0 110.323 179.728 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 29.9 tp10 -95.16 139.37 31.6 Favored 'General case' 0 N--CA 1.495 1.785 0 O-C-N 121.662 -0.649 . . . . 0.0 110.155 -179.931 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 7.5 tp -68.96 137.69 23.82 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.949 0 O-C-N 121.697 -0.627 . . . . 0.0 110.191 -179.732 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 64' ' ' MET . . . . . . . . . . . . . 2.0 ttt -161.73 90.25 1.46 Allowed Pre-proline 0 N--CA 1.496 1.835 0 O-C-N 121.773 -0.58 . . . . 0.0 110.069 -179.741 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 18.7 Cg_exo -62.67 140.22 79.66 Favored 'Trans proline' 0 N--CA 1.489 1.263 0 O-C-N 123.543 1.286 . . . . 0.0 110.608 179.645 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 32.1 ttmt -159.7 33.07 0.19 Allowed 'General case' 0 N--CA 1.494 1.769 0 O-C-N 121.661 -0.649 . . . . 0.0 110.25 179.847 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 18.0 t-20 -140.55 57.39 1.58 Allowed 'General case' 0 N--CA 1.494 1.773 0 O-C-N 121.647 -0.658 . . . . 0.0 110.039 179.979 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 85.53 -160.21 34.18 Favored Glycine 0 N--CA 1.494 2.525 0 N-CA-C 109.477 -1.449 . . . . 0.0 109.477 -179.6 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 40.0 p -117.88 157.66 26.26 Favored 'General case' 0 N--CA 1.496 1.847 0 O-C-N 121.66 -0.906 . . . . 0.0 110.14 -179.913 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 30.5 mtmm -92.21 -64.57 1.09 Allowed 'General case' 0 N--CA 1.496 1.86 0 O-C-N 121.667 -0.645 . . . . 0.0 110.207 -179.932 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 17.0 p -94.06 161.9 28.34 Favored Pre-proline 0 N--CA 1.494 1.737 0 O-C-N 121.649 -0.657 . . . . 0.0 110.233 -179.215 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 23.3 Cg_endo -65.88 164.67 26.24 Favored 'Trans proline' 0 N--CA 1.489 1.25 0 O-C-N 123.689 1.363 . . . . 0.0 110.397 179.677 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 84.4 p -96.95 25.96 4.98 Favored 'General case' 0 N--CA 1.497 1.876 0 O-C-N 121.684 -0.635 . . . . 0.0 110.848 -179.091 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 36.0 p -105.34 29.52 6.39 Favored 'General case' 0 N--CA 1.497 1.894 0 O-C-N 121.441 -0.787 . . . . 0.0 110.491 179.642 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 10.5 t-20 57.76 166.91 0.04 OUTLIER 'General case' 0 N--CA 1.506 2.342 0 O-C-N 121.57 -0.706 . . . . 0.0 111.022 -178.99 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 93.7 p -141.8 155.04 45.6 Favored 'General case' 0 N--CA 1.496 1.839 0 O-C-N 121.646 -0.659 . . . . 0.0 110.152 179.169 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 77' ' ' THR . . . . . 0.646 HG23 ' H ' ' A' ' 80' ' ' LYS . 6.3 t -138.99 151.27 46.72 Favored 'General case' 0 N--CA 1.498 1.956 0 O-C-N 121.637 -0.665 . . . . 0.0 110.366 179.666 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 23.5 ttpp -70.11 -42.55 72.51 Favored 'General case' 0 N--CA 1.499 1.98 0 O-C-N 121.694 -0.629 . . . . 0.0 110.22 179.161 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . 0.493 HD23 ' OG ' ' A' ' 81' ' ' SER . 22.4 tp -66.12 -34.83 78.95 Favored 'General case' 0 N--CA 1.501 2.077 0 O-C-N 121.683 -0.636 . . . . 0.0 110.256 -178.904 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 80' ' ' LYS . . . . . 0.646 ' H ' HG23 ' A' ' 77' ' ' THR . 54.7 mttp 54.19 41.01 32.2 Favored 'General case' 0 N--CA 1.507 2.389 0 O-C-N 121.696 -0.628 . . . . 0.0 110.947 178.662 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 81' ' ' SER . . . . . 0.493 ' OG ' HD23 ' A' ' 79' ' ' LEU . 97.7 p -112.26 130.58 55.89 Favored 'General case' 0 N--CA 1.496 1.83 0 O-C-N 121.601 -0.687 . . . . 0.0 110.117 178.524 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -165.05 -174.32 3.25 Favored 'General case' 0 N--CA 1.497 1.875 0 O-C-N 121.595 -0.691 . . . . 0.0 110.19 -179.942 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 77.6 mt-10 -96.95 152.87 18.29 Favored 'General case' 0 N--CA 1.495 1.777 0 O-C-N 121.636 -0.665 . . . . 0.0 109.97 178.503 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 23.7 m -96.99 134.15 40.73 Favored 'General case' 0 N--CA 1.495 1.782 0 O-C-N 121.685 -0.634 . . . . 0.0 110.35 -178.279 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 97.2 m-85 -123.76 153.07 41.45 Favored 'General case' 0 N--CA 1.495 1.803 0 O-C-N 121.716 -0.615 . . . . 0.0 110.079 178.461 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 22.9 t -74.14 112.87 10.71 Favored 'General case' 0 N--CA 1.498 1.951 0 O-C-N 121.718 -0.614 . . . . 0.0 110.097 -179.603 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 24.8 t -160.27 172.31 17.59 Favored 'General case' 0 N--CA 1.494 1.731 0 O-C-N 121.727 -0.608 . . . . 0.0 110.215 -179.601 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 94.1 mttt -87.45 143.47 27.21 Favored 'General case' 0 N--CA 1.497 1.896 0 O-C-N 121.649 -0.657 . . . . 0.0 110.043 179.299 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 91.6 m-20 -103.21 125.06 49.7 Favored 'General case' 0 N--CA 1.495 1.794 0 O-C-N 121.71 -0.619 . . . . 0.0 110.242 -179.468 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 18.9 tptm -95.44 -61.55 1.45 Allowed 'General case' 0 N--CA 1.495 1.787 0 O-C-N 121.734 -0.604 . . . . 0.0 110.144 179.696 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 91' ' ' TRP . . . . . . . . . . . . . 98.1 m95 -121.1 154.87 35.58 Favored 'General case' 0 N--CA 1.496 1.832 0 O-C-N 121.627 -0.671 . . . . 0.0 110.157 179.878 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 50.5 m -112.63 146.46 38.59 Favored 'General case' 0 N--CA 1.495 1.794 0 O-C-N 121.771 -0.581 . . . . 0.0 110.206 -179.889 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 93' ' ' MET . . . . . . . . . . . . . 4.1 mmt -65.62 -34.7 78.84 Favored 'General case' 0 N--CA 1.501 2.111 0 O-C-N 121.735 -0.603 . . . . 0.0 110.419 -179.519 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 20.3 t0 . . . . . 0 N--CA 1.495 1.804 0 CA-C-O 118.007 -0.996 . . . . 0.0 110.176 -179.908 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' B' B ' 240' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.284 0 N-CA-C 109.553 -1.419 . . . . 0.0 109.553 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' B' B ' 241' ' ' ALA . . . . . . . . . . . . . . . -144.01 156.31 44.35 Favored 'General case' 0 N--CA 1.495 1.776 0 O-C-N 121.713 -0.875 . . . . 0.0 110.256 -179.898 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 242' ' ' THR . . . . . . . . . . . . . 24.2 m -121.31 141.93 50.45 Favored 'General case' 0 N--CA 1.495 1.784 0 O-C-N 121.712 -0.617 . . . . 0.0 110.199 -179.843 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 243' ' ' THR . . . . . . . . . . . . . 40.1 p -123.36 159.92 27.87 Favored 'General case' 0 N--CA 1.496 1.853 0 O-C-N 121.762 -0.587 . . . . 0.0 110.138 -179.935 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 244' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER 52.57 -177.75 0.02 OUTLIER 'General case' 0 N--CA 1.508 2.435 0 O-C-N 121.688 -0.633 . . . . 0.0 111.153 -179.829 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 245' ' ' GLU . . . . . . . . . . . . . 74.5 mm-40 -126.92 157.13 40.23 Favored 'General case' 0 N--CA 1.496 1.83 0 O-C-N 121.554 -0.716 . . . . 0.0 110.157 179.421 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 246' ' ' LYS . . . . . . . . . . . . . 27.0 mtpp -94.14 76.26 4.04 Favored 'General case' 0 N--CA 1.495 1.825 0 O-C-N 121.658 -0.651 . . . . 0.0 110.151 179.632 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 247' ' ' ASN . . . . . . . . . . . . . 89.8 m-20 52.8 35.7 19.44 Favored 'General case' 0 N--CA 1.506 2.35 0 O-C-N 121.522 -0.736 . . . . 0.0 111.006 179.536 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 248' ' ' ILE . . . . . . . . . . . . . 50.2 mm 52.25 90.34 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.507 2.402 0 O-C-N 121.572 -0.705 . . . . 0.0 110.652 -179.888 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 249' ' ' SER . . . . . . . . . . . . . 86.0 p -102.93 29.19 5.59 Favored 'General case' 0 N--CA 1.495 1.804 0 O-C-N 121.689 -0.632 . . . . 0.0 110.556 179.92 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 250' ' ' VAL . . . . . . . . . . . . . 12.5 p -152.79 147.19 14.75 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.867 0 O-C-N 121.53 -0.731 . . . . 0.0 110.151 -179.033 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 251' ' ' ASP . . . . . . . . . . . . . 75.9 m-20 53.07 47.5 24.42 Favored 'General case' 0 N--CA 1.506 2.371 0 O-C-N 121.592 -0.693 . . . . 0.0 110.743 179.82 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 252' ' ' VAL . . . . . 0.5 HG12 ' OD1' ' B' ' 253' ' ' ASP . 59.5 t -81.59 138.72 19.09 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.95 0 O-C-N 121.571 -0.705 . . . . 0.0 110.135 -177.277 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 253' ' ' ASP . . . . . 0.5 ' OD1' HG12 ' B' ' 252' ' ' VAL . 1.1 m-20 54.93 177.1 0.03 OUTLIER 'General case' 0 N--CA 1.506 2.359 0 CA-C-O 121.337 0.589 . . . . 0.0 111.506 176.951 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 254' ' ' ALA . . . . . . . . . . . . . . . -72.18 -8.44 54.78 Favored 'General case' 0 N--CA 1.501 2.076 0 O-C-N 121.744 -0.597 . . . . 0.0 111.753 -179.311 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 255' ' ' ASP . . . . . . . . . . . . . 19.5 t0 -68.0 -28.14 67.17 Favored 'General case' 0 N--CA 1.502 2.13 0 O-C-N 121.178 -0.951 . . . . 0.0 110.425 -176.222 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 256' ' ' ALA . . . . . . . . . . . . . . . -63.61 -36.18 82.95 Favored 'General case' 0 N--CA 1.501 2.097 0 O-C-N 121.465 -0.772 . . . . 0.0 110.326 177.906 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 257' ' ' SER . . . . . . . . . . . . . 74.2 m -55.1 -35.01 64.16 Favored 'General case' 0 N--CA 1.503 2.208 0 O-C-N 121.648 -0.657 . . . . 0.0 110.499 178.436 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 258' ' ' SER . . . . . . . . . . . . . 24.9 m -68.16 -33.25 74.11 Favored 'General case' 0 N--CA 1.498 1.949 0 O-C-N 121.914 -0.491 . . . . 0.0 110.248 -179.468 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 259' ' ' GLN . . . . . . . . . . . . . 94.0 mm-40 -63.24 -36.79 84.83 Favored 'General case' 0 N--CA 1.501 2.109 0 O-C-N 121.648 -0.658 . . . . 0.0 110.463 -179.138 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 260' ' ' LEU . . . . . 0.496 ' HA ' HD12 ' B' ' 263' ' ' LEU . 81.9 mt -67.28 -42.43 83.84 Favored 'General case' 0 N--CA 1.499 2.025 0 O-C-N 121.646 -0.659 . . . . 0.0 110.191 178.989 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 261' ' ' LEU . . . . . . . . . . . . . 24.0 tp -69.79 -36.18 75.48 Favored 'General case' 0 N--CA 1.497 1.893 0 O-C-N 121.615 -0.678 . . . . 0.0 109.736 176.407 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 262' ' ' SER . . . . . . . . . . . . . 69.4 m -62.3 -36.34 81.84 Favored 'General case' 0 N--CA 1.5 2.066 0 O-C-N 121.761 -0.587 . . . . 0.0 110.465 177.41 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 263' ' ' LEU . . . . . 0.496 HD12 ' HA ' ' B' ' 260' ' ' LEU . 20.7 mt -65.31 -45.61 83.65 Favored 'General case' 0 N--CA 1.501 2.076 0 O-C-N 121.679 -0.638 . . . . 0.0 110.116 179.779 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 264' ' ' LEU . . . . . 0.418 HD12 ' CD1' ' A' ' 55' ' ' LEU . 85.3 mt -63.11 -33.67 75.96 Favored 'General case' 0 N--CA 1.502 2.16 0 O-C-N 121.749 -0.594 . . . . 0.0 110.493 177.531 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 265' ' ' LYS . . . . . . . . . . . . . 23.2 ttpt -74.8 -32.49 62.01 Favored 'General case' 0 N--CA 1.498 1.954 0 O-C-N 121.757 -0.589 . . . . 0.0 110.259 -178.633 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 266' ' ' SER . . . . . . . . . . . . . 32.3 t -162.47 133.33 4.92 Favored 'General case' 0 N--CA 1.495 1.81 0 O-C-N 121.556 -0.715 . . . . 0.0 110.136 179.831 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 267' ' ' SER . . . . . . . . . . . . . 23.3 t -152.82 174.41 14.1 Favored 'General case' 0 N--CA 1.495 1.797 0 O-C-N 121.74 -0.6 . . . . 0.0 110.032 179.899 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 268' ' ' THR . . . . . . . . . . . . . 23.8 m -70.1 126.82 30.8 Favored 'General case' 0 N--CA 1.498 1.948 0 O-C-N 121.7 -0.625 . . . . 0.0 110.012 179.963 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 269' ' ' ALA . . . . . . . . . . . . . . . -72.5 161.69 77.82 Favored Pre-proline 0 N--CA 1.499 1.987 0 O-C-N 121.683 -0.636 . . . . 0.0 110.272 -179.361 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 270' ' ' PRO . . . . . . . . . . . . . 23.3 Cg_endo -65.79 150.74 85.76 Favored 'Trans proline' 0 N--CA 1.488 1.202 0 O-C-N 123.744 1.391 . . . . 0.0 110.327 178.541 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 271' ' ' SER . . . . . . . . . . . . . 31.2 t -109.41 138.61 45.5 Favored 'General case' 0 N--CA 1.494 1.77 0 O-C-N 121.64 -0.662 . . . . 0.0 110.443 -178.393 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 272' ' ' ASP . . . . . . . . . . . . . 20.2 t0 -134.11 -58.51 0.85 Allowed 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.717 -0.614 . . . . 0.0 109.987 178.46 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 273' ' ' LEU . . . . . . . . . . . . . 11.1 tp -162.45 30.51 0.11 Allowed 'General case' 0 N--CA 1.495 1.798 0 O-C-N 121.723 -0.611 . . . . 0.0 110.315 177.597 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 274' ' ' ALA . . . . . . . . . . . . . . . -76.1 -37.62 57.92 Favored 'General case' 0 N--CA 1.499 1.989 0 O-C-N 121.534 -0.729 . . . . 0.0 110.224 -179.963 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 275' ' ' THR . . . . . . . . . . . . . 7.1 t -139.16 150.4 64.51 Favored Pre-proline 0 N--CA 1.497 1.885 0 O-C-N 121.695 -0.628 . . . . 0.0 110.212 -178.935 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 276' ' ' PRO . . . . . . . . . . . . . 23.8 Cg_endo -65.87 154.64 73.08 Favored 'Trans proline' 0 N--CA 1.489 1.231 0 O-C-N 123.479 1.252 . . . . 0.0 110.472 178.77 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 277' ' ' GLN . . . . . 0.411 ' N ' ' HD2' ' B' ' 278' ' ' PRO . 1.9 mp0 -64.06 -56.22 26.08 Favored Pre-proline 0 N--CA 1.5 2.043 0 O-C-N 121.701 -0.624 . . . . 0.0 110.79 -179.245 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 278' ' ' PRO . . . . . 0.411 ' HD2' ' N ' ' B' ' 277' ' ' GLN . 36.4 Cg_endo -70.93 119.35 6.25 Favored 'Trans proline' 0 N--CA 1.486 1.055 0 O-C-N 123.193 1.102 . . . . 0.0 110.33 -178.316 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 279' ' ' SER . . . . . . . . . . . . . 25.9 t -161.08 -70.13 0.06 Allowed 'General case' 0 N--CA 1.495 1.797 0 O-C-N 121.718 -0.614 . . . . 0.0 110.059 178.272 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 280' ' ' THR . . . . . . . . . . . . . 24.3 m -76.21 -40.23 52.75 Favored 'General case' 0 N--CA 1.498 1.949 0 O-C-N 121.627 -0.671 . . . . 0.0 109.977 178.048 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 281' ' ' PHE . . . . . . . . . . . . . 21.8 m-85 -152.46 93.44 3.32 Favored Pre-proline 0 N--CA 1.494 1.74 0 O-C-N 121.734 -0.604 . . . . 0.0 110.127 179.986 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 282' ' ' PRO . . . . . . . . . . . . . 24.0 Cg_exo -60.1 145.93 97.33 Favored 'Trans proline' 0 N--CA 1.491 1.346 0 O-C-N 123.439 1.231 . . . . 0.0 110.833 -178.7 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 283' ' ' GLN . . . . . . . . . . . . . 9.4 tt0 -119.31 99.38 50.38 Favored Pre-proline 0 N--CA 1.495 1.814 0 O-C-N 121.775 -0.578 . . . . 0.0 110.055 179.949 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 284' ' ' PRO . . . . . . . . . . . . . 20.3 Cg_endo -65.12 155.27 69.25 Favored 'Trans proline' 0 N--CA 1.489 1.245 0 O-C-N 123.338 1.178 . . . . 0.0 110.483 -178.378 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 285' ' ' PRO . . . . . . . . . . . . . 21.2 Cg_exo -61.54 152.87 70.5 Favored 'Trans proline' 0 N--CA 1.491 1.378 0 O-C-N 123.592 1.312 . . . . 0.0 110.745 -179.012 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 286' ' ' VAL . . . . . . . . . . . . . 26.9 m -128.39 157.46 40.81 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.022 0 O-C-N 121.807 -0.558 . . . . 0.0 110.018 178.663 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 287' ' ' GLU . . . . . . . . . . . . . 14.6 pt-20 -144.41 38.82 1.27 Allowed 'General case' 0 N--CA 1.497 1.879 0 O-C-N 121.677 -0.639 . . . . 0.0 110.464 -179.545 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 288' ' ' SER . . . . . . . . . . . . . 16.2 m -65.19 -35.22 80.4 Favored 'General case' 0 N--CA 1.5 2.039 0 O-C-N 121.677 -0.639 . . . . 0.0 110.338 179.527 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 289' ' ' HIS . . . . . . . . . . . . . 99.1 m-70 -133.33 161.57 34.14 Favored 'General case' 0 N--CA 1.495 1.794 0 O-C-N 121.668 -0.645 . . . . 0.0 110.174 179.838 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 290' ' ' SER . . . . . . . . . . . . . 96.9 p -120.47 154.41 35.27 Favored 'General case' 0 N--CA 1.496 1.846 0 O-C-N 121.628 -0.67 . . . . 0.0 110.173 179.881 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 291' ' ' SER . . . . . . . . . . . . . 71.9 p . . . . . 0 N--CA 1.495 1.799 0 CA-C-O 118.02 -0.991 . . . . 0.0 110.188 -179.955 . . . . . . . . 0 0 . 1 . 021 nuclear nobuild full ' A' A ' -1' ' ' MET . . . . . . . . . . . . . 60.9 mtt . . . . . 0 N--CA 1.493 1.72 0 CA-C-O 121.002 0.43 . . . . 0.0 110.157 . . . . . . . . . 0 0 . 1 . 021 nuclear nobuild full ' A' A ' 0' ' ' GLY . . . . . . . . . . . . . . . -144.62 109.67 0.53 Allowed Glycine 0 N--CA 1.494 2.533 0 N-CA-C 109.518 -1.433 . . . . 0.0 109.518 179.779 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 39.6 ttm -109.84 135.95 49.93 Favored 'General case' 0 N--CA 1.495 1.801 0 O-C-N 121.707 -0.878 . . . . 0.0 110.117 179.584 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 69.1 m -100.22 178.23 4.83 Favored 'General case' 0 N--CA 1.495 1.825 0 O-C-N 121.725 -0.61 . . . . 0.0 110.545 -176.528 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 52.2 t -66.13 -27.84 41.97 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.153 0 O-C-N 121.667 -0.645 . . . . 0.0 110.344 -179.059 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -55.43 -31.81 62.19 Favored 'General case' 0 N--CA 1.505 2.29 0 O-C-N 121.538 -0.726 . . . . 0.0 110.371 -178.057 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 73.7 m-20 -68.84 -35.16 76.62 Favored 'General case' 0 N--CA 1.498 1.951 0 O-C-N 121.747 -0.596 . . . . 0.0 109.912 175.24 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 6' ' ' PHE . . . . . 0.468 ' CE2' HD11 ' B' ' 260' ' ' LEU . 97.8 m-85 -97.93 10.02 41.31 Favored 'General case' 0 N--CA 1.497 1.9 0 O-C-N 121.751 -0.593 . . . . 0.0 111.284 178.826 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -67.41 129.53 40.19 Favored 'General case' 0 N--CA 1.501 2.114 0 O-C-N 121.208 -0.932 . . . . 0.0 109.975 178.694 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 8' ' ' GLY . . . . . 0.459 ' O ' HG13 ' A' ' 24' ' ' VAL . . . 82.08 0.93 90.14 Favored Glycine 0 N--CA 1.497 2.734 0 N-CA-C 110.647 -0.981 . . . . 0.0 110.647 -175.397 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 57.6 m -76.08 135.24 39.89 Favored 'General case' 0 N--CA 1.498 1.944 0 O-C-N 121.09 -1.241 . . . . 0.0 110.445 178.24 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 10' ' ' ASN . . . . . 0.405 ' CG ' HG22 ' A' ' 24' ' ' VAL . 0.1 OUTLIER -84.31 114.25 21.72 Favored 'General case' 0 N--CA 1.498 1.958 0 O-C-N 121.67 -0.644 . . . . 0.0 109.695 174.375 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . 0.553 HG12 ' HA ' ' A' ' 57' ' ' ILE . 35.8 m -140.23 164.04 22.93 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.835 0 O-C-N 121.772 -0.58 . . . . 0.0 109.463 179.992 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . 0.49 ' HB2' HD11 ' A' ' 58' ' ' LEU . 44.1 tt0 -109.36 129.6 55.53 Favored 'General case' 0 N--CA 1.492 1.654 0 C-N-CA 119.782 -0.767 . . . . 0.0 110.02 179.129 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . 0.598 HG22 ' CD2' ' A' ' 55' ' ' LEU . 60.3 t -106.69 127.36 62.24 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.726 0 O-C-N 121.546 -0.721 . . . . 0.0 110.015 -179.042 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.445 HD13 ' HG2' ' A' ' 20' ' ' LYS . 27.1 tp -95.87 125.45 40.44 Favored 'General case' 0 N--CA 1.494 1.769 0 N-CA-C 109.031 -0.729 . . . . 0.0 109.031 173.42 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 87.0 mt -95.51 168.29 10.79 Favored 'General case' 0 N--CA 1.496 1.847 0 O-C-N 121.581 -0.7 . . . . 0.0 111.113 -172.73 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 24.4 p30 -58.02 -21.68 46.21 Favored 'General case' 0 N--CA 1.506 2.339 0 O-C-N 121.856 -0.528 . . . . 0.0 111.632 -176.94 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 46.0 p-10 -91.6 22.51 4.02 Favored 'General case' 0 N--CA 1.499 1.996 0 O-C-N 121.517 -0.739 . . . . 0.0 110.919 -176.641 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 74.4 m-20 58.55 27.37 15.56 Favored 'General case' 0 N--CA 1.506 2.35 0 O-C-N 121.469 -0.769 . . . . 0.0 110.712 175.738 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 49.9 m -108.18 144.39 35.68 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.579 -0.701 . . . . 0.0 109.578 172.887 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . 0.445 ' HG2' HD13 ' A' ' 14' ' ' LEU . 48.2 mttm -109.57 145.47 36.32 Favored 'General case' 0 N--CA 1.495 1.806 0 O-C-N 121.61 -0.681 . . . . 0.0 110.615 -176.512 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -153.07 154.11 34.2 Favored 'General case' 0 N--CA 1.496 1.865 0 O-C-N 121.784 -0.573 . . . . 0.0 109.868 176.272 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . 0.407 ' O ' HD22 ' A' ' 39' ' ' LEU . 30.4 ptt180 -140.4 151.5 44.99 Favored 'General case' 0 N--CA 1.496 1.841 0 O-C-N 121.635 -0.666 . . . . 0.0 110.529 -179.513 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . 0.426 ' HA2' HD13 ' A' ' 39' ' ' LEU . . . -171.85 171.09 43.93 Favored Glycine 0 N--CA 1.492 2.419 0 N-CA-C 109.037 -1.625 . . . . 0.0 109.037 -179.846 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . 0.459 HG13 ' O ' ' A' ' 8' ' ' GLY . 61.3 t -94.63 127.24 46.77 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.845 0 O-C-N 121.651 -0.911 . . . . 0.0 109.163 176.34 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 25' ' ' ILE . . . . . 0.515 ' HA ' HD23 ' A' ' 37' ' ' LEU . 49.3 mt -61.37 138.4 22.12 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.185 0 O-C-N 121.594 -0.691 . . . . 0.0 110.874 -171.099 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . 0.674 HG21 ' HB2' ' A' ' 38' ' ' ARG . 11.4 p -121.25 -20.59 6.66 Favored 'General case' 0 N--CA 1.493 1.717 0 O-C-N 121.876 -0.515 . . . . 0.0 111.49 -179.548 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 6.7 t30 -165.48 158.57 15.99 Favored 'General case' 0 N--CA 1.505 2.311 0 O-C-N 120.945 -1.097 . . . . 0.0 111.871 177.093 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 65.1 t80 -150.41 119.95 6.95 Favored 'General case' 0 N--CA 1.497 1.901 0 N-CA-C 109.226 -0.657 . . . . 0.0 109.226 173.766 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 17.9 t70 -97.14 127.2 42.88 Favored 'General case' 0 N--CA 1.494 1.757 0 O-C-N 121.641 -0.662 . . . . 0.0 109.293 -177.113 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 22.7 t -65.85 -46.34 78.82 Favored 'General case' 0 N--CA 1.5 2.042 0 O-C-N 121.557 -0.715 . . . . 0.0 110.865 -175.11 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 21.4 t -58.61 -48.06 82.25 Favored 'General case' 0 N--CA 1.502 2.13 0 O-C-N 121.505 -0.747 . . . . 0.0 111.0 -173.575 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 92.4 m-20 -107.02 -1.87 21.69 Favored 'General case' 0 N--CA 1.498 1.927 0 O-C-N 121.594 -0.691 . . . . 0.0 111.804 -178.316 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 69.1 m 49.18 67.18 0.92 Allowed 'General case' 0 N--CA 1.508 2.438 0 O-C-N 121.082 -1.011 . . . . 0.0 110.901 -174.437 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 34' ' ' ILE . . . . . 1.102 HD12 HG22 ' A' ' 48' ' ' VAL . 44.2 mm -113.82 125.79 71.18 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.971 0 O-C-N 121.544 -0.723 . . . . 0.0 109.136 -175.215 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 10.9 tp -116.0 119.03 34.56 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.613 -0.679 . . . . 0.0 110.451 -169.816 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 78.2 mt-30 -90.98 132.39 36.0 Favored 'General case' 0 N--CA 1.489 1.523 0 N-CA-C 109.191 -0.67 . . . . 0.0 109.191 170.862 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 0.515 HD23 ' HA ' ' A' ' 25' ' ' ILE . 48.8 mt -117.81 123.47 46.03 Favored 'General case' 0 N--CA 1.493 1.71 0 C-N-CA 120.152 -0.619 . . . . 0.0 109.949 175.218 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 38' ' ' ARG . . . . . 0.674 ' HB2' HG21 ' A' ' 26' ' ' THR . 56.5 ttt85 -105.1 105.85 16.08 Favored 'General case' 0 N--CA 1.495 1.786 0 O-C-N 121.78 -0.575 . . . . 0.0 110.091 174.101 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.426 HD13 ' HA2' ' A' ' 23' ' ' GLY . 63.3 tp -83.37 155.04 23.72 Favored 'General case' 0 N--CA 1.498 1.949 0 O-C-N 121.609 -0.682 . . . . 0.0 110.515 -177.054 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -68.82 -2.91 10.61 Favored 'General case' 0 N--CA 1.504 2.243 0 O-C-N 121.885 -0.51 . . . . 0.0 112.131 -170.347 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 30.1 m120 -88.04 28.59 1.03 Allowed 'General case' 0 N--CA 1.497 1.907 0 O-C-N 121.029 -1.045 . . . . 0.0 110.795 174.878 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 13.5 t0 64.9 29.03 12.6 Favored 'General case' 0 N--CA 1.505 2.295 0 O-C-N 121.205 -0.934 . . . . 0.0 110.387 175.755 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 74.5 m -125.01 137.95 54.23 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.432 -0.792 . . . . 0.0 110.137 177.897 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 9.1 t -128.22 149.72 50.34 Favored 'General case' 0 N--CA 1.496 1.843 0 O-C-N 121.711 -0.618 . . . . 0.0 110.018 178.818 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . 0.422 ' HD3' HD11 ' A' ' 47' ' ' ILE . 57.7 tttm -151.15 134.9 16.44 Favored 'General case' 0 N--CA 1.497 1.879 0 O-C-N 121.704 -0.623 . . . . 0.0 110.574 -178.339 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 91.0 p -95.0 120.99 36.15 Favored 'General case' 0 N--CA 1.495 1.796 0 O-C-N 121.727 -0.608 . . . . 0.0 110.215 177.556 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 47' ' ' ILE . . . . . 0.422 HD11 ' HD3' ' A' ' 45' ' ' LYS . 80.9 mt -129.35 136.05 60.31 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.85 0 O-C-N 121.681 -0.637 . . . . 0.0 109.359 -179.597 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 48' ' ' VAL . . . . . 1.102 HG22 HD12 ' A' ' 34' ' ' ILE . 66.4 t -81.71 127.79 39.28 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.001 0 O-C-N 121.631 -0.668 . . . . 0.0 109.202 179.204 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 49' ' ' THR . . . . . 0.626 ' HB ' HD22 ' B' ' 264' ' ' LEU . 51.6 p -57.99 -25.06 60.56 Favored 'General case' 0 N--CA 1.505 2.295 0 O-C-N 121.463 -0.773 . . . . 0.0 111.87 -168.97 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 43.4 tptt -57.19 -26.06 60.02 Favored 'General case' 0 N--CA 1.502 2.134 0 O-C-N 121.507 -0.745 . . . . 0.0 111.066 -176.805 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 5.0 p30 -84.69 5.72 27.08 Favored 'General case' 0 N--CA 1.498 1.95 0 C-N-CA 119.69 -0.804 . . . . 0.0 111.286 176.323 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 96.5 mt -75.77 124.41 33.76 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.144 0 O-C-N 121.146 -0.971 . . . . 0.0 109.837 175.461 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 42.5 tttp -92.36 -28.68 16.76 Favored 'General case' 0 N--CA 1.495 1.803 0 C-N-CA 120.396 -0.521 . . . . 0.0 109.953 171.962 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 5.4 m-20 -163.75 154.57 15.92 Favored 'General case' 0 N--CA 1.501 2.085 0 O-C-N 121.791 -0.568 . . . . 0.0 110.125 -178.461 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . 0.598 ' CD2' HG22 ' A' ' 13' ' ' VAL . 84.4 mt -132.96 150.75 52.14 Favored 'General case' 0 N--CA 1.497 1.887 0 O-C-N 121.669 -0.645 . . . . 0.0 110.487 -179.181 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 19.6 ptp180 -151.59 145.71 25.31 Favored 'General case' 0 N--CA 1.495 1.797 0 O-C-N 121.688 -0.632 . . . . 0.0 110.009 174.824 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 57' ' ' ILE . . . . . 0.553 ' HA ' HG12 ' A' ' 11' ' ' VAL . 64.8 mt -86.32 133.27 30.16 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.837 0 O-C-N 121.527 -0.733 . . . . 0.0 109.86 173.864 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . 0.49 HD11 ' HB2' ' A' ' 12' ' ' GLU . 61.1 mt -83.27 163.11 51.76 Favored Pre-proline 0 N--CA 1.497 1.893 0 O-C-N 121.594 -0.692 . . . . 0.0 110.145 -178.903 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 31.9 Cg_exo -57.75 -27.78 79.25 Favored 'Trans proline' 0 N--CA 1.493 1.448 0 O-C-N 123.639 1.336 . . . . 0.0 111.109 -178.057 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 60.8 tttt -80.11 114.18 18.83 Favored 'General case' 0 N--CA 1.498 1.958 0 O-C-N 121.603 -0.685 . . . . 0.0 109.974 178.473 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 45.5 p30 -161.75 -167.53 1.72 Allowed 'General case' 0 N--CA 1.498 1.948 0 O-C-N 121.679 -0.638 . . . . 0.0 110.277 -178.576 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 50.9 mt-10 -95.63 158.27 15.53 Favored 'General case' 0 N--CA 1.496 1.845 0 O-C-N 121.687 -0.633 . . . . 0.0 110.122 179.326 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 19.0 tt -63.7 -32.7 57.91 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.052 0 O-C-N 121.709 -0.619 . . . . 0.0 110.509 -178.983 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 64' ' ' MET . . . . . . . . . . . . . 8.2 ttp 51.49 91.0 0.07 OUTLIER Pre-proline 0 N--CA 1.504 2.265 0 O-C-N 121.671 -0.643 . . . . 0.0 111.135 179.807 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 23.8 Cg_endo -65.91 139.49 57.01 Favored 'Trans proline' 0 N--CA 1.489 1.245 0 O-C-N 123.529 1.279 . . . . 0.0 110.43 179.779 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 38.5 ttpt -93.37 -49.63 5.84 Favored 'General case' 0 N--CA 1.495 1.801 0 O-C-N 121.687 -0.633 . . . . 0.0 110.281 -179.172 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 29.9 m120 -101.99 139.12 38.04 Favored 'General case' 0 N--CA 1.495 1.801 0 O-C-N 121.703 -0.623 . . . . 0.0 110.326 -178.747 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . -153.34 110.67 0.46 Allowed Glycine 0 N--CA 1.493 2.489 0 N-CA-C 109.434 -1.466 . . . . 0.0 109.434 179.385 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 40.3 p -125.54 166.57 16.42 Favored 'General case' 0 N--CA 1.496 1.871 0 O-C-N 121.606 -0.938 . . . . 0.0 110.247 -179.262 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 53.3 mttm -91.39 151.34 20.87 Favored 'General case' 0 N--CA 1.497 1.894 0 O-C-N 121.677 -0.639 . . . . 0.0 110.136 179.827 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 66.8 m -79.59 157.28 74.9 Favored Pre-proline 0 N--CA 1.498 1.936 0 O-C-N 121.754 -0.591 . . . . 0.0 110.193 -179.596 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 21.8 Cg_endo -65.29 -30.42 54.21 Favored 'Trans proline' 0 N--CA 1.49 1.291 0 O-C-N 123.729 1.384 . . . . 0.0 110.668 -179.861 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 97.2 p -105.76 156.52 18.22 Favored 'General case' 0 N--CA 1.495 1.795 0 O-C-N 121.58 -0.7 . . . . 0.0 110.207 179.856 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 24.0 m -104.45 138.73 40.4 Favored 'General case' 0 N--CA 1.494 1.775 0 O-C-N 121.815 -0.553 . . . . 0.0 110.225 -179.631 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 39.2 p-10 -142.28 -174.26 4.07 Favored 'General case' 0 N--CA 1.495 1.797 0 O-C-N 121.681 -0.637 . . . . 0.0 110.437 -179.832 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 76' ' ' SER . . . . . 0.401 ' CB ' HD23 ' A' ' 79' ' ' LEU . 11.8 t -74.35 157.92 34.87 Favored 'General case' 0 N--CA 1.498 1.965 0 O-C-N 121.689 -0.632 . . . . 0.0 110.12 179.983 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 23.5 m -105.88 143.44 34.02 Favored 'General case' 0 N--CA 1.495 1.805 0 O-C-N 121.691 -0.631 . . . . 0.0 110.28 -178.71 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 74.6 tttt 54.35 35.56 23.26 Favored 'General case' 0 N--CA 1.505 2.293 0 O-C-N 121.586 -0.696 . . . . 0.0 110.923 179.59 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . 0.582 HD13 ' O ' ' A' ' 79' ' ' LEU . 0.3 OUTLIER -68.05 -34.68 76.91 Favored 'General case' 0 N--CA 1.499 1.997 0 O-C-N 121.632 -0.667 . . . . 0.0 110.014 178.476 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 62.5 mttm -63.92 -32.95 74.66 Favored 'General case' 0 N--CA 1.502 2.137 0 O-C-N 121.726 -0.609 . . . . 0.0 110.429 179.742 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 30.6 t 56.7 -82.48 0.01 OUTLIER 'General case' 0 N--CA 1.507 2.412 0 O-C-N 122.046 -0.409 . . . . 0.0 111.367 -179.317 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -136.2 160.23 39.3 Favored 'General case' 0 N--CA 1.495 1.805 0 O-C-N 121.245 -0.909 . . . . 0.0 110.257 -178.233 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 44.7 tt0 -95.19 147.73 23.14 Favored 'General case' 0 N--CA 1.495 1.794 0 O-C-N 121.725 -0.61 . . . . 0.0 110.048 -179.906 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 84' ' ' THR . . . . . 0.475 ' HG1' ' HD1' ' A' ' 85' ' ' TYR . 27.5 p -66.19 -37.94 86.82 Favored 'General case' 0 N--CA 1.501 2.081 0 O-C-N 121.68 -0.638 . . . . 0.0 110.454 -177.972 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 85' ' ' TYR . . . . . 0.475 ' HD1' ' HG1' ' A' ' 84' ' ' THR . 96.4 m-85 -113.98 115.06 27.04 Favored 'General case' 0 N--CA 1.496 1.862 0 O-C-N 121.493 -0.754 . . . . 0.0 110.172 177.394 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 86.7 p -160.88 169.35 22.81 Favored 'General case' 0 N--CA 1.494 1.757 0 O-C-N 121.636 -0.665 . . . . 0.0 110.141 179.531 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 30.8 t -112.28 123.29 49.95 Favored 'General case' 0 N--CA 1.495 1.788 0 O-C-N 121.704 -0.623 . . . . 0.0 110.099 178.775 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 55.5 mtpt -67.77 -41.98 82.41 Favored 'General case' 0 N--CA 1.499 2.023 0 O-C-N 121.768 -0.583 . . . . 0.0 110.281 -179.431 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 91.8 m-20 -136.33 127.82 28.63 Favored 'General case' 0 N--CA 1.495 1.79 0 O-C-N 121.78 -0.575 . . . . 0.0 110.226 -179.976 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 71.6 mttt -65.35 -32.98 74.9 Favored 'General case' 0 N--CA 1.501 2.09 0 O-C-N 121.664 -0.648 . . . . 0.0 110.394 178.848 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 91' ' ' TRP . . . . . . . . . . . . . 48.7 p90 -115.34 155.76 26.75 Favored 'General case' 0 N--CA 1.496 1.852 0 O-C-N 121.718 -0.614 . . . . 0.0 110.275 179.683 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 25.6 t -109.48 141.22 42.22 Favored 'General case' 0 N--CA 1.495 1.784 0 O-C-N 121.72 -0.612 . . . . 0.0 110.28 -179.853 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 93' ' ' MET . . . . . . . . . . . . . 56.5 ttp -99.12 130.95 45.47 Favored 'General case' 0 N--CA 1.495 1.779 0 O-C-N 121.713 -0.617 . . . . 0.0 110.175 -179.824 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 19.7 t70 . . . . . 0 N--CA 1.495 1.807 0 CA-C-O 117.996 -1.002 . . . . 0.0 110.294 -179.736 . . . . . . . . 0 0 . 1 . 021 nuclear nobuild full ' B' B ' 240' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.319 0 N-CA-C 109.537 -1.425 . . . . 0.0 109.537 . . . . . . . . . 0 0 . 1 . 021 nuclear nobuild full ' B' B ' 241' ' ' ALA . . . . . . . . . . . . . . . -67.55 -36.97 81.99 Favored 'General case' 0 N--CA 1.499 1.985 0 O-C-N 121.612 -0.934 . . . . 0.0 110.291 -179.904 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 242' ' ' THR . . . . . 0.479 HG22 ' O ' ' B' ' 244' ' ' LYS . 24.2 m -126.36 133.56 51.3 Favored 'General case' 0 N--CA 1.495 1.823 0 O-C-N 121.7 -0.625 . . . . 0.0 110.186 179.522 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' B' B ' 243' ' ' THR . . . . . . . . . . . . . 41.8 p -83.11 -33.08 26.4 Favored 'General case' 0 N--CA 1.498 1.942 0 O-C-N 121.719 -0.613 . . . . 0.0 110.321 179.923 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 244' ' ' LYS . . . . . 0.479 ' O ' HG22 ' B' ' 242' ' ' THR . 89.0 mttt -110.85 154.35 24.14 Favored 'General case' 0 N--CA 1.496 1.827 0 O-C-N 121.657 -0.652 . . . . 0.0 110.19 -179.542 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' B' B ' 245' ' ' GLU . . . . . . . . . . . . . 54.7 mt-10 -96.12 142.72 27.97 Favored 'General case' 0 N--CA 1.495 1.789 0 O-C-N 121.671 -0.643 . . . . 0.0 110.139 179.463 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 246' ' ' LYS . . . . . . . . . . . . . 81.3 mttt -65.28 -33.66 76.51 Favored 'General case' 0 N--CA 1.5 2.044 0 O-C-N 121.676 -0.64 . . . . 0.0 110.444 -179.458 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 247' ' ' ASN . . . . . . . . . . . . . 15.1 t-20 53.44 72.68 0.42 Allowed 'General case' 0 N--CA 1.505 2.32 0 O-C-N 121.497 -0.752 . . . . 0.0 110.92 179.704 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 248' ' ' ILE . . . . . . . . . . . . . 80.1 mt 53.95 77.94 0.07 OUTLIER 'Isoleucine or valine' 0 N--CA 1.507 2.402 0 O-C-N 121.456 -0.777 . . . . 0.0 110.416 -179.922 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 249' ' ' SER . . . . . . . . . . . . . 3.1 m -93.29 -27.34 16.86 Favored 'General case' 0 N--CA 1.496 1.868 0 O-C-N 121.639 -0.663 . . . . 0.0 110.672 179.149 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 250' ' ' VAL . . . . . . . . . . . . . 13.5 p -87.07 149.05 4.22 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.884 0 O-C-N 121.566 -0.709 . . . . 0.0 110.368 -178.438 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 251' ' ' ASP . . . . . . . . . . . . . 3.7 m-20 52.32 38.09 24.02 Favored 'General case' 0 N--CA 1.507 2.379 0 O-C-N 121.672 -0.643 . . . . 0.0 111.076 -178.817 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 252' ' ' VAL . . . . . 0.502 HG13 ' N ' ' B' ' 253' ' ' ASP . 0.4 OUTLIER 52.04 -177.28 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.507 2.378 0 O-C-N 121.783 -0.573 . . . . 0.0 111.2 177.795 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' B' B ' 253' ' ' ASP . . . . . 0.502 ' N ' HG13 ' B' ' 252' ' ' VAL . 53.4 p-10 -81.64 171.17 14.94 Favored 'General case' 0 N--CA 1.499 1.977 0 O-C-N 121.538 -0.726 . . . . 0.0 110.556 -179.491 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' B' B ' 254' ' ' ALA . . . . . . . . . . . . . . . -69.06 -13.57 62.52 Favored 'General case' 0 N--CA 1.501 2.12 0 O-C-N 121.762 -0.586 . . . . 0.0 111.31 178.662 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 255' ' ' ASP . . . . . . . . . . . . . 9.7 m-20 -70.69 -25.95 63.2 Favored 'General case' 0 N--CA 1.501 2.101 0 O-C-N 121.307 -0.871 . . . . 0.0 110.702 -176.897 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 256' ' ' ALA . . . . . 0.433 ' CB ' HG11 ' B' ' 252' ' ' VAL . . . -62.45 -35.73 80.21 Favored 'General case' 0 N--CA 1.501 2.124 0 O-C-N 121.375 -0.828 . . . . 0.0 110.467 179.945 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' B' B ' 257' ' ' SER . . . . . . . . . . . . . 34.5 t -54.38 -34.96 62.27 Favored 'General case' 0 N--CA 1.503 2.204 0 O-C-N 121.592 -0.692 . . . . 0.0 110.396 176.682 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 258' ' ' SER . . . . . . . . . . . . . 25.3 m -67.99 -31.25 70.82 Favored 'General case' 0 N--CA 1.498 1.934 0 O-C-N 121.888 -0.507 . . . . 0.0 110.25 178.978 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 259' ' ' GLN . . . . . . . . . . . . . 48.7 tt0 -61.47 -37.59 84.17 Favored 'General case' 0 N--CA 1.502 2.134 0 O-C-N 121.635 -0.666 . . . . 0.0 110.381 178.964 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 260' ' ' LEU . . . . . 0.502 ' HA ' HD12 ' B' ' 263' ' ' LEU . 46.0 mt -65.93 -42.36 90.2 Favored 'General case' 0 N--CA 1.5 2.038 0 O-C-N 121.721 -0.612 . . . . 0.0 110.306 178.449 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' B' B ' 261' ' ' LEU . . . . . . . . . . . . . 18.9 tp -69.89 -36.55 75.53 Favored 'General case' 0 N--CA 1.498 1.961 0 O-C-N 121.717 -0.614 . . . . 0.0 109.75 176.83 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 262' ' ' SER . . . . . . . . . . . . . 49.1 m -62.16 -37.0 83.56 Favored 'General case' 0 N--CA 1.501 2.078 0 O-C-N 121.714 -0.616 . . . . 0.0 110.556 176.614 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 263' ' ' LEU . . . . . 0.502 HD12 ' HA ' ' B' ' 260' ' ' LEU . 18.9 mt -64.7 -42.78 95.05 Favored 'General case' 0 N--CA 1.502 2.133 0 O-C-N 121.698 -0.626 . . . . 0.0 110.186 179.64 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' B' B ' 264' ' ' LEU . . . . . 0.626 HD22 ' HB ' ' A' ' 49' ' ' THR . 85.0 mt -62.21 -34.08 75.78 Favored 'General case' 0 N--CA 1.502 2.154 0 O-C-N 121.724 -0.61 . . . . 0.0 110.566 178.513 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' B' B ' 265' ' ' LYS . . . . . . . . . . . . . 29.2 mtpt -74.98 -34.12 61.95 Favored 'General case' 0 N--CA 1.499 1.994 0 O-C-N 121.718 -0.614 . . . . 0.0 109.976 179.915 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 266' ' ' SER . . . . . . . . . . . . . 64.8 m 51.38 -173.34 0.02 OUTLIER 'General case' 0 N--CA 1.506 2.355 0 O-C-N 121.707 -0.621 . . . . 0.0 111.22 179.136 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 267' ' ' SER . . . . . . . . . . . . . 47.3 m -118.33 150.3 39.72 Favored 'General case' 0 N--CA 1.495 1.818 0 O-C-N 121.665 -0.647 . . . . 0.0 110.15 179.531 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 268' ' ' THR . . . . . . . . . . . . . 9.0 t -67.81 144.09 55.51 Favored 'General case' 0 N--CA 1.5 2.034 0 O-C-N 121.717 -0.614 . . . . 0.0 110.375 -179.404 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 269' ' ' ALA . . . . . 0.748 ' HB3' ' HD3' ' B' ' 270' ' ' PRO . . . -171.12 -60.17 0.0 OUTLIER Pre-proline 0 N--CA 1.499 1.978 0 O-C-N 121.636 -0.665 . . . . 0.0 110.383 -179.666 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' B' B ' 270' ' ' PRO . . . . . 0.748 ' HD3' ' HB3' ' B' ' 269' ' ' ALA . 30.7 Cg_endo -68.56 164.09 34.3 Favored 'Trans proline' 0 N--CA 1.488 1.188 0 O-C-N 123.152 1.08 . . . . 0.0 110.282 178.579 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' B' B ' 271' ' ' SER . . . . . . . . . . . . . 50.5 m -66.22 153.54 42.22 Favored 'General case' 0 N--CA 1.499 2.025 0 O-C-N 121.605 -0.684 . . . . 0.0 110.336 -179.381 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 272' ' ' ASP . . . . . . . . . . . . . 25.9 t0 -101.08 154.52 18.65 Favored 'General case' 0 N--CA 1.496 1.828 0 O-C-N 121.69 -0.631 . . . . 0.0 110.247 -179.064 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 273' ' ' LEU . . . . . . . . . . . . . 12.3 tp 52.78 33.01 13.2 Favored 'General case' 0 N--CA 1.506 2.334 0 O-C-N 121.637 -0.664 . . . . 0.0 110.93 179.883 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 274' ' ' ALA . . . . . . . . . . . . . . . -74.5 -40.82 61.58 Favored 'General case' 0 N--CA 1.497 1.921 0 O-C-N 121.635 -0.666 . . . . 0.0 110.07 179.308 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 275' ' ' THR . . . . . . . . . . . . . 20.0 m -135.86 87.58 24.67 Favored Pre-proline 0 N--CA 1.494 1.773 0 O-C-N 121.699 -0.626 . . . . 0.0 110.06 179.324 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 276' ' ' PRO . . . . . . . . . . . . . 30.6 Cg_endo -68.15 78.86 0.59 Allowed 'Trans proline' 0 N--CA 1.488 1.189 0 O-C-N 123.525 1.276 . . . . 0.0 110.392 -179.58 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 277' ' ' GLN . . . . . 0.421 ' N ' ' CD ' ' B' ' 278' ' ' PRO . 1.4 tt0 -85.94 -48.67 0.55 Allowed Pre-proline 0 N--CA 1.498 1.955 0 O-C-N 121.554 -0.716 . . . . 0.0 110.864 179.2 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' B' B ' 278' ' ' PRO . . . . . 0.421 ' CD ' ' N ' ' B' ' 277' ' ' GLN . 23.4 Cg_exo -60.64 154.44 54.61 Favored 'Trans proline' 0 N--CA 1.493 1.449 0 O-C-N 123.037 1.02 . . . . 0.0 110.759 -179.188 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' B' B ' 279' ' ' SER . . . . . . . . . . . . . 29.9 t -104.47 149.92 25.02 Favored 'General case' 0 N--CA 1.495 1.806 0 O-C-N 121.74 -0.6 . . . . 0.0 110.094 179.799 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 280' ' ' THR . . . . . . . . . . . . . 23.6 m -75.77 138.83 41.47 Favored 'General case' 0 N--CA 1.497 1.924 0 O-C-N 121.672 -0.643 . . . . 0.0 110.206 -179.063 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 281' ' ' PHE . . . . . . . . . . . . . 4.7 t80 52.9 68.23 3.2 Favored Pre-proline 0 N--CA 1.506 2.358 0 O-C-N 121.561 -0.712 . . . . 0.0 110.955 -179.858 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 282' ' ' PRO . . . . . . . . . . . . . 16.8 Cg_exo -63.7 -47.09 7.69 Favored 'Trans proline' 0 N--CA 1.49 1.304 0 O-C-N 123.48 1.253 . . . . 0.0 110.514 179.33 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 283' ' ' GLN . . . . . . . . . . . . . 42.2 mt-30 -150.63 155.17 35.95 Favored Pre-proline 0 N--CA 1.494 1.751 0 O-C-N 121.746 -0.596 . . . . 0.0 110.211 179.553 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 284' ' ' PRO . . . . . . . . . . . . . 36.3 Cg_endo -70.47 152.75 65.85 Favored 'Trans proline' 0 N--CA 1.486 1.052 0 O-C-N 123.644 1.339 . . . . 0.0 110.339 179.905 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 285' ' ' PRO . . . . . . . . . . . . . 33.4 Cg_endo -69.19 168.17 21.59 Favored 'Trans proline' 0 N--CA 1.488 1.189 0 O-C-N 123.626 1.329 . . . . 0.0 110.251 179.189 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 286' ' ' VAL . . . . . . . . . . . . . 27.2 m -124.06 140.05 48.63 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.991 0 O-C-N 121.673 -0.642 . . . . 0.0 110.258 179.261 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 287' ' ' GLU . . . . . . . . . . . . . 74.8 mm-40 -76.49 -34.93 58.63 Favored 'General case' 0 N--CA 1.498 1.925 0 O-C-N 121.698 -0.626 . . . . 0.0 110.401 -179.284 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 288' ' ' SER . . . . . . . . . . . . . 48.5 m -119.49 150.5 40.13 Favored 'General case' 0 N--CA 1.496 1.835 0 O-C-N 121.724 -0.61 . . . . 0.0 110.292 -178.157 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 289' ' ' HIS . . . . . . . . . . . . . 32.2 m170 -65.54 -33.57 76.24 Favored 'General case' 0 N--CA 1.5 2.042 0 O-C-N 121.68 -0.638 . . . . 0.0 110.372 179.704 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 290' ' ' SER . . . . . . . . . . . . . 21.2 m -64.63 -34.12 77.53 Favored 'General case' 0 N--CA 1.5 2.042 0 O-C-N 121.692 -0.63 . . . . 0.0 110.409 -179.791 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 291' ' ' SER . . . . . . . . . . . . . 8.8 m . . . . . 0 N--CA 1.505 2.318 0 CA-C-O 117.951 -1.024 . . . . 0.0 111.022 -179.976 . . . . . . . . 0 0 . 1 . 022 nuclear nobuild full ' A' A ' -1' ' ' MET . . . . . . . . . . . . . 48.1 ttm . . . . . 0 N--CA 1.491 1.589 0 CA-C-O 121.043 0.449 . . . . 0.0 110.203 . . . . . . . . . 0 0 . 1 . 022 nuclear nobuild full ' A' A ' 0' ' ' GLY . . . . . . . . . . . . . . . -83.51 -171.22 47.38 Favored Glycine 0 N--CA 1.493 2.478 0 N-CA-C 109.508 -1.437 . . . . 0.0 109.508 179.576 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 49.4 ttm -90.42 131.54 36.13 Favored 'General case' 0 N--CA 1.496 1.854 0 O-C-N 121.614 -0.933 . . . . 0.0 110.149 179.946 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 69.7 m -91.68 178.84 5.81 Favored 'General case' 0 N--CA 1.496 1.843 0 O-C-N 121.757 -0.59 . . . . 0.0 110.247 -178.547 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 3' ' ' VAL . . . . . 0.431 HG12 ' CE1' ' A' ' 7' ' ' TYR . 65.6 t -66.4 -27.73 41.31 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.065 0 O-C-N 121.727 -0.608 . . . . 0.0 110.337 -178.887 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -54.98 -30.63 59.62 Favored 'General case' 0 N--CA 1.505 2.303 0 O-C-N 121.487 -0.758 . . . . 0.0 110.439 -178.422 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 9.7 m-20 -68.89 -30.72 69.27 Favored 'General case' 0 N--CA 1.499 1.995 0 O-C-N 121.753 -0.592 . . . . 0.0 110.244 174.981 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 97.4 m-85 -95.56 10.06 37.96 Favored 'General case' 0 N--CA 1.497 1.909 0 O-C-N 121.636 -0.665 . . . . 0.0 111.502 -178.16 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 7' ' ' TYR . . . . . 0.431 ' CE1' HG12 ' A' ' 3' ' ' VAL . 3.9 m-30 -67.3 139.88 57.29 Favored 'General case' 0 N--CA 1.502 2.135 0 O-C-N 121.171 -0.955 . . . . 0.0 110.077 174.184 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 8' ' ' GLY . . . . . 0.424 ' O ' HG13 ' A' ' 24' ' ' VAL . . . 83.65 -3.14 86.13 Favored Glycine 0 N--CA 1.497 2.746 0 N-CA-C 110.768 -0.933 . . . . 0.0 110.768 -177.089 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 66.2 m -75.27 138.97 42.23 Favored 'General case' 0 N--CA 1.497 1.887 0 O-C-N 121.115 -1.227 . . . . 0.0 110.508 179.685 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 10' ' ' ASN . . . . . 0.669 ' CG ' HG22 ' A' ' 24' ' ' VAL . 2.4 m120 -84.58 118.8 24.57 Favored 'General case' 0 N--CA 1.498 1.971 0 O-C-N 121.651 -0.656 . . . . 0.0 109.454 174.407 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . 0.474 HG12 ' HA ' ' A' ' 57' ' ' ILE . 35.8 m -143.19 162.3 17.02 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.822 0 O-C-N 121.693 -0.629 . . . . 0.0 109.854 -179.116 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . 0.584 ' HB2' HD11 ' A' ' 58' ' ' LEU . 47.7 tt0 -109.47 127.22 54.26 Favored 'General case' 0 N--CA 1.493 1.692 0 O-C-N 121.56 -0.713 . . . . 0.0 110.047 176.331 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . 0.548 HG22 ' CD2' ' A' ' 55' ' ' LEU . 58.0 t -106.89 123.52 62.0 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.747 0 O-C-N 121.48 -0.763 . . . . 0.0 109.951 -178.324 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.637 HD12 ' O ' ' A' ' 19' ' ' SER . 17.6 tp -96.0 135.1 38.22 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.663 -0.648 . . . . 0.0 109.472 175.737 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 86.2 mt -103.67 169.0 8.78 Favored 'General case' 0 N--CA 1.497 1.908 0 O-C-N 121.61 -0.681 . . . . 0.0 111.22 -172.605 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 24.1 p30 -59.05 -21.73 59.59 Favored 'General case' 0 N--CA 1.507 2.391 0 O-C-N 121.843 -0.535 . . . . 0.0 111.677 -177.507 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 47.7 p-10 -93.45 24.53 3.9 Favored 'General case' 0 N--CA 1.498 1.96 0 O-C-N 121.497 -0.752 . . . . 0.0 110.797 -175.309 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 74.3 m-20 59.31 25.64 14.33 Favored 'General case' 0 N--CA 1.505 2.298 0 O-C-N 121.523 -0.736 . . . . 0.0 110.73 176.834 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . 0.637 ' O ' HD12 ' A' ' 14' ' ' LEU . 70.7 m -97.67 163.07 12.98 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.631 -0.668 . . . . 0.0 109.274 170.657 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 13.0 ptmt -145.4 138.02 25.98 Favored 'General case' 0 N--CA 1.495 1.818 0 O-C-N 121.59 -0.694 . . . . 0.0 110.46 -176.688 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -153.02 161.62 42.31 Favored 'General case' 0 N--CA 1.496 1.863 0 O-C-N 121.728 -0.607 . . . . 0.0 110.299 179.893 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . 0.486 ' O ' HD13 ' A' ' 39' ' ' LEU . 32.5 ptt180 -142.06 147.15 36.35 Favored 'General case' 0 N--CA 1.496 1.826 0 O-C-N 121.701 -0.624 . . . . 0.0 110.782 -179.751 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -171.73 171.42 44.08 Favored Glycine 0 N--CA 1.494 2.561 0 N-CA-C 108.76 -1.736 . . . . 0.0 108.76 -175.47 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . 0.669 HG22 ' CG ' ' A' ' 10' ' ' ASN . 39.9 t -94.59 120.89 44.65 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.901 0 O-C-N 121.424 -1.045 . . . . 0.0 109.35 -175.451 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 25' ' ' ILE . . . . . 0.662 ' HA ' HD23 ' A' ' 37' ' ' LEU . 92.6 mt -64.29 143.45 15.69 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.118 0 O-C-N 121.566 -0.709 . . . . 0.0 110.498 -171.899 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . 0.619 HG21 ' HB2' ' A' ' 38' ' ' ARG . 6.3 p -121.23 -28.16 4.75 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.785 -0.572 . . . . 0.0 111.256 179.334 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 27' ' ' ASN . . . . . 0.518 ' O ' HD12 ' A' ' 35' ' ' LEU . 27.5 t30 -161.66 160.77 29.07 Favored 'General case' 0 N--CA 1.5 2.065 0 C-N-CA 118.919 -1.112 . . . . 0.0 111.899 -177.881 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 28' ' ' PHE . . . . . 0.56 ' HE1' HG21 ' A' ' 49' ' ' THR . 82.0 t80 -150.08 125.81 10.38 Favored 'General case' 0 N--CA 1.499 2.002 0 N-CA-C 109.052 -0.721 . . . . 0.0 109.052 169.724 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 17.8 t70 -99.68 128.56 45.78 Favored 'General case' 0 N--CA 1.492 1.664 0 N-CA-C 109.089 -0.708 . . . . 0.0 109.089 -177.484 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 21.8 m -66.43 -46.37 76.71 Favored 'General case' 0 N--CA 1.499 2.015 0 C-N-CA 120.053 -0.659 . . . . 0.0 110.673 -175.736 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 16.3 t -58.22 -48.06 81.55 Favored 'General case' 0 N--CA 1.503 2.206 0 O-C-N 121.485 -0.76 . . . . 0.0 110.957 -173.971 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 90.4 m-20 -104.59 -5.38 21.51 Favored 'General case' 0 N--CA 1.497 1.895 0 O-C-N 121.614 -0.679 . . . . 0.0 111.643 -178.486 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 71.0 m 49.36 67.25 0.91 Allowed 'General case' 0 N--CA 1.507 2.418 0 O-C-N 121.132 -0.98 . . . . 0.0 110.937 -174.32 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 34' ' ' ILE . . . . . 1.034 HD12 HG22 ' A' ' 48' ' ' VAL . 45.5 mm -120.68 126.41 75.21 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.019 0 O-C-N 121.665 -0.647 . . . . 0.0 109.323 -174.959 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.518 HD12 ' O ' ' A' ' 27' ' ' ASN . 11.9 tp -115.76 120.38 39.13 Favored 'General case' 0 N--CA 1.494 1.762 0 O-C-N 121.68 -0.637 . . . . 0.0 110.504 -169.065 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 99.0 mt-30 -90.99 134.68 34.29 Favored 'General case' 0 N--CA 1.491 1.593 0 N-CA-C 109.468 -0.568 . . . . 0.0 109.468 174.485 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 0.662 HD23 ' HA ' ' A' ' 25' ' ' ILE . 90.2 mt -117.82 123.82 46.86 Favored 'General case' 0 N--CA 1.496 1.842 0 O-C-N 121.841 -0.537 . . . . 0.0 109.915 174.342 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 38' ' ' ARG . . . . . 0.619 ' HB2' HG21 ' A' ' 26' ' ' THR . 58.0 ttt85 -96.64 108.54 21.17 Favored 'General case' 0 N--CA 1.496 1.83 0 O-C-N 121.669 -0.645 . . . . 0.0 109.829 175.283 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.486 HD13 ' O ' ' A' ' 22' ' ' ARG . 17.9 tp -84.83 153.37 22.99 Favored 'General case' 0 N--CA 1.494 1.739 0 O-C-N 121.745 -0.597 . . . . 0.0 110.962 -174.155 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -63.57 -9.65 14.4 Favored 'General case' 0 N--CA 1.503 2.183 0 O-C-N 121.985 -0.447 . . . . 0.0 111.928 -171.781 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 30.0 m120 -86.14 27.47 0.91 Allowed 'General case' 0 N--CA 1.498 1.953 0 O-C-N 121.106 -0.996 . . . . 0.0 110.984 175.679 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 15.7 t0 62.89 29.23 16.57 Favored 'General case' 0 N--CA 1.504 2.235 0 O-C-N 120.975 -1.078 . . . . 0.0 110.595 175.481 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 63.8 m -123.14 137.81 54.81 Favored 'General case' 0 N--CA 1.496 1.872 0 O-C-N 121.344 -0.847 . . . . 0.0 110.402 -179.522 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 10.2 t -97.62 151.02 20.51 Favored 'General case' 0 N--CA 1.495 1.82 0 O-C-N 121.735 -0.603 . . . . 0.0 110.281 176.756 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 57.9 tttt -149.24 119.15 7.11 Favored 'General case' 0 N--CA 1.496 1.854 0 O-C-N 121.691 -0.631 . . . . 0.0 110.202 177.812 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 88.1 p -95.21 123.95 38.99 Favored 'General case' 0 N--CA 1.495 1.798 0 O-C-N 121.64 -0.662 . . . . 0.0 110.294 -179.831 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 82.7 mt -129.27 134.83 63.14 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.866 0 O-C-N 121.692 -0.63 . . . . 0.0 109.379 178.889 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 48' ' ' VAL . . . . . 1.034 HG22 HD12 ' A' ' 34' ' ' ILE . 66.6 t -82.71 127.56 39.55 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.889 0 O-C-N 121.622 -0.674 . . . . 0.0 109.306 179.318 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 49' ' ' THR . . . . . 0.56 HG21 ' HE1' ' A' ' 28' ' ' PHE . 67.9 p -58.29 -24.93 61.09 Favored 'General case' 0 N--CA 1.507 2.408 0 O-C-N 121.545 -0.722 . . . . 0.0 111.916 -169.793 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 56.3 tttt -56.51 -23.26 38.39 Favored 'General case' 0 N--CA 1.502 2.135 0 O-C-N 121.464 -0.772 . . . . 0.0 111.149 -177.055 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 50.4 p30 -84.0 1.47 43.59 Favored 'General case' 0 N--CA 1.498 1.941 0 O-C-N 121.419 -0.8 . . . . 0.0 111.301 176.677 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 52' ' ' ILE . . . . . 0.402 HD12 ' HB ' ' A' ' 49' ' ' THR . 97.8 mt -76.13 127.56 37.44 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.074 0 O-C-N 121.163 -0.961 . . . . 0.0 110.055 179.05 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 45.8 tptt -92.14 -30.86 15.74 Favored 'General case' 0 N--CA 1.495 1.789 0 O-C-N 121.868 -0.52 . . . . 0.0 109.602 169.283 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 5.3 m-20 -163.91 159.37 20.86 Favored 'General case' 0 N--CA 1.499 2.007 0 O-C-N 121.87 -0.519 . . . . 0.0 109.89 -178.56 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . 0.548 ' CD2' HG22 ' A' ' 13' ' ' VAL . 85.5 mt -132.94 149.33 52.25 Favored 'General case' 0 N--CA 1.496 1.868 0 O-C-N 121.699 -0.626 . . . . 0.0 110.342 -179.241 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 6.8 ptm180 -150.71 137.6 19.1 Favored 'General case' 0 N--CA 1.496 1.832 0 O-C-N 121.716 -0.615 . . . . 0.0 109.978 176.462 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 57' ' ' ILE . . . . . 0.474 ' HA ' HG12 ' A' ' 11' ' ' VAL . 68.6 mt -84.77 133.18 29.89 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.795 0 O-C-N 121.503 -0.748 . . . . 0.0 109.843 175.182 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . 0.584 HD11 ' HB2' ' A' ' 12' ' ' GLU . 56.4 mt -85.4 117.04 67.97 Favored Pre-proline 0 N--CA 1.496 1.863 0 O-C-N 121.592 -0.693 . . . . 0.0 110.137 179.404 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 27.3 Cg_endo -66.71 143.95 69.86 Favored 'Trans proline' 0 N--CA 1.489 1.259 0 O-C-N 123.346 1.182 . . . . 0.0 110.311 178.602 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 47.3 tttm -96.67 105.14 17.19 Favored 'General case' 0 N--CA 1.496 1.852 0 O-C-N 121.684 -0.635 . . . . 0.0 110.175 -179.653 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 28.9 t30 -162.63 141.53 8.9 Favored 'General case' 0 N--CA 1.497 1.875 0 O-C-N 121.686 -0.633 . . . . 0.0 110.177 179.513 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 40.2 tt0 54.65 99.0 0.01 OUTLIER 'General case' 0 N--CA 1.507 2.409 0 O-C-N 121.591 -0.693 . . . . 0.0 111.014 179.431 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 81.7 mt -107.62 134.21 50.07 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.914 0 O-C-N 121.66 -0.65 . . . . 0.0 109.677 179.82 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 64' ' ' MET . . . . . . . . . . . . . 20.1 ttm 51.96 58.02 15.76 Favored Pre-proline 0 N--CA 1.504 2.269 0 O-C-N 121.589 -0.694 . . . . 0.0 110.974 -179.277 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 29.0 Cg_endo -67.6 143.86 64.15 Favored 'Trans proline' 0 N--CA 1.488 1.184 0 O-C-N 123.501 1.264 . . . . 0.0 110.367 -179.949 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 82.8 tttt -64.91 -33.79 76.86 Favored 'General case' 0 N--CA 1.501 2.081 0 O-C-N 121.716 -0.615 . . . . 0.0 110.291 179.275 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 6.1 t-20 54.85 41.55 31.82 Favored 'General case' 0 N--CA 1.505 2.28 0 O-C-N 121.559 -0.713 . . . . 0.0 110.867 -179.639 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . -105.21 41.86 2.05 Favored Glycine 0 N--CA 1.494 2.512 0 N-CA-C 109.482 -1.447 . . . . 0.0 109.482 179.402 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 22.3 m -96.93 149.26 22.09 Favored 'General case' 0 N--CA 1.495 1.817 0 O-C-N 121.667 -0.902 . . . . 0.0 110.242 -179.336 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 37.6 tttp -62.39 -39.74 94.2 Favored 'General case' 0 N--CA 1.501 2.101 0 O-C-N 121.619 -0.676 . . . . 0.0 110.473 -179.528 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 72.5 m -140.34 158.97 65.33 Favored Pre-proline 0 N--CA 1.494 1.765 0 O-C-N 121.645 -0.659 . . . . 0.0 110.126 179.25 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 18.4 Cg_exo -62.55 135.07 51.02 Favored 'Trans proline' 0 N--CA 1.49 1.268 0 O-C-N 123.617 1.325 . . . . 0.0 110.606 179.092 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 22.7 t -140.55 141.69 35.23 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.652 -0.655 . . . . 0.0 110.161 179.611 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 44.8 p -69.44 -34.2 74.08 Favored 'General case' 0 N--CA 1.499 1.978 0 O-C-N 121.692 -0.63 . . . . 0.0 110.138 179.645 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 91.6 m-20 -118.68 145.46 45.47 Favored 'General case' 0 N--CA 1.496 1.825 0 O-C-N 121.681 -0.637 . . . . 0.0 110.202 179.611 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 47.9 m -120.24 149.31 42.48 Favored 'General case' 0 N--CA 1.495 1.816 0 O-C-N 121.638 -0.664 . . . . 0.0 110.211 -179.893 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 23.7 m -100.99 137.84 38.82 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.646 -0.658 . . . . 0.0 110.13 179.784 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 18.7 tptm -101.47 142.3 33.06 Favored 'General case' 0 N--CA 1.496 1.826 0 O-C-N 121.679 -0.638 . . . . 0.0 110.287 -179.141 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 82.7 mt -89.81 155.72 18.98 Favored 'General case' 0 N--CA 1.497 1.89 0 O-C-N 121.762 -0.586 . . . . 0.0 110.125 179.197 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 49.8 mtpt 53.69 40.77 31.88 Favored 'General case' 0 N--CA 1.506 2.33 0 O-C-N 121.629 -0.669 . . . . 0.0 110.799 179.893 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 22.9 t -138.21 162.9 33.09 Favored 'General case' 0 N--CA 1.495 1.787 0 O-C-N 121.719 -0.613 . . . . 0.0 110.13 -179.998 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -66.12 144.43 56.69 Favored 'General case' 0 N--CA 1.499 2.0 0 O-C-N 121.644 -0.66 . . . . 0.0 110.339 -179.584 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 13.2 mm-40 -67.15 141.57 57.33 Favored 'General case' 0 N--CA 1.499 1.989 0 O-C-N 121.658 -0.651 . . . . 0.0 110.342 -179.04 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 25.0 m -125.16 141.66 51.97 Favored 'General case' 0 N--CA 1.494 1.769 0 O-C-N 121.68 -0.638 . . . . 0.0 110.115 179.937 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 98.0 m-85 -113.61 134.51 54.67 Favored 'General case' 0 N--CA 1.495 1.79 0 O-C-N 121.596 -0.69 . . . . 0.0 110.14 179.515 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 48.0 m -122.6 142.67 50.39 Favored 'General case' 0 N--CA 1.495 1.812 0 O-C-N 121.667 -0.646 . . . . 0.0 110.171 179.921 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 99.4 p -144.59 31.04 1.2 Allowed 'General case' 0 N--CA 1.495 1.796 0 O-C-N 121.7 -0.625 . . . . 0.0 110.396 179.073 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 31.0 ttpt -100.17 129.51 46.2 Favored 'General case' 0 N--CA 1.494 1.74 0 O-C-N 121.517 -0.739 . . . . 0.0 110.157 -179.687 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 91.6 m-20 -111.68 151.41 28.9 Favored 'General case' 0 N--CA 1.496 1.84 0 O-C-N 121.588 -0.695 . . . . 0.0 110.22 179.954 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 63.8 tttt -79.45 134.88 36.55 Favored 'General case' 0 N--CA 1.497 1.903 0 O-C-N 121.65 -0.656 . . . . 0.0 110.142 -179.824 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 91' ' ' TRP . . . . . . . . . . . . . 81.6 t90 -103.82 126.92 51.28 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.64 -0.663 . . . . 0.0 110.238 -179.811 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 27.2 t -146.14 150.21 35.47 Favored 'General case' 0 N--CA 1.494 1.773 0 O-C-N 121.717 -0.614 . . . . 0.0 110.221 179.862 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 93' ' ' MET . . . . . . . . . . . . . 73.2 mtm 56.47 -83.23 0.01 OUTLIER 'General case' 0 N--CA 1.506 2.344 0 O-C-N 121.956 -0.465 . . . . 0.0 111.325 -179.209 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 10.6 p-10 . . . . . 0 N--CA 1.496 1.874 0 O-C-N 121.102 -0.999 . . . . 0.0 110.243 -178.819 . . . . . . . . 0 0 . 1 . 022 nuclear nobuild full ' B' B ' 240' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 2.405 0 N-CA-C 109.501 -1.439 . . . . 0.0 109.501 . . . . . . . . . 0 0 . 1 . 022 nuclear nobuild full ' B' B ' 241' ' ' ALA . . . . . . . . . . . . . . . -68.27 -30.5 69.54 Favored 'General case' 0 N--CA 1.501 2.083 0 O-C-N 121.709 -0.877 . . . . 0.0 110.539 179.718 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 242' ' ' THR . . . . . . . . . . . . . 23.6 m -63.36 -37.04 85.71 Favored 'General case' 0 N--CA 1.501 2.123 0 O-C-N 121.517 -0.739 . . . . 0.0 110.607 -177.875 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 243' ' ' THR . . . . . . . . . . . . . 40.2 p -119.27 154.43 33.47 Favored 'General case' 0 N--CA 1.497 1.917 0 O-C-N 121.601 -0.687 . . . . 0.0 110.39 -178.538 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 244' ' ' LYS . . . . . . . . . . . . . 83.4 tttt -99.35 -41.3 7.5 Favored 'General case' 0 N--CA 1.496 1.826 0 O-C-N 121.673 -0.642 . . . . 0.0 110.171 179.276 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 245' ' ' GLU . . . . . . . . . . . . . 50.6 mt-10 52.72 -177.55 0.02 OUTLIER 'General case' 0 N--CA 1.507 2.387 0 O-C-N 121.601 -0.687 . . . . 0.0 111.132 -179.849 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 246' ' ' LYS . . . . . . . . . . . . . 50.1 pttt -161.14 133.09 5.77 Favored 'General case' 0 N--CA 1.496 1.866 0 O-C-N 121.613 -0.68 . . . . 0.0 110.417 -179.871 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 247' ' ' ASN . . . . . . . . . . . . . 91.8 m-20 -113.46 143.24 44.84 Favored 'General case' 0 N--CA 1.495 1.793 0 O-C-N 121.724 -0.61 . . . . 0.0 110.173 179.744 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 248' ' ' ILE . . . . . 0.509 HG22 ' O ' ' B' ' 248' ' ' ILE . 72.6 mt 52.87 51.48 0.38 Allowed 'Isoleucine or valine' 0 N--CA 1.508 2.428 0 O-C-N 121.508 -0.745 . . . . 0.0 110.227 -179.249 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' B' B ' 249' ' ' SER . . . . . . . . . . . . . 58.5 m -90.32 -28.24 18.88 Favored 'General case' 0 N--CA 1.496 1.862 0 O-C-N 121.512 -0.743 . . . . 0.0 110.783 -178.572 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 250' ' ' VAL . . . . . . . . . . . . . 57.4 t -85.05 -55.23 7.08 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.01 0 O-C-N 121.558 -0.713 . . . . 0.0 109.909 -176.602 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 251' ' ' ASP . . . . . 0.423 ' C ' HG13 ' B' ' 252' ' ' VAL . 16.1 m-20 51.04 -172.39 0.02 OUTLIER 'General case' 0 N--CA 1.506 2.365 0 O-C-N 121.542 -0.724 . . . . 0.0 111.048 -177.936 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' B' B ' 252' ' ' VAL . . . . . 0.423 HG13 ' C ' ' B' ' 251' ' ' ASP . 24.1 m -153.64 127.28 1.24 Allowed 'Isoleucine or valine' 0 N--CA 1.499 2.005 0 O-C-N 121.649 -0.657 . . . . 0.0 109.788 -178.526 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' B' B ' 253' ' ' ASP . . . . . . . . . . . . . 5.3 m-20 -161.54 108.49 1.4 Allowed 'General case' 0 N--CA 1.497 1.882 0 O-C-N 121.822 -0.549 . . . . 0.0 109.847 -179.28 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 254' ' ' ALA . . . . . . . . . . . . . . . -66.82 -35.84 80.98 Favored 'General case' 0 N--CA 1.499 1.977 0 O-C-N 121.584 -0.697 . . . . 0.0 110.372 -179.371 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 255' ' ' ASP . . . . . . . . . . . . . 74.6 m-20 -73.7 -31.72 63.55 Favored 'General case' 0 N--CA 1.5 2.029 0 O-C-N 121.738 -0.601 . . . . 0.0 110.36 -179.593 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 256' ' ' ALA . . . . . . . . . . . . . . . -63.5 -37.09 85.97 Favored 'General case' 0 N--CA 1.501 2.1 0 O-C-N 121.626 -0.671 . . . . 0.0 110.328 179.966 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 257' ' ' SER . . . . . . . . . . . . . 45.4 m -55.53 -36.17 66.46 Favored 'General case' 0 N--CA 1.503 2.219 0 O-C-N 121.668 -0.645 . . . . 0.0 110.422 177.93 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 258' ' ' SER . . . . . . . . . . . . . 25.6 t -69.51 -32.79 71.86 Favored 'General case' 0 N--CA 1.498 1.973 0 C-N-CA 120.365 -0.534 . . . . 0.0 110.274 179.171 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 259' ' ' GLN . . . . . . . . . . . . . 29.2 tt0 -63.27 -38.37 90.88 Favored 'General case' 0 N--CA 1.501 2.1 0 O-C-N 121.629 -0.669 . . . . 0.0 110.472 -179.37 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 260' ' ' LEU . . . . . 0.495 ' HA ' HD12 ' B' ' 263' ' ' LEU . 84.5 mt -67.16 -42.33 84.48 Favored 'General case' 0 N--CA 1.5 2.027 0 O-C-N 121.652 -0.655 . . . . 0.0 110.251 179.872 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' B' B ' 261' ' ' LEU . . . . . . . . . . . . . 21.6 tp -70.01 -36.61 75.24 Favored 'General case' 0 N--CA 1.496 1.873 0 O-C-N 121.668 -0.645 . . . . 0.0 109.757 176.852 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 262' ' ' SER . . . . . . . . . . . . . 22.6 t -62.25 -37.51 85.72 Favored 'General case' 0 N--CA 1.501 2.086 0 O-C-N 121.745 -0.597 . . . . 0.0 110.389 177.036 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 263' ' ' LEU . . . . . 0.495 HD12 ' HA ' ' B' ' 260' ' ' LEU . 28.2 mt -64.91 -41.64 95.4 Favored 'General case' 0 N--CA 1.501 2.093 0 O-C-N 121.651 -0.655 . . . . 0.0 110.314 179.365 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' B' B ' 264' ' ' LEU . . . . . 0.455 ' CD1' HD11 ' A' ' 55' ' ' LEU . 85.8 mt -62.26 -34.73 77.1 Favored 'General case' 0 N--CA 1.503 2.203 0 O-C-N 121.68 -0.638 . . . . 0.0 110.516 178.601 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' B' B ' 265' ' ' LYS . . . . . . . . . . . . . 53.9 tttm -75.19 -34.09 61.49 Favored 'General case' 0 N--CA 1.498 1.952 0 O-C-N 121.692 -0.63 . . . . 0.0 110.065 -179.391 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 266' ' ' SER . . . . . . . . . . . . . 86.6 p -162.48 158.67 24.02 Favored 'General case' 0 N--CA 1.496 1.838 0 O-C-N 121.665 -0.647 . . . . 0.0 110.074 179.834 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 267' ' ' SER . . . . . . . . . . . . . 12.7 t -90.29 -32.27 16.6 Favored 'General case' 0 N--CA 1.496 1.844 0 O-C-N 121.662 -0.649 . . . . 0.0 110.396 -179.348 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 268' ' ' THR . . . . . . . . . . . . . 37.8 p -85.31 132.11 34.3 Favored 'General case' 0 N--CA 1.497 1.917 0 O-C-N 121.598 -0.689 . . . . 0.0 110.263 -179.192 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 269' ' ' ALA . . . . . . . . . . . . . . . -170.31 155.76 5.28 Favored Pre-proline 0 N--CA 1.499 1.994 0 O-C-N 121.658 -0.651 . . . . 0.0 109.915 179.271 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 270' ' ' PRO . . . . . . . . . . . . . 29.1 Cg_endo -67.76 128.13 17.41 Favored 'Trans proline' 0 N--CA 1.488 1.159 0 O-C-N 123.664 1.349 . . . . 0.0 110.323 179.381 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 271' ' ' SER . . . . . . . . . . . . . 4.0 m -161.73 -52.1 0.04 OUTLIER 'General case' 0 N--CA 1.495 1.818 0 O-C-N 121.703 -0.623 . . . . 0.0 110.113 179.887 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 272' ' ' ASP . . . . . . . . . . . . . 74.5 m-20 -100.07 29.75 4.11 Favored 'General case' 0 N--CA 1.496 1.835 0 O-C-N 121.726 -0.609 . . . . 0.0 110.489 179.989 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 273' ' ' LEU . . . . . . . . . . . . . 82.8 mt 57.23 -81.88 0.02 OUTLIER 'General case' 0 N--CA 1.506 2.367 0 O-C-N 121.902 -0.499 . . . . 0.0 111.287 -178.67 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 274' ' ' ALA . . . . . . . . . . . . . . . -75.05 147.3 40.79 Favored 'General case' 0 N--CA 1.498 1.974 0 O-C-N 121.21 -0.931 . . . . 0.0 110.19 -178.431 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 275' ' ' THR . . . . . . . . . . . . . 24.0 p -112.37 161.51 25.83 Favored Pre-proline 0 N--CA 1.494 1.758 0 O-C-N 121.706 -0.621 . . . . 0.0 110.162 179.841 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 276' ' ' PRO . . . . . . . . . . . . . 27.6 Cg_endo -66.89 129.39 20.73 Favored 'Trans proline' 0 N--CA 1.489 1.224 0 O-C-N 123.714 1.376 . . . . 0.0 110.443 -179.794 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 277' ' ' GLN . . . . . . . . . . . . . 4.5 mp0 -88.49 -49.87 0.41 Allowed Pre-proline 0 N--CA 1.497 1.915 0 O-C-N 121.699 -0.625 . . . . 0.0 110.79 179.947 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 278' ' ' PRO . . . . . . . . . . . . . 27.8 Cg_exo -57.49 135.39 69.5 Favored 'Trans proline' 0 N--CA 1.495 1.578 0 O-C-N 123.046 1.024 . . . . 0.0 110.839 179.054 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 279' ' ' SER . . . . . . . . . . . . . 27.3 m -67.14 -37.88 84.57 Favored 'General case' 0 N--CA 1.499 2.002 0 O-C-N 121.715 -0.616 . . . . 0.0 110.274 179.757 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 280' ' ' THR . . . . . . . . . . . . . 11.3 m 52.1 94.27 0.02 OUTLIER 'General case' 0 N--CA 1.506 2.328 0 O-C-N 121.696 -0.627 . . . . 0.0 111.052 -179.389 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 281' ' ' PHE . . . . . . . . . . . . . 50.4 p90 -140.22 130.15 13.66 Favored Pre-proline 0 N--CA 1.496 1.842 0 O-C-N 121.612 -0.68 . . . . 0.0 110.269 -179.532 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 282' ' ' PRO . . . . . . . . . . . . . 58.3 Cg_endo -78.43 91.27 1.2 Allowed 'Trans proline' 0 N--CA 1.485 1.006 0 O-C-N 123.323 1.17 . . . . 0.0 110.503 178.952 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 283' ' ' GLN . . . . . 0.419 ' HB3' ' HD3' ' B' ' 284' ' ' PRO . 3.0 tp60 -80.68 -51.06 1.01 Allowed Pre-proline 0 N--CA 1.497 1.889 0 O-C-N 121.63 -0.669 . . . . 0.0 110.985 178.239 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' B' B ' 284' ' ' PRO . . . . . 0.419 ' HD3' ' HB3' ' B' ' 283' ' ' GLN . 46.7 Cg_endo -75.58 157.09 40.49 Favored 'Trans proline' 0 N--CA 1.486 1.087 0 O-C-N 123.133 1.07 . . . . 0.0 110.316 -176.964 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' B' B ' 285' ' ' PRO . . . . . . . . . . . . . 22.4 Cg_endo -65.46 -31.92 50.51 Favored 'Trans proline' 0 N--CA 1.489 1.228 0 O-C-N 123.715 1.376 . . . . 0.0 110.587 -179.911 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 286' ' ' VAL . . . . . . . . . . . . . 61.3 t -119.42 132.81 68.17 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.929 0 O-C-N 121.687 -0.633 . . . . 0.0 109.689 179.697 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 287' ' ' GLU . . . . . . . . . . . . . 46.1 tt0 -67.54 -35.74 79.64 Favored 'General case' 0 N--CA 1.5 2.031 0 O-C-N 121.714 -0.617 . . . . 0.0 110.133 179.5 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 288' ' ' SER . . . . . . . . . . . . . 4.8 m 51.92 87.27 0.03 OUTLIER 'General case' 0 N--CA 1.507 2.395 0 O-C-N 121.686 -0.634 . . . . 0.0 111.103 -179.816 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 289' ' ' HIS . . . . . . . . . . . . . 76.6 m80 52.09 -173.97 0.03 OUTLIER 'General case' 0 N--CA 1.506 2.356 0 O-C-N 121.486 -0.759 . . . . 0.0 111.116 179.503 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 290' ' ' SER . . . . . . . . . . . . . 97.7 p -134.09 157.77 45.32 Favored 'General case' 0 N--CA 1.495 1.779 0 O-C-N 121.674 -0.641 . . . . 0.0 110.151 179.634 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 291' ' ' SER . . . . . . . . . . . . . 47.9 t . . . . . 0 N--CA 1.495 1.809 0 CA-C-O 117.974 -1.013 . . . . 0.0 110.214 -179.931 . . . . . . . . 0 0 . 1 stop_ save_