data_2kfv_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 2kfv _Structure_validation_residue.Date_analyzed 2016-10-07 loop_ _Residue_analysis_software.Software_ID _Residue_analysis_software.Software_label _Residue_analysis_software.Method_ID _Residue_analysis_software.Method_label _Residue_analysis_software.Entry_ID _Residue_analysis_software.Structure_validation_oneline_list_ID 1 MolProbity . . ? 1 2 CYRANGE . . ? 1 stop_ loop_ _Residue_analysis.ID _Residue_analysis.PDB_model_num _Residue_analysis.Hydrogen_positions _Residue_analysis.MolProbity_flips _Residue_analysis.Cyrange_core_flag _Residue_analysis.Two_letter_chain_ID _Residue_analysis.PDB_strand_ID _Residue_analysis.PDB_residue_no _Residue_analysis.PDB_ins_code _Residue_analysis.PDB_residue_name _Residue_analysis.Assembly_ID _Residue_analysis.Entity_assembly_ID _Residue_analysis.Entity_ID _Residue_analysis.Comp_ID _Residue_analysis.Comp_index_ID _Residue_analysis.Clash_value _Residue_analysis.Clash_source_PDB_atom_name _Residue_analysis.Clash_destination_PDB_atom_name _Residue_analysis.Clash_destination_PDB_strand_ID _Residue_analysis.Clash_destination_PDB_residue_no _Residue_analysis.Clash_destination_PDB_ins_code _Residue_analysis.Clash_destination_PDB_residue_name _Residue_analysis.Cbeta_deviation_value _Residue_analysis.Rotamer_score _Residue_analysis.Rotamer_name _Residue_analysis.Ramachandran_phi _Residue_analysis.Ramachandran_psi _Residue_analysis.Ramachandran_score _Residue_analysis.Ramachandran_evaluation _Residue_analysis.Ramachandran_type _Residue_analysis.Bond_outlier_count _Residue_analysis.Worst_bond _Residue_analysis.Worst_bond_value _Residue_analysis.Worst_bond_sigma _Residue_analysis.Angle_outlier_count _Residue_analysis.Worst_angle _Residue_analysis.Worst_angle_value _Residue_analysis.Worst_angle_sigma _Residue_analysis.RNA_phosphate_perpendicular_outlier _Residue_analysis.RNA_suitness_score _Residue_analysis.RNA_suite_conformer _Residue_analysis.RNA_suite_triage _Residue_analysis.Max_b_factor _Residue_analysis.Tau_angle _Residue_analysis.Omega_dihedral _Residue_analysis.Disulfide_chi1 _Residue_analysis.Disulfide_chi2 _Residue_analysis.Disulfide_chi3 _Residue_analysis.Disulfide_ss_angle _Residue_analysis.Disulfide_ss _Residue_analysis.Disulfide_ss_angle_prime _Residue_analysis.Disulfide_chi2prime _Residue_analysis.Disulfide_chi1prime _Residue_analysis.Outlier_count_separate_geometry _Residue_analysis.Outlier_count _Residue_analysis.Entry_ID _Residue_analysis.Structure_validation_residue_list_ID . 001 nuclear orig core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.541 0.612 0 CA-C-O 121.6 0.714 . . . . 0.0 111.056 . . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -76.24 -37.39 57.74 Favored 'General case' 0 N--CA 1.472 0.627 0 CA-C-N 114.53 -1.214 . . . . 0.0 109.919 -176.859 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 29' ' ' TRP . . . . . . . . . . . . . 2.5 m-90 -120.94 148.13 44.5 Favored 'General case' 0 N--CA 1.471 0.6 0 CA-C-N 114.932 -1.031 . . . . 0.0 109.1 -177.279 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 76.3 p -87.18 175.33 8.11 Favored 'General case' 0 CA--C 1.54 0.596 0 C-N-CA 123.073 0.549 . . . . 0.0 110.006 176.167 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . 0.419 HG13 ' HE ' ' A' ' 35' ' ' ARG . 51.8 t -55.87 -46.26 80.07 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.052 0 C-N-CA 123.687 0.795 . . . . 0.0 111.484 -178.732 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 12.7 pt-20 -66.94 -41.51 86.87 Favored 'General case' 0 N--CA 1.475 0.782 0 C-N-CA 123.335 0.654 . . . . 0.0 111.403 -179.245 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 55.3 mt-30 -60.17 -36.52 77.76 Favored 'General case' 0 N--CA 1.479 0.995 0 C-N-CA 123.196 0.598 . . . . 0.0 110.974 178.329 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 85.0 mt -70.19 -51.43 31.1 Favored 'General case' 0 N--CA 1.469 0.497 0 C-N-CA 122.74 0.416 . . . . 0.0 110.427 178.864 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 35' ' ' ARG . . . . . 0.419 ' HE ' HG13 ' A' ' 31' ' ' VAL . 50.5 mtm180 -57.27 -28.45 62.99 Favored 'General case' 0 N--CA 1.484 1.251 0 C-N-CA 123.913 0.885 . . . . 0.0 111.755 -179.371 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 44.6 t -53.93 122.19 9.56 Favored 'General case' 0 CA--C 1.541 0.619 0 C-N-CA 124.262 1.025 . . . . 0.0 110.941 174.848 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 10.9 pt-20 -71.14 -8.82 56.07 Favored 'General case' 0 CA--C 1.549 0.939 0 C-N-CA 123.973 0.909 . . . . 0.0 111.482 179.038 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 95.7 mt-30 -65.89 -47.92 73.2 Favored 'General case' 0 N--CA 1.472 0.667 0 C-N-CA 123.914 0.886 . . . . 0.0 109.712 168.753 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 3.8 tt -76.89 116.92 61.25 Favored Pre-proline 0 CA--C 1.553 1.085 0 N-CA-C 108.126 -1.065 . . . . 0.0 108.126 179.509 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 32.4 Cg_exo -61.63 165.45 13.58 Favored 'Trans proline' 0 C--N 1.38 2.187 0 C-N-CA 123.479 2.786 . . . . 0.0 114.126 176.763 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 36.6 mtmm -81.54 -25.94 35.48 Favored 'General case' 0 N--CA 1.475 0.82 0 CA-C-N 115.722 -0.672 . . . . 0.0 111.004 179.536 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 18.5 ptpt -64.77 -48.11 75.68 Favored 'General case' 0 CA--C 1.547 0.865 0 C-N-CA 123.524 0.73 . . . . 0.0 112.797 -171.394 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 13.6 p-10 -73.28 -23.65 60.33 Favored 'General case' 0 N--CA 1.478 0.936 0 C-N-CA 122.666 0.386 . . . . 0.0 111.852 -176.794 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 54.2 mt -66.89 -52.69 41.76 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.084 0 C-N-CA 123.071 0.549 . . . . 0.0 110.1 171.496 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 80.3 mt -60.13 -34.73 57.92 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.17 0 C-N-CA 123.132 0.573 . . . . 0.0 110.416 177.545 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 2.7 tmtp? -59.77 -50.29 74.41 Favored 'General case' 0 N--CA 1.474 0.761 0 C-N-CA 123.714 0.806 . . . . 0.0 109.075 175.498 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 24.0 t80 -58.77 -45.16 90.39 Favored 'General case' 0 N--CA 1.485 1.319 0 C-N-CA 124.035 0.934 . . . . 0.0 111.627 179.978 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . 0.482 ' HB3' ' HE2' ' A' ' 56' ' ' PHE . 92.4 mt -72.01 -32.3 67.05 Favored 'General case' 0 CA--C 1.545 0.782 0 CA-C-N 115.277 -0.874 . . . . 0.0 111.816 -175.879 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . 0.508 ' HA ' HD22 ' A' ' 57' ' ' LEU . 3.0 pt20 -85.53 -23.86 27.52 Favored 'General case' 0 N--CA 1.491 1.594 0 C-N-CA 122.724 0.41 . . . . 0.0 112.013 175.051 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . 0.548 ' HG3' ' HD1' ' A' ' 51' ' ' HIS . 8.5 tp10 -58.36 -39.04 78.47 Favored 'General case' 0 N--CA 1.482 1.165 0 C-N-CA 124.458 1.103 . . . . 0.0 111.24 -179.759 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 51' ' ' HIS . . . . . 0.548 ' HD1' ' HG3' ' A' ' 50' ' ' GLU . 2.0 m80 -132.59 -30.23 1.47 Allowed 'General case' 0 N--CA 1.479 0.98 0 CA-C-O 119.034 -0.508 . . . . 0.0 112.169 -175.004 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -59.31 120.16 21.41 Favored Glycine 0 N--CA 1.478 1.434 0 CA-C-O 119.489 -0.617 . . . . 0.0 111.949 175.758 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 22.8 t -70.97 176.44 4.35 Favored 'General case' 0 N--CA 1.484 1.246 0 C-N-CA 123.607 0.763 . . . . 0.0 112.17 -171.251 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 5.6 p-10 -58.57 -36.49 74.02 Favored 'General case' 0 N--CA 1.48 1.056 0 C-N-CA 124.292 1.037 . . . . 0.0 113.429 -168.16 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 27.8 t -69.38 -40.7 77.26 Favored 'General case' 0 N--CA 1.476 0.827 0 C-N-CA 122.839 0.456 . . . . 0.0 110.096 -178.998 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 56' ' ' PHE . . . . . 0.629 ' HB2' ' HB3' ' A' ' 90' ' ' ARG . 65.7 t80 -59.69 -49.29 78.33 Favored 'General case' 0 N--CA 1.477 0.906 0 CA-C-O 121.378 0.609 . . . . 0.0 110.368 175.454 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . 0.508 HD22 ' HA ' ' A' ' 49' ' ' GLN . 68.7 mt -67.71 -31.78 71.96 Favored 'General case' 0 C--O 1.221 -0.424 0 CA-C-N 114.626 -1.17 . . . . 0.0 112.082 -176.128 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -73.68 -49.97 23.2 Favored 'General case' 0 N--CA 1.478 0.943 0 C-N-CA 122.798 0.439 . . . . 0.0 111.647 179.345 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 43.6 mt-10 -67.17 -36.59 82.12 Favored 'General case' 0 N--CA 1.485 1.301 0 C-N-CA 123.58 0.752 . . . . 0.0 111.612 -177.782 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 42.6 m-70 -98.77 -4.96 32.22 Favored 'General case' 0 N--CA 1.478 0.972 0 C-N-CA 123.122 0.569 . . . . 0.0 111.892 -177.85 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 62.9 mttp 58.56 41.35 22.54 Favored 'General case' 0 N--CA 1.496 1.849 0 C-N-CA 124.482 1.113 . . . . 0.0 112.641 175.736 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 85.1 mt -102.73 0.94 33.72 Favored 'General case' 0 N--CA 1.479 1.0 0 C-N-CA 123.592 0.757 . . . . 0.0 111.487 -178.749 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . 0.435 ' HB3' ' HB3' ' A' ' 57' ' ' LEU . 1.1 pp -77.07 160.73 28.85 Favored 'General case' 0 N--CA 1.483 1.206 0 C-N-CA 122.95 0.5 . . . . 0.0 111.369 174.651 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 89.28 -158.67 27.99 Favored Glycine 0 C--N 1.338 0.666 0 CA-C-N 115.167 -0.924 . . . . 0.0 112.942 173.79 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 36.8 m-80 -61.91 118.3 7.05 Favored 'General case' 0 CA--C 1.539 0.541 0 C-N-CA 123.573 0.749 . . . . 0.0 110.423 179.957 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 84.4 mt -50.05 -51.89 15.7 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.117 0 C-N-CA 124.136 0.975 . . . . 0.0 111.398 -177.617 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.76 -38.55 88.44 Favored 'General case' 0 CA--C 1.552 1.047 0 C-N-CA 123.47 0.708 . . . . 0.0 112.148 -178.399 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 23.9 t-20 -61.54 -38.34 87.06 Favored 'General case' 0 N--CA 1.485 1.311 0 C-N-CA 123.411 0.684 . . . . 0.0 110.777 175.841 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 99.2 t -73.5 -39.72 54.75 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.786 0 CA-C-N 115.183 -0.917 . . . . 0.0 110.355 175.141 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -69.35 -26.71 64.82 Favored 'General case' 0 N--CA 1.484 1.232 0 C-N-CA 124.388 1.075 . . . . 0.0 112.589 -171.902 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 22.1 ptmt -76.82 -17.13 59.2 Favored 'General case' 0 N--CA 1.477 0.91 0 C-N-CA 122.425 0.29 . . . . 0.0 111.523 -179.94 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 9.1 t -120.98 2.29 10.46 Favored 'General case' 0 CA--C 1.55 0.966 0 C-N-CA 123.94 0.896 . . . . 0.0 110.452 177.801 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . 0.43 ' HB2' HD23 ' A' ' 78' ' ' LEU . . . -91.95 121.16 33.28 Favored 'General case' 0 N--CA 1.47 0.55 0 C-N-CA 123.148 0.579 . . . . 0.0 109.932 175.063 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 12.5 p-10 -93.42 145.92 24.13 Favored 'General case' 0 N--CA 1.473 0.678 0 N-CA-C 108.493 -0.929 . . . . 0.0 108.493 168.829 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 4.6 tppp? -59.64 -42.3 92.45 Favored 'General case' 0 N--CA 1.477 0.88 0 C-N-CA 123.842 0.857 . . . . 0.0 112.143 -169.839 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 6.2 p-10 -64.5 -32.45 74.08 Favored 'General case' 0 N--CA 1.477 0.893 0 C-N-CA 123.265 0.626 . . . . 0.0 111.833 -177.102 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 47.5 t60 -68.37 -34.91 76.91 Favored 'General case' 0 N--CA 1.487 1.376 0 C-N-CA 123.484 0.713 . . . . 0.0 110.465 174.046 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . 0.43 HD23 ' HB2' ' A' ' 73' ' ' ALA . 84.4 mt -70.23 -35.33 73.79 Favored 'General case' 0 N--CA 1.479 0.977 0 C-N-CA 122.892 0.477 . . . . 0.0 111.465 -179.174 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 53.4 t -71.71 -37.95 64.54 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.788 0 O-C-N 124.084 0.865 . . . . 0.0 110.045 176.748 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 63.6 m -61.49 -47.17 86.87 Favored 'General case' 0 CA--C 1.545 0.756 0 CA-C-N 115.625 -0.716 . . . . 0.0 110.265 173.216 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -63.48 -41.63 98.58 Favored 'General case' 0 N--CA 1.476 0.825 0 C-N-CA 123.606 0.762 . . . . 0.0 110.951 -179.608 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 82' ' ' TYR . . . . . . . . . . . . . 7.8 t80 -55.77 -55.49 31.72 Favored 'General case' 0 CA--C 1.543 0.711 0 C-N-CA 124.954 1.302 . . . . 0.0 111.11 175.964 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 83' ' ' ASN . . . . . . . . . . . . . 70.7 m-20 -65.17 -41.09 94.98 Favored 'General case' 0 N--CA 1.486 1.36 0 C-N-CA 123.302 0.641 . . . . 0.0 111.683 -175.924 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 22.2 m-70 -68.79 -25.58 64.77 Favored 'General case' 0 N--CA 1.479 0.979 0 C-N-CA 123.878 0.871 . . . . 0.0 111.567 178.171 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 85' ' ' LEU . . . . . 0.515 ' HG ' ' HD2' ' A' ' 91' ' ' PHE . 51.2 tp -57.57 -53.95 52.42 Favored 'General case' 0 N--CA 1.487 1.405 0 CA-C-O 121.831 0.824 . . . . 0.0 111.069 178.872 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 43.4 m-85 -73.11 -30.9 63.97 Favored 'General case' 0 CA--C 1.538 0.506 0 CA-C-N 113.787 -1.551 . . . . 0.0 110.889 -177.174 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 44.9 tt0 -66.51 -30.33 70.62 Favored 'General case' 0 CA--C 1.548 0.871 0 C-N-CA 124.141 0.976 . . . . 0.0 111.774 -176.221 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 11.6 p -116.98 2.58 12.74 Favored 'General case' 0 N--CA 1.48 1.071 0 C-N-CA 123.421 0.688 . . . . 0.0 111.618 179.153 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 27.2 mtpp 58.21 30.97 20.2 Favored 'General case' 0 N--CA 1.485 1.285 0 C-N-CA 123.92 0.888 . . . . 0.0 111.815 177.461 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 90' ' ' ARG . . . . . 0.629 ' HB3' ' HB2' ' A' ' 56' ' ' PHE . 53.2 mtt85 -62.8 -12.36 23.88 Favored 'General case' 0 N--CA 1.489 1.513 0 C-N-CA 124.14 0.976 . . . . 0.0 113.095 -175.748 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 91' ' ' PHE . . . . . 0.515 ' HD2' ' HG ' ' A' ' 85' ' ' LEU . 6.9 p90 -77.15 161.66 28.05 Favored 'General case' 0 CA--C 1.542 0.644 0 C-N-CA 123.462 0.705 . . . . 0.0 112.046 174.997 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 19.4 ptmt . . . . . 0 CA--C 1.557 1.218 0 N-CA-C 108.127 -1.064 . . . . 0.0 108.127 169.047 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 38.0 ttp180 . . . . . 0 CA--C 1.537 0.473 0 N-CA-C 109.279 -0.638 . . . . 0.0 109.279 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -93.83 -15.95 24.58 Favored 'General case' 0 N--CA 1.47 0.53 0 CA-C-N 114.485 -1.234 . . . . 0.0 110.847 -174.898 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 29' ' ' TRP . . . . . . . . . . . . . 4.1 m0 -130.57 132.31 45.48 Favored 'General case' 0 N--CA 1.466 0.357 0 C-N-CA 123.791 0.836 . . . . 0.0 108.9 -174.062 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 64.7 p -80.4 174.1 11.94 Favored 'General case' 0 C--O 1.245 0.844 0 N-CA-C 108.912 -0.773 . . . . 0.0 108.912 167.927 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . 0.408 ' HA ' HD12 ' A' ' 34' ' ' LEU . 13.5 p -57.35 -35.38 48.97 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.262 0 C-N-CA 122.565 0.346 . . . . 0.0 111.38 -174.724 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 14.8 pt-20 -73.73 -37.75 65.0 Favored 'General case' 0 CA--C 1.551 0.99 0 C-N-CA 123.963 0.905 . . . . 0.0 111.635 178.879 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 15.4 mm100 -67.49 -33.49 75.22 Favored 'General case' 0 N--CA 1.479 1.014 0 C-N-CA 123.311 0.644 . . . . 0.0 110.666 179.998 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . 0.468 ' O ' ' HD3' ' A' ' 75' ' ' LYS . 83.2 mt -59.02 -48.83 80.16 Favored 'General case' 0 N--CA 1.473 0.721 0 N-CA-C 109.256 -0.646 . . . . 0.0 109.256 171.738 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 29.6 mtp180 -68.09 -12.93 61.74 Favored 'General case' 0 N--CA 1.487 1.422 0 CA-C-N 114.638 -1.164 . . . . 0.0 113.221 -176.949 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 46.1 t -56.85 117.64 4.14 Favored 'General case' 0 N--CA 1.48 1.032 0 C-N-CA 123.67 0.788 . . . . 0.0 109.929 176.784 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 12.4 pt-20 -65.58 -33.93 77.06 Favored 'General case' 0 N--CA 1.48 1.044 0 C-N-CA 123.427 0.691 . . . . 0.0 112.06 -172.248 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 18.0 mm-40 -74.07 -22.53 59.49 Favored 'General case' 0 N--CA 1.471 0.597 0 C-N-CA 123.309 0.643 . . . . 0.0 111.19 179.65 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 5.3 tt -76.2 116.97 60.77 Favored Pre-proline 0 CA--C 1.545 0.781 0 N-CA-C 107.281 -1.377 . . . . 0.0 107.281 171.002 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 17.9 Cg_exo -66.62 136.14 41.4 Favored 'Trans proline' 0 C--N 1.375 1.963 0 C-N-CA 122.831 2.354 . . . . 0.0 111.831 -177.895 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 41' ' ' LYS . . . . . 0.439 ' HZ3' ' HA ' ' A' ' 74' ' ' ASN . 16.7 ptpt -64.72 -33.4 75.87 Favored 'General case' 0 CA--C 1.548 0.899 0 C-N-CA 122.963 0.505 . . . . 0.0 110.036 177.365 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 55.0 pttt -71.19 -27.06 63.24 Favored 'General case' 0 N--CA 1.478 0.956 0 C-N-CA 123.946 0.898 . . . . 0.0 111.356 179.912 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 14.9 t70 -63.34 -36.72 84.65 Favored 'General case' 0 CA--C 1.552 1.022 0 C-N-CA 122.97 0.508 . . . . 0.0 109.702 172.561 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 42.8 mt -73.28 -47.17 47.66 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.923 0 C-N-CA 123.902 0.881 . . . . 0.0 110.183 177.818 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 82.7 mt -56.82 -39.53 65.12 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.707 0 C-N-CA 123.553 0.741 . . . . 0.0 110.953 178.973 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 37.8 ttmt -62.96 -44.52 95.84 Favored 'General case' 0 N--CA 1.476 0.865 0 C-N-CA 123.254 0.622 . . . . 0.0 110.679 178.702 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 22.8 t80 -59.34 -46.39 88.74 Favored 'General case' 0 N--CA 1.478 0.951 0 CA-C-N 115.269 -0.878 . . . . 0.0 110.42 177.274 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . 0.409 ' HB3' ' HE2' ' A' ' 56' ' ' PHE . 96.6 mt -72.47 -30.76 64.84 Favored 'General case' 0 CA--C 1.539 0.555 0 CA-C-N 114.625 -1.171 . . . . 0.0 112.212 -175.187 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . 0.5 ' HA ' HD22 ' A' ' 57' ' ' LEU . 3.0 pt20 -84.08 -34.24 24.21 Favored 'General case' 0 N--CA 1.483 1.176 0 CA-C-N 117.895 0.316 . . . . 0.0 111.42 179.796 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 43.0 tt0 -67.89 -39.67 83.63 Favored 'General case' 0 N--CA 1.48 1.056 0 CA-C-O 121.403 0.621 . . . . 0.0 110.569 -179.913 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 76.7 m80 -96.37 -49.8 5.03 Favored 'General case' 0 N--CA 1.469 0.503 0 CA-C-N 114.865 -1.061 . . . . 0.0 111.297 -175.584 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . 0.55 ' HA2' ' HA ' ' A' ' 91' ' ' PHE . . . -60.77 141.31 48.1 Favored Glycine 0 C--N 1.345 1.063 0 O-C-N 123.396 0.435 . . . . 0.0 113.698 178.505 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 16.8 t -88.54 174.03 8.31 Favored 'General case' 0 N--CA 1.479 1.016 0 C-N-CA 122.737 0.415 . . . . 0.0 111.296 -176.842 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 3.2 m-20 -48.29 -45.43 34.78 Favored 'General case' 0 N--CA 1.489 1.477 0 C-N-CA 125.839 1.656 . . . . 0.0 113.831 -170.187 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 42.0 t -66.35 -43.09 87.03 Favored 'General case' 0 N--CA 1.478 0.975 0 C-N-CA 123.402 0.681 . . . . 0.0 110.855 -178.386 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 56' ' ' PHE . . . . . 0.543 ' HB2' ' HB3' ' A' ' 90' ' ' ARG . 85.1 t80 -62.08 -40.2 95.01 Favored 'General case' 0 N--CA 1.48 1.037 0 C-N-CA 123.324 0.65 . . . . 0.0 110.316 176.499 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . 0.5 HD22 ' HA ' ' A' ' 49' ' ' GLN . 32.0 mt -73.01 -35.68 66.86 Favored 'General case' 0 C--O 1.218 -0.591 0 CA-C-N 115.095 -0.957 . . . . 0.0 111.906 -175.532 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -73.54 -49.32 27.07 Favored 'General case' 0 N--CA 1.473 0.69 0 C-N-CA 122.64 0.376 . . . . 0.0 110.785 179.416 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 27.2 mm-40 -55.15 -36.89 66.29 Favored 'General case' 0 N--CA 1.481 1.114 0 C-N-CA 123.756 0.822 . . . . 0.0 112.253 178.586 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 57.9 m80 -108.11 1.5 22.33 Favored 'General case' 0 CA--C 1.55 0.978 0 C-N-CA 123.022 0.529 . . . . 0.0 112.338 -177.117 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 57.4 mtpt 54.93 35.31 24.19 Favored 'General case' 0 N--CA 1.496 1.857 0 C-N-CA 124.405 1.082 . . . . 0.0 112.796 177.375 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . 0.426 ' HA ' HG11 ' A' ' 69' ' ' VAL . 92.3 mt -90.13 -6.62 55.19 Favored 'General case' 0 N--CA 1.482 1.133 0 C-N-CA 123.483 0.713 . . . . 0.0 111.931 -176.319 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 1.2 pp -73.51 162.65 29.03 Favored 'General case' 0 N--CA 1.481 1.079 0 C-N-CA 123.749 0.82 . . . . 0.0 111.75 179.146 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 81.23 -148.26 28.05 Favored Glycine 0 CA--C 1.528 0.864 0 CA-C-N 115.353 -0.84 . . . . 0.0 113.613 174.614 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -68.0 113.96 6.13 Favored 'General case' 0 N--CA 1.478 0.949 0 C-N-CA 123.269 0.628 . . . . 0.0 109.505 -178.465 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 41.4 mt -55.02 -45.33 76.75 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.874 0 O-C-N 124.822 1.326 . . . . 0.0 110.968 -177.063 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 62.6 pttt -60.71 -37.44 81.69 Favored 'General case' 0 CA--C 1.554 1.114 0 C-N-CA 123.994 0.917 . . . . 0.0 111.93 179.459 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 61.5 t30 -72.75 -36.68 67.75 Favored 'General case' 0 N--CA 1.48 1.056 0 C-N-CA 123.376 0.67 . . . . 0.0 110.456 179.485 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 69' ' ' VAL . . . . . 0.426 HG11 ' HA ' ' A' ' 62' ' ' LEU . 57.8 t -66.25 -36.4 77.31 Favored 'Isoleucine or valine' 0 C--O 1.214 -0.789 0 CA-C-N 115.562 -0.745 . . . . 0.0 109.621 173.017 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -67.52 -15.42 63.65 Favored 'General case' 0 N--CA 1.478 0.962 0 C-N-CA 123.963 0.905 . . . . 0.0 113.349 -174.317 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 21.2 ptmt -94.65 -19.99 19.95 Favored 'General case' 0 N--CA 1.481 1.077 0 O-C-N 121.617 -0.677 . . . . 0.0 111.872 177.691 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 9.0 t -112.84 -15.07 12.99 Favored 'General case' 0 N--CA 1.484 1.23 0 C-N-CA 123.155 0.582 . . . . 0.0 111.716 -176.574 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -110.91 101.56 10.13 Favored 'General case' 0 C--O 1.24 0.56 0 C-N-CA 124.139 0.976 . . . . 0.0 108.41 178.892 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 74' ' ' ASN . . . . . 0.439 ' HA ' ' HZ3' ' A' ' 41' ' ' LYS . 26.1 p-10 -72.06 160.76 31.93 Favored 'General case' 0 CA--C 1.534 0.353 0 CA-C-N 116.242 -0.436 . . . . 0.0 110.277 177.009 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . 0.468 ' HD3' ' O ' ' A' ' 34' ' ' LEU . 36.8 ttmt -63.84 -33.28 75.34 Favored 'General case' 0 CA--C 1.543 0.704 0 C-N-CA 123.549 0.74 . . . . 0.0 111.708 -173.883 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 21.6 t70 -62.81 -33.18 74.69 Favored 'General case' 0 N--CA 1.485 1.321 0 C-N-CA 123.638 0.775 . . . . 0.0 110.857 178.985 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 40.9 t60 -70.63 -36.89 73.7 Favored 'General case' 0 N--CA 1.477 0.912 0 C-N-CA 124.603 1.161 . . . . 0.0 110.468 174.499 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 60.8 mt -71.03 -31.24 67.67 Favored 'General case' 0 N--CA 1.483 1.179 0 C-N-CA 123.137 0.575 . . . . 0.0 111.577 -177.561 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 79' ' ' VAL . . . . . 0.409 HG23 ' O ' ' A' ' 75' ' ' LYS . 99.5 t -64.03 -44.27 97.74 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.759 0 O-C-N 123.959 0.787 . . . . 0.0 109.355 173.641 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 24.6 m -61.62 -42.79 99.38 Favored 'General case' 0 N--CA 1.474 0.746 0 CA-C-N 115.16 -0.927 . . . . 0.0 110.982 176.304 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -67.4 -39.97 85.58 Favored 'General case' 0 N--CA 1.473 0.698 0 C-N-CA 123.085 0.554 . . . . 0.0 111.04 178.271 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 82' ' ' TYR . . . . . 0.467 ' CD2' HD13 ' A' ' 34' ' ' LEU . 64.5 t80 -62.96 -56.97 12.46 Favored 'General case' 0 N--CA 1.472 0.658 0 C-N-CA 124.047 0.939 . . . . 0.0 110.419 -175.363 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 83' ' ' ASN . . . . . . . . . . . . . 27.8 m-80 -62.83 -40.69 98.2 Favored 'General case' 0 N--CA 1.482 1.141 0 C-N-CA 123.293 0.637 . . . . 0.0 111.25 -176.129 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 13.2 m170 -70.08 -25.49 63.55 Favored 'General case' 0 N--CA 1.481 1.114 0 C-N-CA 123.773 0.829 . . . . 0.0 111.954 -179.465 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 85' ' ' LEU . . . . . 0.437 ' HG ' ' HD2' ' A' ' 91' ' ' PHE . 57.7 tp -56.71 -54.22 48.68 Favored 'General case' 0 N--CA 1.486 1.359 0 CA-C-O 121.912 0.863 . . . . 0.0 110.763 178.809 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 20.1 m-85 -73.88 -32.06 63.43 Favored 'General case' 0 CA--C 1.554 1.114 0 CA-C-N 113.483 -1.689 . . . . 0.0 110.16 -178.605 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 9.7 tp10 -68.85 -23.33 64.23 Favored 'General case' 0 N--CA 1.485 1.292 0 C-N-CA 124.718 1.207 . . . . 0.0 112.285 -174.352 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 19.9 p -128.39 5.24 5.71 Favored 'General case' 0 N--CA 1.487 1.415 0 C-N-CA 123.289 0.636 . . . . 0.0 111.867 179.694 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 14.3 mmmm 60.6 29.71 19.21 Favored 'General case' 0 N--CA 1.487 1.408 0 C-N-CA 124.109 0.964 . . . . 0.0 111.869 175.665 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 90' ' ' ARG . . . . . 0.543 ' HB3' ' HB2' ' A' ' 56' ' ' PHE . 52.2 mtt85 -66.81 -11.19 54.42 Favored 'General case' 0 N--CA 1.496 1.838 0 N-CA-C 114.403 1.26 . . . . 0.0 114.403 -171.079 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 91' ' ' PHE . . . . . 0.55 ' HA ' ' HA2' ' A' ' 52' ' ' GLY . 16.6 p90 -67.74 138.44 56.24 Favored 'General case' 0 CA--C 1.54 0.573 0 N-CA-C 112.484 0.55 . . . . 0.0 112.484 176.852 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 3.8 tmtp? . . . . . 0 CA--C 1.552 1.048 0 C-N-CA 125.153 1.381 . . . . 0.0 109.639 -178.796 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.473 0.69 0 CA-C-O 122.002 0.906 . . . . 0.0 111.592 . . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -84.36 -21.25 30.96 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 114.28 -1.327 . . . . 0.0 110.118 -178.691 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 29' ' ' TRP . . . . . . . . . . . . . 4.5 m-90 -140.94 147.6 39.06 Favored 'General case' 0 N--CA 1.476 0.833 0 C-N-CA 124.439 1.096 . . . . 0.0 109.614 -176.297 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 36.3 p -83.02 174.29 11.01 Favored 'General case' 0 N--CA 1.476 0.857 0 N-CA-C 109.629 -0.508 . . . . 0.0 109.629 169.098 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . 0.564 HG12 HG13 ' A' ' 79' ' ' VAL . 45.5 t -52.26 -45.52 43.85 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.022 0 C-N-CA 123.821 0.848 . . . . 0.0 111.743 179.781 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -66.31 -42.81 87.75 Favored 'General case' 0 N--CA 1.48 1.059 0 C-N-CA 123.238 0.615 . . . . 0.0 111.395 179.051 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 15.7 mm-40 -64.7 -29.07 70.06 Favored 'General case' 0 N--CA 1.482 1.146 0 C-N-CA 123.253 0.621 . . . . 0.0 110.94 179.883 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . 0.449 ' HA ' HD22 ' A' ' 39' ' ' LEU . 79.0 mt -69.53 -53.67 17.9 Favored 'General case' 0 N--CA 1.469 0.522 0 C-N-CA 123.129 0.572 . . . . 0.0 109.772 172.984 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 35' ' ' ARG . . . . . 0.408 ' HG3' ' O ' ' A' ' 31' ' ' VAL . 83.0 mtp180 -65.05 -15.15 62.02 Favored 'General case' 0 N--CA 1.485 1.321 0 C-N-CA 123.937 0.895 . . . . 0.0 112.125 -173.706 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 47.8 t -59.72 117.65 5.21 Favored 'General case' 0 CA--C 1.54 0.587 0 N-CA-C 109.29 -0.633 . . . . 0.0 109.29 169.61 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 11.5 pt-20 -65.65 -16.29 63.59 Favored 'General case' 0 N--CA 1.477 0.884 0 C-N-CA 124.3 1.04 . . . . 0.0 111.893 178.954 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 12.7 mm100 -68.64 -25.68 64.95 Favored 'General case' 0 CA--C 1.545 0.753 0 C-N-CA 123.945 0.898 . . . . 0.0 110.639 173.822 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . 0.449 HD22 ' HA ' ' A' ' 34' ' ' LEU . 26.0 tp -88.65 117.77 68.67 Favored Pre-proline 0 CA--C 1.545 0.755 0 N-CA-C 108.252 -1.018 . . . . 0.0 108.252 171.082 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 34.6 Cg_exo -62.08 143.35 94.73 Favored 'Trans proline' 0 C--N 1.374 1.892 0 C-N-CA 122.776 2.318 . . . . 0.0 112.571 177.522 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 54.3 mtmt -60.61 -36.65 79.1 Favored 'General case' 0 N--CA 1.471 0.613 0 CA-C-N 115.538 -0.756 . . . . 0.0 110.693 174.915 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 61.5 pttt -65.51 -33.98 77.19 Favored 'General case' 0 N--CA 1.473 0.698 0 C-N-CA 123.34 0.656 . . . . 0.0 111.152 178.878 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 27.9 t0 -69.1 -31.63 70.48 Favored 'General case' 0 N--CA 1.476 0.868 0 CA-C-O 121.288 0.566 . . . . 0.0 110.696 -178.775 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 53.7 mt -73.59 -47.12 46.09 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.736 0 CA-C-N 115.667 -0.697 . . . . 0.0 110.351 176.125 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 73.5 mt -59.95 -35.24 59.62 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.184 0 C-N-CA 123.507 0.723 . . . . 0.0 110.498 177.225 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 88.0 tttt -60.27 -42.59 95.69 Favored 'General case' 0 CA--C 1.548 0.896 0 C-N-CA 124.308 1.043 . . . . 0.0 110.708 176.822 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 22.3 t80 -67.03 -47.27 71.9 Favored 'General case' 0 CA--C 1.547 0.841 0 CA-C-N 114.1 -1.409 . . . . 0.0 111.231 176.313 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . 0.536 ' HB3' ' HE2' ' A' ' 56' ' ' PHE . 87.4 mt -70.38 -36.95 74.43 Favored 'General case' 0 N--CA 1.473 0.709 0 C-N-CA 124.056 0.942 . . . . 0.0 112.414 -173.921 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 3.1 pt20 -80.56 -32.24 36.69 Favored 'General case' 0 N--CA 1.478 0.959 0 C-N-CA 122.457 0.303 . . . . 0.0 111.059 -175.556 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 44.4 tt0 -59.87 -37.0 78.08 Favored 'General case' 0 N--CA 1.478 0.96 0 C-N-CA 123.278 0.631 . . . . 0.0 111.053 -176.8 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 81.8 m-70 -106.19 -37.13 6.68 Favored 'General case' 0 N--CA 1.476 0.852 0 CA-C-N 115.609 -0.723 . . . . 0.0 111.247 -176.355 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . 0.476 ' HA2' ' HA ' ' A' ' 91' ' ' PHE . . . -60.26 127.31 43.55 Favored Glycine 0 C--N 1.346 1.128 0 O-C-N 123.924 0.765 . . . . 0.0 113.841 -178.349 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 25.7 t -68.28 168.09 13.11 Favored 'General case' 0 CA--C 1.548 0.88 0 C-N-CA 124.274 1.03 . . . . 0.0 110.948 -179.906 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 19.5 m-20 -57.25 -27.79 62.38 Favored 'General case' 0 N--CA 1.486 1.371 0 C-N-CA 124.156 0.983 . . . . 0.0 112.801 -172.877 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 19.6 p -64.57 -50.62 66.52 Favored 'General case' 0 CA--C 1.548 0.878 0 C-N-CA 123.723 0.809 . . . . 0.0 110.925 174.426 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 56' ' ' PHE . . . . . 0.552 ' HB2' ' HB3' ' A' ' 90' ' ' ARG . 58.9 t80 -61.23 -37.22 82.28 Favored 'General case' 0 N--CA 1.482 1.128 0 C-N-CA 123.959 0.904 . . . . 0.0 110.905 178.398 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 84.9 mt -66.41 -41.79 88.74 Favored 'General case' 0 CA--C 1.54 0.578 0 CA-C-N 114.357 -1.292 . . . . 0.0 110.976 176.85 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -71.08 -27.03 63.32 Favored 'General case' 0 N--CA 1.479 1.011 0 C-N-CA 123.894 0.878 . . . . 0.0 112.5 -179.64 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -61.72 -50.24 73.21 Favored 'General case' 0 CA--C 1.547 0.838 0 C-N-CA 123.675 0.79 . . . . 0.0 112.521 -177.467 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 22.4 t-80 -119.07 14.26 13.1 Favored 'General case' 0 N--CA 1.487 1.411 0 N-CA-C 112.568 0.581 . . . . 0.0 112.568 -179.761 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 50.5 mtpt 55.31 49.51 16.9 Favored 'General case' 0 N--CA 1.482 1.175 0 C-N-CA 123.7 0.8 . . . . 0.0 110.962 -172.917 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . 0.436 ' HA ' HG12 ' A' ' 69' ' ' VAL . 86.7 mt -79.69 -6.99 58.3 Favored 'General case' 0 N--CA 1.48 1.05 0 C-N-CA 123.759 0.824 . . . . 0.0 110.76 176.349 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 1.2 pp -76.12 159.86 30.32 Favored 'General case' 0 N--CA 1.475 0.805 0 C-N-CA 123.945 0.898 . . . . 0.0 110.936 173.225 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 86.14 -160.5 33.56 Favored Glycine 0 C--N 1.343 0.947 0 CA-C-N 115.524 -0.762 . . . . 0.0 113.2 179.212 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 16.5 m120 -63.5 123.56 19.09 Favored 'General case' 0 N--CA 1.474 0.73 0 C-N-CA 123.209 0.604 . . . . 0.0 110.4 179.622 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 53.3 mt -56.49 -46.29 82.24 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.657 0 C-N-CA 124.599 1.16 . . . . 0.0 111.73 -175.006 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 62.7 pttt -58.84 -37.43 76.44 Favored 'General case' 0 CA--C 1.556 1.182 0 C-N-CA 123.855 0.862 . . . . 0.0 111.537 178.516 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 5.9 m-20 -70.42 -31.22 68.32 Favored 'General case' 0 N--CA 1.481 1.088 0 C-N-CA 124.201 1.0 . . . . 0.0 110.62 179.695 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 69' ' ' VAL . . . . . 0.436 HG12 ' HA ' ' A' ' 62' ' ' LEU . 30.7 t -74.28 -37.19 45.09 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.937 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.064 172.289 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -68.3 -21.66 64.77 Favored 'General case' 0 N--CA 1.484 1.256 0 C-N-CA 124.059 0.944 . . . . 0.0 112.765 -174.608 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 20.9 ptmt -83.0 -18.14 40.9 Favored 'General case' 0 N--CA 1.482 1.163 0 C-N-CA 122.758 0.423 . . . . 0.0 111.442 179.714 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 8.9 t -114.11 -5.67 13.08 Favored 'General case' 0 N--CA 1.478 0.969 0 C-N-CA 123.762 0.825 . . . . 0.0 110.605 179.471 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -95.35 131.7 41.17 Favored 'General case' 0 N--CA 1.47 0.537 0 C-N-CA 123.504 0.722 . . . . 0.0 110.378 177.555 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 30.7 t30 -97.14 145.04 26.4 Favored 'General case' 0 C--O 1.242 0.677 0 N-CA-C 108.169 -1.048 . . . . 0.0 108.169 170.37 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 4.6 tppp? -55.85 -43.94 77.56 Favored 'General case' 0 N--CA 1.474 0.748 0 C-N-CA 124.044 0.938 . . . . 0.0 111.754 -178.693 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 22.3 t70 -57.97 -44.03 86.84 Favored 'General case' 0 N--CA 1.479 0.98 0 C-N-CA 123.758 0.823 . . . . 0.0 111.633 -177.842 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 26.2 t60 -75.38 -26.37 58.41 Favored 'General case' 0 N--CA 1.473 0.702 0 C-N-CA 122.639 0.375 . . . . 0.0 111.085 179.729 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 67.6 mt -68.16 -31.11 70.44 Favored 'General case' 0 N--CA 1.486 1.332 0 CA-C-N 118.225 0.466 . . . . 0.0 111.931 176.026 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 79' ' ' VAL . . . . . 0.564 HG13 HG12 ' A' ' 31' ' ' VAL . 97.0 t -69.65 -39.73 78.55 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.734 0 CA-C-N 115.565 -0.743 . . . . 0.0 109.66 171.169 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 37.4 m -63.37 -40.25 96.74 Favored 'General case' 0 CA--C 1.547 0.848 0 C-N-CA 123.524 0.73 . . . . 0.0 111.204 176.576 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -71.44 -40.64 70.25 Favored 'General case' 0 N--CA 1.476 0.833 0 C-N-CA 123.895 0.878 . . . . 0.0 109.592 178.988 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 82' ' ' TYR . . . . . . . . . . . . . 11.7 t80 -54.49 -54.75 36.84 Favored 'General case' 0 N--CA 1.474 0.731 0 C-N-CA 124.648 1.179 . . . . 0.0 110.762 175.741 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 83' ' ' ASN . . . . . . . . . . . . . 45.1 m-80 -67.46 -40.67 85.36 Favored 'General case' 0 N--CA 1.478 0.933 0 C-N-CA 122.475 0.31 . . . . 0.0 110.997 -176.712 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 38.6 m170 -66.65 -24.62 66.31 Favored 'General case' 0 N--CA 1.483 1.21 0 C-N-CA 123.535 0.734 . . . . 0.0 111.663 178.608 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 85' ' ' LEU . . . . . 0.454 ' HG ' ' HD2' ' A' ' 91' ' ' PHE . 35.4 tp -58.6 -53.83 53.93 Favored 'General case' 0 N--CA 1.482 1.148 0 C-N-CA 123.793 0.837 . . . . 0.0 110.653 177.042 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 86' ' ' PHE . . . . . 0.406 ' HA ' ' HE2' ' A' ' 91' ' ' PHE . 36.6 m-85 -74.85 -29.78 61.15 Favored 'General case' 0 N--CA 1.474 0.729 0 CA-C-N 114.593 -1.185 . . . . 0.0 111.428 -178.896 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 40.7 tt0 -58.78 -47.69 83.85 Favored 'General case' 0 N--CA 1.477 0.887 0 C-N-CA 125.013 1.325 . . . . 0.0 112.831 -173.367 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 30.2 p -120.18 8.59 10.94 Favored 'General case' 0 N--CA 1.477 0.91 0 C-N-CA 123.634 0.774 . . . . 0.0 111.271 -178.043 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 96.6 mttt 54.78 61.78 2.82 Favored 'General case' 0 N--CA 1.477 0.915 0 C-N-CA 124.277 1.031 . . . . 0.0 111.072 -177.108 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 90' ' ' ARG . . . . . 0.552 ' HB3' ' HB2' ' A' ' 56' ' ' PHE . 44.5 mtt85 -75.63 -8.53 57.02 Favored 'General case' 0 N--CA 1.476 0.831 0 CA-C-N 114.06 -1.427 . . . . 0.0 111.807 178.403 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 91' ' ' PHE . . . . . 0.476 ' HA ' ' HA2' ' A' ' 52' ' ' GLY . 23.2 p90 -81.49 162.02 23.41 Favored 'General case' 0 N--CA 1.469 0.524 0 C-N-CA 124.164 0.986 . . . . 0.0 111.11 172.131 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 6.5 tmtm? . . . . . 0 C--O 1.253 1.265 0 CA-C-N 115.045 -0.98 . . . . 0.0 109.003 175.016 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 27' ' ' ARG . . . . . 0.651 HH21 HG23 ' A' ' 30' ' ' THR . 15.4 ttt180 . . . . . 0 CA--C 1.549 0.905 0 CA-C-O 121.279 0.561 . . . . 0.0 110.522 . . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -90.09 -60.01 2.04 Favored 'General case' 0 CA--C 1.549 0.924 0 CA-C-N 114.589 -1.187 . . . . 0.0 109.456 174.852 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 29' ' ' TRP . . . . . . . . . . . . . 3.8 m-90 -89.67 149.54 22.74 Favored 'General case' 0 N--CA 1.474 0.762 0 C-N-CA 124.121 0.969 . . . . 0.0 111.896 -175.672 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 30' ' ' THR . . . . . 0.651 HG23 HH21 ' A' ' 27' ' ' ARG . 66.8 p -82.07 173.67 11.94 Favored 'General case' 0 N--CA 1.471 0.611 0 C-N-CA 123.328 0.651 . . . . 0.0 109.854 168.494 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . 0.482 ' HA ' HD13 ' A' ' 34' ' ' LEU . 69.3 t -58.99 -38.28 72.81 Favored 'Isoleucine or valine' 0 CA--C 1.554 1.1 0 C-N-CA 123.581 0.753 . . . . 0.0 111.381 -179.013 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 11.6 pt-20 -73.49 -36.25 65.75 Favored 'General case' 0 N--CA 1.482 1.158 0 CA-C-N 116.112 -0.494 . . . . 0.0 111.743 178.402 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 99.5 mt-30 -67.13 -28.17 67.92 Favored 'General case' 0 N--CA 1.482 1.134 0 C-N-CA 123.156 0.582 . . . . 0.0 111.33 175.667 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . 0.522 HD12 ' HA ' ' A' ' 79' ' ' VAL . 89.2 mt -68.04 -52.48 34.93 Favored 'General case' 0 N--CA 1.477 0.918 0 C-N-CA 123.355 0.662 . . . . 0.0 110.963 175.463 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 15.5 ptm180 -74.7 -10.92 59.99 Favored 'General case' 0 N--CA 1.485 1.308 0 C-N-CA 123.154 0.582 . . . . 0.0 111.654 -177.606 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 33.3 t -53.7 121.23 7.43 Favored 'General case' 0 N--CA 1.478 0.965 0 C-N-CA 123.619 0.767 . . . . 0.0 110.719 171.302 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 44.1 mt-10 -67.55 -25.82 66.0 Favored 'General case' 0 N--CA 1.477 0.881 0 C-N-CA 124.234 1.014 . . . . 0.0 111.927 -174.634 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 94.8 mt-30 -65.93 -29.45 69.86 Favored 'General case' 0 N--CA 1.479 0.981 0 C-N-CA 123.812 0.845 . . . . 0.0 110.838 177.004 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 44.0 tp -83.05 117.1 67.54 Favored Pre-proline 0 CA--C 1.549 0.905 0 N-CA-C 107.749 -1.204 . . . . 0.0 107.749 170.88 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 15.9 Cg_exo -70.99 163.73 38.21 Favored 'Trans proline' 0 C--N 1.372 1.791 0 C-N-CA 122.844 2.363 . . . . 0.0 113.272 177.864 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 37.1 mtmm -68.24 -42.48 79.66 Favored 'General case' 0 N--CA 1.475 0.775 0 CA-C-N 115.537 -0.756 . . . . 0.0 110.587 175.984 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 55.2 pttt -61.41 -28.95 69.62 Favored 'General case' 0 N--CA 1.48 1.048 0 C-N-CA 123.947 0.899 . . . . 0.0 111.505 -179.216 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 6.5 t70 -70.81 -43.37 68.76 Favored 'General case' 0 CA--C 1.545 0.779 0 C-N-CA 122.598 0.359 . . . . 0.0 110.469 -179.158 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 27.9 mt -72.3 -45.68 60.08 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.122 0 C-N-CA 122.678 0.391 . . . . 0.0 110.388 179.941 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 45' ' ' ILE . . . . . 0.431 HD11 ' HB3' ' A' ' 70' ' ' ALA . 98.2 mt -58.89 -39.54 77.91 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.556 0 C-N-CA 123.366 0.667 . . . . 0.0 110.915 177.757 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 46' ' ' LYS . . . . . 0.403 ' O ' ' HB2' ' A' ' 50' ' ' GLU . 62.6 tttm -62.28 -46.72 87.54 Favored 'General case' 0 N--CA 1.473 0.723 0 C-N-CA 123.057 0.543 . . . . 0.0 110.347 175.887 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 20.5 t80 -58.56 -51.11 71.26 Favored 'General case' 0 N--CA 1.476 0.866 0 O-C-N 124.362 1.039 . . . . 0.0 110.569 -179.752 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 95.3 mt -70.87 -31.33 67.97 Favored 'General case' 0 N--CA 1.468 0.466 0 CA-C-N 115.536 -0.756 . . . . 0.0 112.084 -173.746 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 1.9 pt20 -81.2 -26.35 36.02 Favored 'General case' 0 N--CA 1.481 1.093 0 N-CA-C 110.079 -0.341 . . . . 0.0 110.079 176.871 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . 0.403 ' HB2' ' O ' ' A' ' 46' ' ' LYS . 7.6 tp10 -59.68 -33.57 71.74 Favored 'General case' 0 N--CA 1.474 0.758 0 C-N-CA 123.694 0.798 . . . . 0.0 110.964 -178.057 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 54.8 p-80 -132.09 -20.18 2.48 Favored 'General case' 0 N--CA 1.479 0.983 0 CA-C-O 117.858 -1.068 . . . . 0.0 113.573 -176.29 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . 0.455 ' HA2' ' HA ' ' A' ' 91' ' ' PHE . . . -67.24 144.97 45.39 Favored Glycine 0 N--CA 1.48 1.575 0 CA-C-N 119.447 1.022 . . . . 0.0 112.362 177.876 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 53.7 m -77.73 163.08 26.47 Favored 'General case' 0 N--CA 1.486 1.344 0 CA-C-N 117.546 0.673 . . . . 0.0 111.92 -177.114 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 9.1 m-20 -54.29 -43.41 71.04 Favored 'General case' 0 N--CA 1.485 1.295 0 C-N-CA 124.533 1.133 . . . . 0.0 113.199 -170.42 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 34.5 t -68.21 -40.71 82.04 Favored 'General case' 0 N--CA 1.479 1.019 0 C-N-CA 123.38 0.672 . . . . 0.0 111.223 -176.224 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 89.8 t80 -63.49 -48.08 79.1 Favored 'General case' 0 N--CA 1.478 0.954 0 C-N-CA 123.257 0.623 . . . . 0.0 109.713 177.386 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 63.6 mt -65.02 -32.45 74.18 Favored 'General case' 0 C--O 1.22 -0.487 0 CA-C-N 115.173 -0.921 . . . . 0.0 111.18 -178.205 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -70.17 -48.43 57.32 Favored 'General case' 0 N--CA 1.475 0.82 0 C-N-CA 123.313 0.645 . . . . 0.0 110.813 179.276 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 55.2 mt-10 -61.66 -36.59 81.26 Favored 'General case' 0 N--CA 1.481 1.078 0 C-N-CA 123.23 0.612 . . . . 0.0 111.947 -179.866 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 94.5 m-70 -99.27 -4.05 32.77 Favored 'General case' 0 N--CA 1.481 1.093 0 C-N-CA 122.517 0.327 . . . . 0.0 111.866 -178.444 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 33.8 mmtp 61.18 30.34 19.26 Favored 'General case' 0 N--CA 1.495 1.807 0 C-N-CA 124.177 0.991 . . . . 0.0 112.108 179.747 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 80.4 mt -80.3 -13.49 59.15 Favored 'General case' 0 N--CA 1.482 1.165 0 C-N-CA 124.177 0.991 . . . . 0.0 111.564 179.653 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -74.33 179.78 4.37 Favored 'General case' 0 N--CA 1.485 1.317 0 C-N-CA 123.484 0.713 . . . . 0.0 111.822 177.644 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 76.43 -160.0 50.51 Favored Glycine 0 C--N 1.342 0.891 0 CA-C-N 115.362 -0.835 . . . . 0.0 113.239 175.734 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 13.3 m120 -67.98 113.51 5.74 Favored 'General case' 0 N--CA 1.479 0.992 0 C-N-CA 123.087 0.555 . . . . 0.0 109.928 -178.88 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 44.2 mt -51.99 -53.06 19.62 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.116 0 C-N-CA 125.313 1.445 . . . . 0.0 112.287 -172.159 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 41.8 mtmt -64.25 -38.41 90.94 Favored 'General case' 0 N--CA 1.482 1.14 0 C-N-CA 124.257 1.023 . . . . 0.0 111.428 -175.674 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 50.6 t30 -66.02 -39.86 90.58 Favored 'General case' 0 N--CA 1.481 1.091 0 C-N-CA 124.113 0.965 . . . . 0.0 110.894 178.49 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 69' ' ' VAL . . . . . 0.408 HG13 HD13 ' A' ' 45' ' ' ILE . 97.5 t -67.39 -39.53 82.86 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.878 0 CA-C-N 115.853 -0.612 . . . . 0.0 109.597 174.129 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 70' ' ' ALA . . . . . 0.431 ' HB3' HD11 ' A' ' 45' ' ' ILE . . . -81.77 12.23 4.15 Favored 'General case' 0 N--CA 1.483 1.209 0 C-N-CA 124.216 1.006 . . . . 0.0 111.743 179.568 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 65.4 tttp -94.43 -31.03 14.15 Favored 'General case' 0 CA--C 1.544 0.731 0 C-N-CA 124.148 0.979 . . . . 0.0 110.123 170.985 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 8.8 t -122.28 -19.86 6.35 Favored 'General case' 0 N--CA 1.482 1.167 0 N-CA-C 112.667 0.618 . . . . 0.0 112.667 -170.759 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -77.89 148.41 34.61 Favored 'General case' 0 N--CA 1.477 0.893 0 C-N-CA 122.794 0.438 . . . . 0.0 109.848 176.771 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 9.4 p30 -98.76 163.87 12.45 Favored 'General case' 0 N--CA 1.483 1.203 0 C-N-CA 122.587 0.355 . . . . 0.0 110.4 176.422 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 19.0 tptm -71.59 -39.39 70.58 Favored 'General case' 0 N--CA 1.478 0.953 0 C-N-CA 123.658 0.783 . . . . 0.0 111.357 -172.75 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 25.2 t70 -63.69 -33.08 74.84 Favored 'General case' 0 N--CA 1.483 1.217 0 C-N-CA 124.412 1.085 . . . . 0.0 111.088 -176.435 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 69.5 t60 -58.43 -43.82 88.88 Favored 'General case' 0 N--CA 1.475 0.786 0 C-N-CA 124.891 1.276 . . . . 0.0 110.26 173.416 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 56.7 mt -68.56 -31.53 70.81 Favored 'General case' 0 N--CA 1.476 0.834 0 CA-C-N 115.389 -0.823 . . . . 0.0 112.076 -174.907 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 79' ' ' VAL . . . . . 0.522 ' HA ' HD12 ' A' ' 34' ' ' LEU . 53.7 t -65.1 -48.45 83.77 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.883 0 O-C-N 124.114 0.884 . . . . 0.0 109.775 177.263 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 56.8 m -62.8 -44.52 95.95 Favored 'General case' 0 N--CA 1.474 0.771 0 CA-C-N 115.193 -0.912 . . . . 0.0 111.58 178.309 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -64.39 -48.24 76.17 Favored 'General case' 0 N--CA 1.476 0.838 0 C-N-CA 123.37 0.668 . . . . 0.0 110.557 -179.137 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 82' ' ' TYR . . . . . 0.625 ' HH ' ' HG3' ' A' ' 27' ' ' ARG . 74.0 t80 -53.59 -57.44 10.74 Favored 'General case' 0 N--CA 1.471 0.59 0 C-N-CA 124.288 1.035 . . . . 0.0 111.136 -178.133 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 83' ' ' ASN . . . . . . . . . . . . . 46.5 m-80 -66.76 -28.25 68.25 Favored 'General case' 0 N--CA 1.478 0.966 0 CA-C-N 115.359 -0.837 . . . . 0.0 111.913 -172.652 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 10.6 m170 -77.47 -28.47 52.31 Favored 'General case' 0 N--CA 1.482 1.129 0 C-N-CA 123.155 0.582 . . . . 0.0 111.927 177.6 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 34.2 tp -59.89 -53.03 62.69 Favored 'General case' 0 N--CA 1.492 1.657 0 CA-C-O 121.571 0.701 . . . . 0.0 111.21 -177.518 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 86' ' ' PHE . . . . . 0.402 ' HA ' ' HE2' ' A' ' 91' ' ' PHE . 34.5 m-85 -73.9 -29.82 62.26 Favored 'General case' 0 N--CA 1.47 0.556 0 CA-C-N 113.993 -1.458 . . . . 0.0 110.743 -176.074 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 13.9 tp10 -69.19 -36.99 77.9 Favored 'General case' 0 N--CA 1.471 0.616 0 C-N-CA 123.532 0.733 . . . . 0.0 110.957 -176.7 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 60.5 p -106.92 0.49 23.87 Favored 'General case' 0 N--CA 1.478 0.935 0 C-N-CA 123.967 0.907 . . . . 0.0 111.683 -177.561 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 74.4 mmtt 61.88 27.15 16.51 Favored 'General case' 0 N--CA 1.489 1.475 0 C-N-CA 124.49 1.116 . . . . 0.0 112.24 174.919 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 54.2 mtt180 -73.46 4.58 4.62 Favored 'General case' 0 N--CA 1.492 1.628 0 N-CA-C 114.056 1.132 . . . . 0.0 114.056 -172.967 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 91' ' ' PHE . . . . . 0.455 ' HA ' ' HA2' ' A' ' 52' ' ' GLY . 5.8 p90 -70.43 141.92 52.05 Favored 'General case' 0 CA--C 1.551 0.995 0 CA-C-O 121.343 0.592 . . . . 0.0 111.783 169.955 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 13.6 tptp . . . . . 0 C--O 1.25 1.097 0 C-N-CA 127.753 2.421 . . . . 0.0 112.688 -176.856 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 27' ' ' ARG . . . . . 0.443 ' HD3' ' H ' ' A' ' 27' ' ' ARG . 0.0 OUTLIER . . . . . 0 CA--C 1.537 0.462 0 CA-C-O 121.54 0.686 . . . . 0.0 109.941 . . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -79.05 -35.08 43.14 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 114.605 -1.18 . . . . 0.0 110.613 -174.14 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 29' ' ' TRP . . . . . 0.495 ' HB3' ' HB2' ' A' ' 33' ' ' GLN . 3.2 m-90 -115.0 145.89 41.8 Favored 'General case' 0 N--CA 1.472 0.666 0 CA-C-N 115.16 -0.927 . . . . 0.0 110.57 -172.618 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 49.2 p -93.07 174.58 7.16 Favored 'General case' 0 CA--C 1.544 0.729 0 C-N-CA 123.68 0.792 . . . . 0.0 108.865 168.438 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . 0.513 ' HA ' HD11 ' A' ' 34' ' ' LEU . 7.1 p -58.89 -35.66 57.53 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.277 0 C-N-CA 122.907 0.483 . . . . 0.0 112.19 -174.471 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 9.0 pt-20 -66.07 -42.16 89.77 Favored 'General case' 0 N--CA 1.48 1.051 0 C-N-CA 123.657 0.783 . . . . 0.0 111.262 176.695 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 33' ' ' GLN . . . . . 0.495 ' HB2' ' HB3' ' A' ' 29' ' ' TRP . 12.4 mm100 -63.9 -42.34 97.46 Favored 'General case' 0 N--CA 1.477 0.918 0 C-N-CA 123.021 0.528 . . . . 0.0 110.085 178.209 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . 0.513 HD11 ' HA ' ' A' ' 31' ' ' VAL . 70.2 mt -63.23 -49.57 73.65 Favored 'General case' 0 N--CA 1.472 0.649 0 O-C-N 124.485 1.116 . . . . 0.0 111.17 -176.943 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 11.5 ptp180 -73.07 -16.84 61.47 Favored 'General case' 0 N--CA 1.48 1.052 0 O-C-N 124.046 0.841 . . . . 0.0 111.636 -175.166 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 13.4 t -69.46 122.46 19.04 Favored 'General case' 0 CA--C 1.55 0.965 0 N-CA-C 109.514 -0.55 . . . . 0.0 109.514 -178.825 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . 0.4 ' HA ' ' HE2' ' A' ' 75' ' ' LYS . 60.1 mm-40 -63.65 -22.16 66.76 Favored 'General case' 0 N--CA 1.481 1.094 0 C-N-CA 123.903 0.881 . . . . 0.0 113.017 -174.833 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 29.3 pt20 -68.15 -21.69 64.9 Favored 'General case' 0 N--CA 1.482 1.125 0 C-N-CA 123.292 0.637 . . . . 0.0 111.636 179.541 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 2.4 tt -81.26 121.56 80.44 Favored Pre-proline 0 CA--C 1.553 1.091 0 N-CA-C 107.005 -1.48 . . . . 0.0 107.005 174.103 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_exo -56.78 126.1 21.17 Favored 'Trans proline' 0 C--N 1.381 2.254 0 C-N-CA 122.804 2.336 . . . . 0.0 111.972 173.399 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 41' ' ' LYS . . . . . 0.457 ' HB2' HD13 ' A' ' 78' ' ' LEU . 9.6 ptpp? -58.74 -34.24 71.16 Favored 'General case' 0 N--CA 1.48 1.029 0 C-N-CA 123.261 0.624 . . . . 0.0 111.194 179.925 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 21.3 ptmt -66.49 -33.17 75.08 Favored 'General case' 0 N--CA 1.472 0.669 0 C-N-CA 124.183 0.993 . . . . 0.0 111.849 179.538 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 32.5 t70 -68.1 -33.12 73.92 Favored 'General case' 0 N--CA 1.476 0.871 0 C-N-CA 123.599 0.76 . . . . 0.0 110.33 -178.007 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 53.8 mt -70.17 -46.86 70.65 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.079 0 CA-C-N 115.657 -0.701 . . . . 0.0 109.916 175.266 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 74.6 mt -57.86 -35.77 52.88 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.492 0 C-N-CA 123.199 0.599 . . . . 0.0 110.872 176.882 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 88.6 tttt -65.79 -41.85 91.44 Favored 'General case' 0 CA--C 1.546 0.79 0 C-N-CA 123.306 0.642 . . . . 0.0 110.983 178.756 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 27.2 t80 -57.21 -48.43 78.81 Favored 'General case' 0 N--CA 1.489 1.52 0 C-N-CA 123.278 0.631 . . . . 0.0 110.085 172.892 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . 0.443 ' HB3' ' HE2' ' A' ' 56' ' ' PHE . 96.4 mt -66.77 -35.4 80.0 Favored 'General case' 0 CA--C 1.539 0.553 0 CA-C-N 114.259 -1.337 . . . . 0.0 112.144 -174.111 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . 0.435 ' HA ' ' CD2' ' A' ' 57' ' ' LEU . 3.5 pt20 -82.75 -34.77 27.05 Favored 'General case' 0 N--CA 1.482 1.133 0 CA-C-N 117.903 0.32 . . . . 0.0 111.234 179.25 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 44.5 tt0 -67.47 -37.51 83.01 Favored 'General case' 0 N--CA 1.477 0.895 0 C-N-CA 123.108 0.563 . . . . 0.0 111.247 -177.642 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 97.1 m-70 -108.16 -40.43 5.2 Favored 'General case' 0 N--CA 1.48 1.032 0 CA-C-N 115.679 -0.691 . . . . 0.0 111.822 -171.75 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . 0.526 ' HA2' ' HA ' ' A' ' 91' ' ' PHE . . . -63.88 136.54 41.05 Favored Glycine 0 C--N 1.345 1.031 0 O-C-N 123.596 0.56 . . . . 0.0 113.016 175.178 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 53' ' ' SER . . . . . 0.416 ' O ' ' HG ' ' A' ' 57' ' ' LEU . 9.1 t -73.09 172.64 10.67 Favored 'General case' 0 N--CA 1.476 0.851 0 C-N-CA 123.553 0.741 . . . . 0.0 110.309 -177.988 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 4.3 m-20 -55.0 -39.46 69.07 Favored 'General case' 0 N--CA 1.488 1.467 0 C-N-CA 123.845 0.858 . . . . 0.0 111.356 -177.625 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 22.7 t -63.85 -30.72 71.78 Favored 'General case' 0 N--CA 1.479 1.002 0 CA-C-N 114.932 -1.031 . . . . 0.0 111.71 -179.269 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 56' ' ' PHE . . . . . 0.586 ' HB2' ' HB3' ' A' ' 90' ' ' ARG . 46.3 t80 -75.48 -41.9 54.33 Favored 'General case' 0 N--CA 1.473 0.677 0 C-N-CA 123.102 0.561 . . . . 0.0 110.947 176.449 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . 0.435 ' CD2' ' HA ' ' A' ' 49' ' ' GLN . 20.8 mt -74.24 -49.09 24.73 Favored 'General case' 0 N--CA 1.472 0.629 0 CA-C-N 115.094 -0.957 . . . . 0.0 112.077 -168.541 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -61.4 -48.15 82.56 Favored 'General case' 0 N--CA 1.478 0.95 0 C-N-CA 123.383 0.673 . . . . 0.0 111.319 -177.346 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 14.1 mm-40 -60.37 -30.15 69.39 Favored 'General case' 0 N--CA 1.484 1.26 0 C-N-CA 123.521 0.728 . . . . 0.0 112.768 -178.997 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 35.3 m80 -113.18 0.9 15.06 Favored 'General case' 0 N--CA 1.488 1.426 0 N-CA-C 112.331 0.493 . . . . 0.0 112.331 -175.802 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 75.4 mmtt 55.71 44.68 25.93 Favored 'General case' 0 N--CA 1.486 1.34 0 C-N-CA 124.591 1.156 . . . . 0.0 111.729 178.761 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 85.2 mt -95.33 -11.23 28.15 Favored 'General case' 0 N--CA 1.481 1.094 0 C-N-CA 123.994 0.918 . . . . 0.0 111.455 179.605 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -79.96 171.97 14.39 Favored 'General case' 0 N--CA 1.482 1.14 0 C-N-CA 123.176 0.59 . . . . 0.0 111.42 176.657 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 85.62 -153.42 27.29 Favored Glycine 0 C--N 1.34 0.796 0 CA-C-N 114.751 -1.113 . . . . 0.0 112.53 178.418 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 12.5 m120 -69.79 118.52 12.75 Favored 'General case' 0 N--CA 1.469 0.483 0 N-CA-C 108.948 -0.76 . . . . 0.0 108.948 175.364 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 59.0 mt -55.43 -39.19 51.92 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.066 0 C-N-CA 123.94 0.896 . . . . 0.0 110.813 -177.883 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 58.2 pttt -53.74 -42.88 68.62 Favored 'General case' 0 N--CA 1.485 1.311 0 C-N-CA 124.145 0.978 . . . . 0.0 112.48 178.175 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 3.8 m-20 -59.64 -41.62 90.91 Favored 'General case' 0 N--CA 1.489 1.477 0 C-N-CA 123.997 0.919 . . . . 0.0 110.404 179.257 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 21.5 t -71.22 -44.86 73.13 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.073 0 CA-C-N 113.893 -1.503 . . . . 0.0 109.996 179.307 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -82.1 7.12 14.27 Favored 'General case' 0 N--CA 1.485 1.317 0 C-N-CA 124.726 1.211 . . . . 0.0 113.441 -168.242 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 21.1 ptmt -95.26 -18.69 20.64 Favored 'General case' 0 N--CA 1.482 1.137 0 O-C-N 121.907 -0.496 . . . . 0.0 111.079 172.109 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 13.0 t -133.05 -14.09 2.71 Favored 'General case' 0 CA--C 1.553 1.077 0 C-N-CA 123.257 0.623 . . . . 0.0 112.53 -173.668 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -84.17 99.85 10.78 Favored 'General case' 0 C--O 1.244 0.796 0 N-CA-C 108.692 -0.855 . . . . 0.0 108.692 176.827 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 32.4 p30 -68.65 163.45 23.76 Favored 'General case' 0 CA--C 1.539 0.53 0 CA-C-N 115.826 -0.624 . . . . 0.0 110.132 178.819 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . 0.713 ' HB2' ' HZ3' ' A' ' 75' ' ' LYS . 3.5 ttmp? -67.61 -26.75 66.41 Favored 'General case' 0 CA--C 1.548 0.883 0 C-N-CA 123.053 0.541 . . . . 0.0 110.985 -173.686 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 20.8 t70 -61.9 -41.37 97.82 Favored 'General case' 0 CA--C 1.552 1.037 0 C-N-CA 124.463 1.105 . . . . 0.0 110.966 173.741 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 17.4 t60 -62.84 -36.76 84.28 Favored 'General case' 0 N--CA 1.484 1.249 0 C-N-CA 125.292 1.437 . . . . 0.0 109.653 -179.075 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . 0.457 HD13 ' HB2' ' A' ' 41' ' ' LYS . 48.3 mt -75.06 -36.64 61.8 Favored 'General case' 0 N--CA 1.47 0.537 0 CA-C-N 114.584 -1.189 . . . . 0.0 111.922 -172.863 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 61.9 t -67.39 -41.97 86.86 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.899 0 O-C-N 123.82 0.7 . . . . 0.0 109.699 173.182 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 22.9 m -60.22 -43.56 95.92 Favored 'General case' 0 N--CA 1.482 1.132 0 C-N-CA 123.237 0.615 . . . . 0.0 110.936 177.171 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -69.73 -43.94 71.32 Favored 'General case' 0 N--CA 1.473 0.705 0 C-N-CA 123.523 0.729 . . . . 0.0 111.019 179.077 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 82' ' ' TYR . . . . . . . . . . . . . 18.0 t80 -53.62 -55.93 21.54 Favored 'General case' 0 N--CA 1.479 1.017 0 C-N-CA 124.202 1.001 . . . . 0.0 110.598 178.765 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 83' ' ' ASN . . . . . . . . . . . . . 34.2 m-80 -66.28 -41.54 89.71 Favored 'General case' 0 N--CA 1.476 0.849 0 C-N-CA 122.627 0.371 . . . . 0.0 110.822 -175.948 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 84' ' ' HIS . . . . . 0.48 ' HA ' ' HB3' ' A' ' 87' ' ' GLU . 46.1 m170 -64.5 -26.72 68.55 Favored 'General case' 0 N--CA 1.479 0.993 0 C-N-CA 123.169 0.588 . . . . 0.0 111.837 178.779 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 85' ' ' LEU . . . . . 0.402 ' HG ' ' HD2' ' A' ' 91' ' ' PHE . 56.4 tp -58.33 -54.45 46.84 Favored 'General case' 0 N--CA 1.48 1.056 0 CA-C-O 121.711 0.767 . . . . 0.0 110.179 177.796 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 86' ' ' PHE . . . . . 0.437 ' CZ ' ' HB3' ' A' ' 27' ' ' ARG . 27.1 m-85 -75.63 -26.5 57.83 Favored 'General case' 0 CA--C 1.546 0.821 0 CA-C-N 114.273 -1.33 . . . . 0.0 111.308 179.876 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 87' ' ' GLU . . . . . 0.48 ' HB3' ' HA ' ' A' ' 84' ' ' HIS . 14.9 tp10 -69.55 -25.67 64.12 Favored 'General case' 0 N--CA 1.484 1.262 0 C-N-CA 124.204 1.002 . . . . 0.0 111.745 -176.523 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 39.0 p -123.89 0.86 8.65 Favored 'General case' 0 N--CA 1.474 0.75 0 C-N-CA 123.385 0.674 . . . . 0.0 110.837 179.215 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 34.5 mmtp 54.57 40.05 31.58 Favored 'General case' 0 N--CA 1.483 1.213 0 C-N-CA 124.083 0.953 . . . . 0.0 110.606 -177.109 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 90' ' ' ARG . . . . . 0.586 ' HB3' ' HB2' ' A' ' 56' ' ' PHE . 28.5 mtt180 -73.08 -7.69 52.42 Favored 'General case' 0 N--CA 1.487 1.381 0 C-N-CA 125.323 1.449 . . . . 0.0 113.352 -174.544 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 91' ' ' PHE . . . . . 0.526 ' HA ' ' HA2' ' A' ' 52' ' ' GLY . 3.2 p90 -68.75 164.72 21.13 Favored 'General case' 0 N--CA 1.476 0.86 0 C-N-CA 123.398 0.679 . . . . 0.0 111.347 168.377 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 24.2 ttpp . . . . . 0 CA--C 1.556 1.19 0 O-C-N 124.567 1.167 . . . . 0.0 110.451 171.896 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 40.4 ttp180 . . . . . 0 CA--C 1.549 0.935 0 CA-C-O 121.351 0.596 . . . . 0.0 110.779 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -94.99 -19.6 20.07 Favored 'General case' 0 CA--C 1.549 0.925 0 CA-C-N 114.664 -1.153 . . . . 0.0 111.604 178.621 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 29' ' ' TRP . . . . . . . . . . . . . 2.9 m-90 -135.98 135.0 39.18 Favored 'General case' 0 N--CA 1.483 1.182 0 C-N-CA 124.187 0.995 . . . . 0.0 108.949 -172.705 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 82.1 p -75.63 170.34 16.36 Favored 'General case' 0 CA--C 1.545 0.783 0 N-CA-C 109.804 -0.443 . . . . 0.0 109.804 178.161 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . 0.43 HG23 HD22 ' A' ' 83' ' ' ASN . 91.2 t -59.17 -37.52 68.96 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.273 0 C-N-CA 122.391 0.276 . . . . 0.0 111.186 -177.042 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 10.7 pt-20 -69.09 -34.24 74.79 Favored 'General case' 0 N--CA 1.48 1.072 0 C-N-CA 123.49 0.716 . . . . 0.0 110.918 178.15 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 79.4 mt-30 -70.16 -33.81 72.23 Favored 'General case' 0 N--CA 1.477 0.892 0 C-N-CA 123.005 0.522 . . . . 0.0 110.397 176.233 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . 0.434 HD11 ' CD2' ' A' ' 82' ' ' TYR . 76.2 mt -64.36 -53.7 44.57 Favored 'General case' 0 N--CA 1.477 0.901 0 N-CA-C 109.305 -0.628 . . . . 0.0 109.305 175.651 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 75.9 mtp180 -71.01 -12.02 61.3 Favored 'General case' 0 N--CA 1.477 0.889 0 CA-C-N 114.468 -1.242 . . . . 0.0 111.466 -177.469 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 44.0 t -57.83 143.2 43.2 Favored 'General case' 0 C--N 1.354 0.777 0 C-N-CA 123.482 0.713 . . . . 0.0 111.468 175.496 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 35.7 mt-10 -80.02 -8.31 59.3 Favored 'General case' 0 CA--C 1.55 0.97 0 CA-C-N 114.765 -1.107 . . . . 0.0 111.205 -178.707 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 28.1 mm-40 -86.36 -38.06 17.82 Favored 'General case' 0 N--CA 1.474 0.746 0 C-N-CA 124.038 0.935 . . . . 0.0 110.676 179.509 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 1.3 tt -82.61 112.93 41.07 Favored Pre-proline 0 N--CA 1.476 0.84 0 N-CA-C 108.328 -0.99 . . . . 0.0 108.328 179.096 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 40' ' ' PRO . . . . . 0.508 ' HB2' ' HG2' ' A' ' 42' ' ' LYS . 79.0 Cg_endo -73.81 148.7 41.52 Favored 'Trans proline' 0 C--N 1.372 1.809 0 C-N-CA 121.933 1.755 . . . . 0.0 111.406 -179.638 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 18.8 ptpt -64.52 -28.27 69.54 Favored 'General case' 0 N--CA 1.472 0.669 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.871 -178.429 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . 0.508 ' HG2' ' HB2' ' A' ' 40' ' ' PRO . 19.8 ptpt -65.08 -33.89 77.11 Favored 'General case' 0 N--CA 1.472 0.653 0 C-N-CA 123.453 0.701 . . . . 0.0 111.387 179.571 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 25.1 t70 -75.37 -31.53 60.52 Favored 'General case' 0 N--CA 1.476 0.845 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.642 -177.515 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 49.4 mt -69.06 -50.18 55.69 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.779 0 N-CA-C 109.657 -0.497 . . . . 0.0 109.657 176.068 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 72.9 mt -57.62 -41.89 80.17 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.335 0 C-N-CA 123.497 0.719 . . . . 0.0 110.468 176.521 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 23.1 tptm -53.46 -46.92 70.09 Favored 'General case' 0 N--CA 1.485 1.307 0 C-N-CA 124.555 1.142 . . . . 0.0 110.85 176.53 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 11.9 t80 -66.49 -47.58 72.56 Favored 'General case' 0 N--CA 1.473 0.686 0 CA-C-N 114.916 -1.038 . . . . 0.0 110.897 -179.478 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 93.2 mt -68.12 -33.44 74.5 Favored 'General case' 0 CA--C 1.541 0.627 0 C-N-CA 122.922 0.489 . . . . 0.0 111.842 -173.225 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 3.6 pt20 -83.5 -25.5 31.04 Favored 'General case' 0 N--CA 1.484 1.271 0 C-N-CA 122.464 0.306 . . . . 0.0 111.592 177.623 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 4.2 tm-20 -54.21 -42.5 69.83 Favored 'General case' 0 N--CA 1.49 1.526 0 C-N-CA 124.327 1.051 . . . . 0.0 111.846 -178.919 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 4.0 p80 -138.74 -20.73 1.01 Allowed 'General case' 0 N--CA 1.481 1.123 0 CA-C-N 116.28 -0.418 . . . . 0.0 112.09 -172.755 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -60.26 135.2 50.18 Favored Glycine 0 C--N 1.352 1.43 0 CA-C-O 119.714 -0.492 . . . . 0.0 112.006 172.032 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 53' ' ' SER . . . . . 0.407 ' O ' ' HG ' ' A' ' 57' ' ' LEU . 32.4 t -62.98 148.09 48.66 Favored 'General case' 0 N--CA 1.471 0.622 0 C-N-CA 123.349 0.66 . . . . 0.0 111.868 -175.495 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 25.5 t70 -59.12 -36.95 76.08 Favored 'General case' 0 N--CA 1.481 1.125 0 C-N-CA 124.005 0.922 . . . . 0.0 112.197 -176.038 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 38.4 m -64.0 -37.53 87.74 Favored 'General case' 0 CA--C 1.549 0.931 0 C-N-CA 123.516 0.726 . . . . 0.0 111.367 177.591 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 52.4 t80 -66.5 -47.26 73.53 Favored 'General case' 0 N--CA 1.481 1.085 0 C-N-CA 123.498 0.719 . . . . 0.0 109.593 173.253 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . 0.407 ' HG ' ' O ' ' A' ' 53' ' ' SER . 76.3 mt -60.16 -33.47 72.22 Favored 'General case' 0 N--CA 1.476 0.874 0 CA-C-N 115.203 -0.908 . . . . 0.0 111.377 -175.427 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -65.03 -48.4 73.98 Favored 'General case' 0 N--CA 1.476 0.839 0 C-N-CA 123.626 0.771 . . . . 0.0 111.538 178.646 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 40.2 mt-10 -62.34 -26.47 68.46 Favored 'General case' 0 N--CA 1.482 1.128 0 CA-C-N 115.222 -0.899 . . . . 0.0 112.039 -178.262 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 72.8 m80 -114.37 1.76 14.51 Favored 'General case' 0 N--CA 1.483 1.197 0 C-N-CA 123.3 0.64 . . . . 0.0 112.241 -176.754 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 49.1 mtmt 62.37 22.82 13.48 Favored 'General case' 0 N--CA 1.497 1.881 0 C-N-CA 125.268 1.427 . . . . 0.0 112.6 178.073 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 89.6 mt -80.1 -10.97 59.8 Favored 'General case' 0 N--CA 1.478 0.926 0 C-N-CA 124.186 0.994 . . . . 0.0 112.312 -177.033 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 1.4 pp -74.4 162.48 28.81 Favored 'General case' 0 N--CA 1.48 1.035 0 CA-C-O 121.322 0.582 . . . . 0.0 111.207 175.298 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 89.23 -159.96 29.09 Favored Glycine 0 C--O 1.242 0.649 0 CA-C-N 115.02 -0.991 . . . . 0.0 112.267 178.683 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 65' ' ' ASN . . . . . 0.456 ' OD1' ' HG2' ' A' ' 67' ' ' LYS . 14.0 t-20 -75.63 139.34 41.96 Favored 'General case' 0 N--CA 1.469 0.481 0 N-CA-C 109.441 -0.578 . . . . 0.0 109.441 -179.447 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 59.7 mt -61.0 -46.41 96.71 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.797 0 O-C-N 123.69 0.619 . . . . 0.0 112.568 -171.261 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 67' ' ' LYS . . . . . 0.456 ' HG2' ' OD1' ' A' ' 65' ' ' ASN . 8.9 ptpp? -60.48 -36.29 77.95 Favored 'General case' 0 N--CA 1.491 1.617 0 CA-C-N 118.334 0.515 . . . . 0.0 110.83 -178.344 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 7.0 t30 -61.42 -40.5 94.63 Favored 'General case' 0 N--CA 1.48 1.028 0 C-N-CA 124.543 1.137 . . . . 0.0 110.975 176.692 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 32.8 t -73.13 -40.22 57.9 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.808 0 CA-C-N 115.223 -0.899 . . . . 0.0 110.441 175.984 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -72.82 -5.89 41.21 Favored 'General case' 0 N--CA 1.484 1.229 0 C-N-CA 124.614 1.166 . . . . 0.0 113.221 -170.332 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . 0.604 ' HB2' ' HZ3' ' A' ' 71' ' ' LYS . 0.0 OUTLIER -90.34 -18.94 24.65 Favored 'General case' 0 CA--C 1.548 0.867 0 C-N-CA 122.209 0.203 . . . . 0.0 110.765 176.278 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 10.1 t -120.08 -15.16 8.78 Favored 'General case' 0 N--CA 1.477 0.876 0 C-N-CA 123.927 0.891 . . . . 0.0 111.354 -178.022 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -90.32 97.37 11.14 Favored 'General case' 0 N--CA 1.475 0.777 0 C-N-CA 123.243 0.617 . . . . 0.0 110.317 179.407 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 74' ' ' ASN . . . . . 0.4 ' ND2' ' HB3' ' A' ' 76' ' ' ASP . 54.4 t30 -66.3 156.7 33.64 Favored 'General case' 0 N--CA 1.477 0.876 0 CA-C-N 115.431 -0.804 . . . . 0.0 109.125 173.077 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . 0.431 ' O ' HG21 ' A' ' 79' ' ' VAL . 2.9 tppp? -64.32 -38.76 92.18 Favored 'General case' 0 CA--C 1.548 0.892 0 N-CA-C 110.186 -0.302 . . . . 0.0 110.186 179.734 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 76' ' ' ASP . . . . . 0.4 ' HB3' ' ND2' ' A' ' 74' ' ' ASN . 31.0 t70 -64.53 -34.82 79.12 Favored 'General case' 0 N--CA 1.484 1.253 0 C-N-CA 124.156 0.982 . . . . 0.0 111.28 175.783 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 17.3 t60 -66.45 -38.63 87.77 Favored 'General case' 0 N--CA 1.487 1.386 0 C-N-CA 123.967 0.907 . . . . 0.0 109.376 174.232 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 71.8 mt -74.42 -26.62 60.18 Favored 'General case' 0 N--CA 1.475 0.793 0 C-N-CA 123.401 0.68 . . . . 0.0 112.326 -178.536 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 79' ' ' VAL . . . . . 0.431 HG21 ' O ' ' A' ' 75' ' ' LYS . 88.1 t -68.79 -44.02 82.34 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.018 0 N-CA-C 109.271 -0.64 . . . . 0.0 109.271 172.79 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 59.9 m -58.11 -51.77 68.33 Favored 'General case' 0 CA--C 1.546 0.79 0 CA-C-N 115.041 -0.981 . . . . 0.0 110.783 175.847 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -65.49 -45.88 81.87 Favored 'General case' 0 N--CA 1.475 0.786 0 C-N-CA 123.483 0.713 . . . . 0.0 111.779 -176.864 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 82' ' ' TYR . . . . . 0.434 ' CD2' HD11 ' A' ' 34' ' ' LEU . 79.8 t80 -58.82 -57.34 13.45 Favored 'General case' 0 N--CA 1.474 0.75 0 C-N-CA 124.289 1.036 . . . . 0.0 110.307 -177.712 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 83' ' ' ASN . . . . . 0.43 HD22 HG23 ' A' ' 31' ' ' VAL . 18.2 m-80 -60.56 -42.1 95.91 Favored 'General case' 0 CA--C 1.549 0.913 0 CA-C-N 115.677 -0.692 . . . . 0.0 111.65 -176.037 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 63.5 m-70 -68.22 -25.24 65.11 Favored 'General case' 0 N--CA 1.481 1.097 0 CA-C-O 118.733 -0.651 . . . . 0.0 112.66 178.78 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 57.1 tp -62.08 -53.5 54.55 Favored 'General case' 0 N--CA 1.49 1.553 0 CA-C-N 118.76 0.709 . . . . 0.0 110.876 178.643 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 24.4 m-85 -75.33 -20.64 58.93 Favored 'General case' 0 N--CA 1.477 0.898 0 CA-C-N 114.613 -1.176 . . . . 0.0 110.868 -177.54 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 34.4 tt0 -69.36 -26.6 64.75 Favored 'General case' 0 N--CA 1.479 1.004 0 C-N-CA 123.316 0.647 . . . . 0.0 111.062 175.988 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 26.3 p -112.26 -21.93 11.18 Favored 'General case' 0 N--CA 1.477 0.92 0 C-N-CA 123.897 0.879 . . . . 0.0 110.914 179.385 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 97.3 mttt 55.1 46.87 23.16 Favored 'General case' 0 N--CA 1.481 1.09 0 C-N-CA 124.985 1.314 . . . . 0.0 112.292 -176.131 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 99.2 mtt180 -71.5 -16.05 62.33 Favored 'General case' 0 N--CA 1.493 1.697 0 C-N-CA 124.144 0.978 . . . . 0.0 112.095 177.973 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 91' ' ' PHE . . . . . . . . . . . . . 54.3 p90 -72.57 161.14 31.17 Favored 'General case' 0 CA--C 1.543 0.681 0 C-N-CA 123.631 0.773 . . . . 0.0 111.904 178.435 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 49.2 pttt . . . . . 0 C--O 1.254 1.294 0 N-CA-C 108.313 -0.995 . . . . 0.0 108.313 165.959 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 CA--C 1.544 0.736 0 CA-C-O 120.837 0.351 . . . . 0.0 110.209 . . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -77.56 -41.76 37.77 Favored 'General case' 0 N--CA 1.47 0.574 0 N-CA-C 109.101 -0.703 . . . . 0.0 109.101 178.192 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 29' ' ' TRP . . . . . . . . . . . . . 10.7 m-90 -138.32 159.68 41.44 Favored 'General case' 0 N--CA 1.477 0.9 0 C-N-CA 124.717 1.207 . . . . 0.0 108.236 175.462 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 67.9 p -85.42 168.55 14.5 Favored 'General case' 0 N--CA 1.483 1.218 0 N-CA-C 108.662 -0.866 . . . . 0.0 108.662 176.525 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 7.2 p -61.0 -39.34 81.86 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.197 0 CA-C-N 118.052 0.387 . . . . 0.0 111.425 -174.859 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -64.26 -35.74 81.83 Favored 'General case' 0 N--CA 1.479 1.015 0 C-N-CA 123.836 0.855 . . . . 0.0 111.42 177.775 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 51.0 mt-30 -69.66 -42.37 74.31 Favored 'General case' 0 C--N 1.353 0.746 0 C-N-CA 123.28 0.632 . . . . 0.0 110.757 175.045 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . 0.424 ' HA ' HD11 ' A' ' 39' ' ' LEU . 89.2 mt -63.51 -53.61 49.23 Favored 'General case' 0 N--CA 1.478 0.974 0 C-N-CA 123.237 0.615 . . . . 0.0 111.094 -175.697 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 8.0 ptm180 -65.01 -22.45 67.0 Favored 'General case' 0 N--CA 1.473 0.719 0 O-C-N 124.176 0.923 . . . . 0.0 112.003 -172.718 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 23.3 t -60.2 132.3 53.49 Favored 'General case' 0 CA--C 1.545 0.756 0 C-N-CA 123.552 0.741 . . . . 0.0 110.457 177.917 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 3.1 mp0 -66.72 -21.15 66.08 Favored 'General case' 0 CA--C 1.546 0.819 0 C-N-CA 123.658 0.783 . . . . 0.0 111.718 -173.395 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 13.8 pt20 -69.47 -29.18 66.79 Favored 'General case' 0 N--CA 1.479 1.011 0 C-N-CA 122.823 0.449 . . . . 0.0 111.211 177.456 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . 0.424 HD11 ' HA ' ' A' ' 34' ' ' LEU . 4.0 tt -86.33 113.09 50.54 Favored Pre-proline 0 N--CA 1.475 0.775 0 N-CA-C 107.967 -1.123 . . . . 0.0 107.967 177.728 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 40' ' ' PRO . . . . . 0.448 ' HB2' ' HG2' ' A' ' 42' ' ' LYS . 98.6 Cg_endo -73.03 149.26 46.41 Favored 'Trans proline' 0 C--N 1.375 1.963 0 C-N-CA 122.509 2.14 . . . . 0.0 112.015 -178.92 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 46.2 mtmt -68.27 -21.12 64.82 Favored 'General case' 0 N--CA 1.472 0.65 0 CA-C-N 114.868 -1.06 . . . . 0.0 112.043 -175.572 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . 0.448 ' HG2' ' HB2' ' A' ' 40' ' ' PRO . 17.3 ptpt -65.08 -34.16 77.76 Favored 'General case' 0 CA--C 1.544 0.747 0 C-N-CA 123.97 0.908 . . . . 0.0 111.149 178.462 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -69.79 -38.79 76.8 Favored 'General case' 0 C--O 1.241 0.616 0 C-N-CA 123.617 0.767 . . . . 0.0 111.161 179.015 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 43.1 mt -68.74 -50.88 51.05 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.596 0 CA-C-N 115.49 -0.777 . . . . 0.0 110.164 -178.457 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 75.7 mt -59.81 -36.09 64.17 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.163 0 C-N-CA 123.277 0.631 . . . . 0.0 110.872 177.471 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 13.4 ttmm -59.48 -48.45 81.62 Favored 'General case' 0 N--CA 1.479 0.996 0 C-N-CA 122.788 0.435 . . . . 0.0 111.023 174.384 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 20.9 t80 -54.88 -45.96 74.71 Favored 'General case' 0 N--CA 1.484 1.254 0 CA-C-O 121.259 0.552 . . . . 0.0 110.73 176.115 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . 0.425 ' HB3' ' HE2' ' A' ' 56' ' ' PHE . 90.8 mt -70.58 -37.93 74.01 Favored 'General case' 0 CA--C 1.544 0.73 0 CA-C-N 115.045 -0.98 . . . . 0.0 112.163 -175.152 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 3.3 pt20 -85.6 -36.43 20.39 Favored 'General case' 0 N--CA 1.489 1.503 0 N-CA-C 113.121 0.786 . . . . 0.0 113.121 -175.935 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 32.5 tt0 -69.1 -37.42 78.41 Favored 'General case' 0 N--CA 1.479 0.991 0 C-N-CA 123.802 0.841 . . . . 0.0 111.599 -170.303 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -141.04 14.0 2.25 Favored 'General case' 0 N--CA 1.48 1.064 0 N-CA-C 113.107 0.78 . . . . 0.0 113.107 -178.93 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -103.9 150.38 17.45 Favored Glycine 0 N--CA 1.478 1.472 0 N-CA-C 110.639 -0.984 . . . . 0.0 110.639 162.564 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 53' ' ' SER . . . . . 0.479 ' O ' ' HG ' ' A' ' 57' ' ' LEU . 80.1 p -68.09 159.25 31.28 Favored 'General case' 0 N--CA 1.485 1.308 0 N-CA-C 113.353 0.871 . . . . 0.0 113.353 -170.137 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 22.1 t70 -66.21 -38.85 88.96 Favored 'General case' 0 N--CA 1.48 1.062 0 C-N-CA 124.514 1.126 . . . . 0.0 111.409 -177.331 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 13.3 t -67.49 -31.06 70.93 Favored 'General case' 0 N--CA 1.478 0.965 0 C-N-CA 123.544 0.738 . . . . 0.0 110.992 -179.364 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 56' ' ' PHE . . . . . 0.435 ' HD1' HH11 ' A' ' 90' ' ' ARG . 27.2 t80 -65.56 -48.81 71.14 Favored 'General case' 0 CA--C 1.548 0.874 0 CA-C-N 115.435 -0.802 . . . . 0.0 110.246 170.753 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . 0.479 ' HG ' ' O ' ' A' ' 53' ' ' SER . 72.1 mt -60.97 -45.4 94.9 Favored 'General case' 0 N--CA 1.481 1.122 0 C-N-CA 122.884 0.473 . . . . 0.0 111.347 -177.674 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -52.74 -26.24 13.53 Favored 'General case' 0 CA--C 1.545 0.752 0 C-N-CA 125.918 1.687 . . . . 0.0 113.734 -175.033 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 57.0 mt-10 -57.08 -49.09 76.93 Favored 'General case' 0 N--CA 1.481 1.118 0 C-N-CA 123.812 0.845 . . . . 0.0 111.789 179.81 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 58.7 t-80 -109.93 -5.2 15.55 Favored 'General case' 0 N--CA 1.485 1.276 0 C-N-CA 123.379 0.672 . . . . 0.0 111.013 177.563 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 24.9 mtpp 64.84 59.43 0.9 Allowed 'General case' 0 CA--C 1.545 0.763 0 C-N-CA 124.578 1.151 . . . . 0.0 109.908 -170.692 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . 0.489 ' HA ' HG11 ' A' ' 69' ' ' VAL . 84.6 mt -83.49 -0.34 49.78 Favored 'General case' 0 N--CA 1.489 1.518 0 C-N-CA 124.11 0.964 . . . . 0.0 110.848 175.771 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -82.47 158.83 23.07 Favored 'General case' 0 C--O 1.242 0.672 0 C-N-CA 124.631 1.172 . . . . 0.0 110.751 176.093 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 85.67 -146.92 21.76 Favored Glycine 0 C--N 1.337 0.6 0 CA-C-N 115.038 -0.983 . . . . 0.0 113.466 175.91 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 78.1 m-20 -65.36 111.21 2.93 Favored 'General case' 0 N--CA 1.473 0.698 0 C-N-CA 124.182 0.993 . . . . 0.0 109.83 -175.691 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 55.1 mt -56.1 -51.45 61.95 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.107 0 O-C-N 124.31 1.006 . . . . 0.0 112.678 -169.015 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 67' ' ' LYS . . . . . 0.472 ' H ' ' HD2' ' A' ' 67' ' ' LYS . 0.0 OUTLIER -71.69 -32.07 67.44 Favored 'General case' 0 N--CA 1.485 1.293 0 C-N-CA 123.183 0.593 . . . . 0.0 110.28 -174.634 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 49.0 t30 -62.82 -35.67 80.66 Favored 'General case' 0 N--CA 1.482 1.127 0 CA-C-N 115.277 -0.874 . . . . 0.0 110.846 175.326 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 69' ' ' VAL . . . . . 0.489 HG11 ' HA ' ' A' ' 62' ' ' LEU . 64.6 t -73.85 -41.28 53.76 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.859 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.145 172.058 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 70' ' ' ALA . . . . . 0.481 ' HA ' ' HB2' ' A' ' 73' ' ' ALA . . . -69.94 -1.94 11.04 Favored 'General case' 0 N--CA 1.487 1.393 0 C-N-CA 124.377 1.071 . . . . 0.0 113.417 -174.172 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 64.0 pttt -75.91 -33.71 59.91 Favored 'General case' 0 N--CA 1.478 0.966 0 CA-C-N 118.06 0.391 . . . . 0.0 110.131 174.081 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 10.0 t -115.16 -13.92 11.77 Favored 'General case' 0 N--CA 1.472 0.641 0 C-N-CA 123.988 0.915 . . . . 0.0 110.626 -176.906 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . 0.481 ' HB2' ' HA ' ' A' ' 70' ' ' ALA . . . -78.25 94.19 4.75 Favored 'General case' 0 C--N 1.343 0.317 0 N-CA-C 108.976 -0.75 . . . . 0.0 108.976 174.16 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 27.8 p-10 -74.25 155.54 38.17 Favored 'General case' 0 C--O 1.244 0.79 0 N-CA-C 109.372 -0.603 . . . . 0.0 109.372 176.33 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 4.6 tppp? -56.54 -39.05 72.76 Favored 'General case' 0 CA--C 1.549 0.916 0 C-N-CA 123.82 0.848 . . . . 0.0 111.846 -174.476 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 25.9 t70 -59.42 -49.5 77.54 Favored 'General case' 0 N--CA 1.476 0.869 0 C-N-CA 124.055 0.942 . . . . 0.0 112.333 -177.215 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 8.7 t60 -70.76 -28.12 64.45 Favored 'General case' 0 N--CA 1.476 0.869 0 C-N-CA 123.327 0.651 . . . . 0.0 110.696 -176.717 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . 0.452 HD21 ' HB1' ' A' ' 73' ' ' ALA . 82.4 mt -68.72 -33.61 74.23 Favored 'General case' 0 N--CA 1.478 0.925 0 C-N-CA 122.824 0.449 . . . . 0.0 111.972 176.266 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 57.1 t -66.03 -45.48 90.63 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.702 0 O-C-N 124.031 0.832 . . . . 0.0 109.653 171.227 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 33.8 m -58.63 -40.1 82.41 Favored 'General case' 0 N--CA 1.479 1.004 0 C-N-CA 123.855 0.862 . . . . 0.0 111.209 177.571 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -69.55 -46.66 65.93 Favored 'General case' 0 N--CA 1.469 0.514 0 C-N-CA 123.858 0.863 . . . . 0.0 110.527 178.142 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 82' ' ' TYR . . . . . . . . . . . . . 10.6 t80 -52.05 -54.8 25.75 Favored 'General case' 0 N--CA 1.475 0.816 0 C-N-CA 124.857 1.263 . . . . 0.0 110.997 179.349 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 83' ' ' ASN . . . . . . . . . . . . . 62.3 m-80 -65.0 -38.16 90.05 Favored 'General case' 0 N--CA 1.478 0.953 0 C-N-CA 122.825 0.45 . . . . 0.0 111.511 -177.609 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 32.1 m170 -66.64 -26.14 66.92 Favored 'General case' 0 N--CA 1.484 1.269 0 C-N-CA 123.729 0.811 . . . . 0.0 112.054 177.993 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 37.9 tp -58.52 -52.67 64.66 Favored 'General case' 0 N--CA 1.478 0.959 0 CA-C-O 121.386 0.613 . . . . 0.0 110.538 176.948 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 28.6 m-85 -75.44 -32.56 60.72 Favored 'General case' 0 N--CA 1.47 0.562 0 CA-C-N 114.261 -1.336 . . . . 0.0 111.771 -179.11 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 35.9 tt0 -55.99 -45.58 78.95 Favored 'General case' 0 N--CA 1.484 1.229 0 C-N-CA 123.941 0.896 . . . . 0.0 112.306 -172.664 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 16.5 p -112.77 3.41 16.46 Favored 'General case' 0 N--CA 1.477 0.908 0 C-N-CA 123.91 0.884 . . . . 0.0 111.393 178.194 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 47.9 mtpt 52.75 64.66 1.77 Allowed 'General case' 0 N--CA 1.479 0.977 0 C-N-CA 124.664 1.186 . . . . 0.0 110.612 179.182 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 90' ' ' ARG . . . . . 0.435 HH11 ' HD1' ' A' ' 56' ' ' PHE . 99.3 mtt180 -78.5 -33.19 48.27 Favored 'General case' 0 N--CA 1.473 0.701 0 CA-C-N 114.561 -1.199 . . . . 0.0 112.099 -172.374 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 91' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -51.41 160.73 0.54 Allowed 'General case' 0 N--CA 1.483 1.188 0 C-N-CA 124.116 0.966 . . . . 0.0 113.436 178.353 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 92' ' ' LYS . . . . . 0.6 ' HA ' ' HE2' ' A' ' 92' ' ' LYS . 11.0 mmpt? . . . . . 0 C--O 1.254 1.305 0 C-N-CA 124.33 1.052 . . . . 0.0 111.825 178.421 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 27' ' ' ARG . . . . . 0.525 ' HB2' ' OH ' ' A' ' 82' ' ' TYR . 0.0 OUTLIER . . . . . 0 N--CA 1.477 0.895 0 CA-C-O 120.889 0.376 . . . . 0.0 111.521 . . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -101.51 -43.3 5.95 Favored 'General case' 0 N--CA 1.475 0.818 0 C-N-CA 123.591 0.756 . . . . 0.0 110.878 -174.489 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 29' ' ' TRP . . . . . . . . . . . . . 3.7 m-90 -101.76 152.64 20.63 Favored 'General case' 0 N--CA 1.474 0.731 0 C-N-CA 124.554 1.142 . . . . 0.0 111.605 -169.43 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 64.9 p -92.09 174.16 7.46 Favored 'General case' 0 CA--C 1.542 0.657 0 C-N-CA 123.511 0.724 . . . . 0.0 109.505 170.963 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 12.4 p -56.11 -37.97 51.58 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.36 0 C-N-CA 123.379 0.672 . . . . 0.0 111.973 -177.674 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 10.0 pt-20 -73.61 -35.92 65.41 Favored 'General case' 0 N--CA 1.474 0.727 0 C-N-CA 123.666 0.787 . . . . 0.0 111.843 -178.994 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 2.7 mp0 -66.64 -33.42 75.61 Favored 'General case' 0 N--CA 1.482 1.149 0 C-N-CA 122.839 0.455 . . . . 0.0 110.652 176.144 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . 0.512 HD13 ' HA ' ' A' ' 79' ' ' VAL . 79.4 mt -65.48 -50.72 64.28 Favored 'General case' 0 N--CA 1.48 1.041 0 CA-C-O 121.302 0.572 . . . . 0.0 111.127 177.131 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 13.8 ptm180 -74.34 -11.51 60.28 Favored 'General case' 0 CA--C 1.548 0.892 0 CA-C-N 114.727 -1.124 . . . . 0.0 112.073 -175.786 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 48.3 t -64.73 143.98 57.55 Favored 'General case' 0 CA--C 1.553 1.079 0 C-N-CA 123.497 0.719 . . . . 0.0 111.113 173.65 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 13.9 pt-20 -73.71 -27.99 61.49 Favored 'General case' 0 N--CA 1.481 1.078 0 C-N-CA 123.307 0.643 . . . . 0.0 110.489 175.816 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 92.9 mt-30 -63.16 -31.16 72.24 Favored 'General case' 0 N--CA 1.474 0.773 0 C-N-CA 124.982 1.313 . . . . 0.0 110.868 -177.18 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . 0.418 HD22 ' HA ' ' A' ' 34' ' ' LEU . 48.7 tp -92.04 109.16 35.54 Favored Pre-proline 0 CA--C 1.549 0.92 0 N-CA-C 108.362 -0.977 . . . . 0.0 108.362 170.713 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 40' ' ' PRO . . . . . 0.468 ' HG2' ' HB2' ' A' ' 43' ' ' ASP . 47.3 Cg_endo -68.61 151.11 75.23 Favored 'Trans proline' 0 C--N 1.378 2.081 0 C-N-CA 122.821 2.347 . . . . 0.0 112.466 -178.587 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 49.7 mtmt -58.21 -42.72 86.84 Favored 'General case' 0 N--CA 1.477 0.883 0 C-N-CA 123.983 0.913 . . . . 0.0 111.325 -179.806 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 17.8 ptpt -63.52 -34.34 77.57 Favored 'General case' 0 CA--C 1.542 0.669 0 CA-C-N 114.442 -1.254 . . . . 0.0 111.763 -176.274 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 43' ' ' ASP . . . . . 0.468 ' HB2' ' HG2' ' A' ' 40' ' ' PRO . 14.0 t70 -73.99 -30.83 62.69 Favored 'General case' 0 N--CA 1.48 1.048 0 O-C-N 123.109 0.256 . . . . 0.0 110.847 -176.941 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 44' ' ' ILE . . . . . 0.507 HD12 HD11 ' A' ' 78' ' ' LEU . 42.8 mt -70.22 -52.16 32.54 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.973 0 C-N-CA 122.827 0.451 . . . . 0.0 110.033 177.036 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 69.5 mt -55.64 -41.84 66.43 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.537 0 C-N-CA 123.612 0.765 . . . . 0.0 110.581 177.008 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 35.1 ttmt -56.25 -48.38 76.64 Favored 'General case' 0 N--CA 1.474 0.763 0 C-N-CA 124.737 1.215 . . . . 0.0 111.241 178.036 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 15.9 t80 -61.37 -46.48 90.02 Favored 'General case' 0 N--CA 1.474 0.74 0 CA-C-N 115.045 -0.979 . . . . 0.0 110.903 178.021 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 88.5 mt -69.42 -32.56 71.61 Favored 'General case' 0 N--CA 1.473 0.705 0 C-N-CA 123.544 0.738 . . . . 0.0 112.14 -174.704 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 3.1 pt20 -82.29 -26.33 33.19 Favored 'General case' 0 N--CA 1.479 0.979 0 CA-C-O 120.779 0.323 . . . . 0.0 110.716 178.788 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 11.3 tp10 -63.43 -26.27 68.66 Favored 'General case' 0 N--CA 1.48 1.046 0 C-N-CA 124.068 0.947 . . . . 0.0 112.07 -176.933 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 51' ' ' HIS . . . . . 0.461 ' O ' ' HG2' ' A' ' 92' ' ' LYS . 0.4 OUTLIER -136.22 -24.94 1.22 Allowed 'General case' 0 N--CA 1.487 1.404 0 N-CA-C 113.428 0.899 . . . . 0.0 113.428 178.764 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -58.04 131.68 52.17 Favored Glycine 0 C--N 1.346 1.089 0 CA-C-N 118.426 0.557 . . . . 0.0 112.761 174.118 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 48.2 t -64.36 160.14 19.63 Favored 'General case' 0 N--CA 1.477 0.914 0 C-N-CA 123.014 0.525 . . . . 0.0 111.34 -177.51 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 4.8 m-20 -56.95 -38.19 72.6 Favored 'General case' 0 N--CA 1.482 1.167 0 C-N-CA 124.111 0.964 . . . . 0.0 111.003 -178.587 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 28.2 t -65.98 -36.45 83.34 Favored 'General case' 0 CA--C 1.548 0.891 0 CA-C-N 114.175 -1.375 . . . . 0.0 110.847 -179.468 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 88.5 t80 -70.75 -51.12 29.23 Favored 'General case' 0 N--CA 1.476 0.862 0 C-N-CA 123.102 0.561 . . . . 0.0 110.099 175.791 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 73.1 mt -62.78 -31.8 72.84 Favored 'General case' 0 N--CA 1.474 0.771 0 CA-C-N 115.19 -0.913 . . . . 0.0 111.561 -173.633 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -62.09 -49.5 75.68 Favored 'General case' 0 N--CA 1.476 0.862 0 C-N-CA 123.587 0.755 . . . . 0.0 111.443 177.286 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 36.1 mt-10 -57.4 -48.74 78.29 Favored 'General case' 0 N--CA 1.483 1.224 0 C-N-CA 123.81 0.844 . . . . 0.0 110.555 179.357 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 64.2 m80 -95.67 1.95 53.79 Favored 'General case' 0 N--CA 1.477 0.876 0 CA-C-N 114.86 -1.064 . . . . 0.0 111.974 -170.532 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 39.4 mtmm 57.34 27.46 13.8 Favored 'General case' 0 N--CA 1.492 1.666 0 C-N-CA 124.496 1.118 . . . . 0.0 112.797 176.951 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . 0.453 HD11 ' HB2' ' A' ' 81' ' ' ALA . 85.1 mt -82.32 -11.61 58.5 Favored 'General case' 0 N--CA 1.483 1.183 0 C-N-CA 123.298 0.639 . . . . 0.0 111.671 -176.012 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 2.9 pp -79.54 158.45 27.17 Favored 'General case' 0 N--CA 1.475 0.806 0 CA-C-O 121.103 0.478 . . . . 0.0 110.724 175.347 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 93.42 -168.52 29.58 Favored Glycine 0 C--N 1.339 0.74 0 CA-C-N 115.313 -0.858 . . . . 0.0 112.774 179.76 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 65' ' ' ASN . . . . . 0.403 ' O ' HG22 ' A' ' 69' ' ' VAL . 51.5 t-20 -59.7 111.87 1.6 Allowed 'General case' 0 N--CA 1.478 0.974 0 C-N-CA 124.08 0.952 . . . . 0.0 109.593 -177.521 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 39.8 mt -55.36 -42.69 68.18 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.58 0 C-N-CA 123.873 0.869 . . . . 0.0 111.307 -171.652 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 17.5 mtpp -55.96 -45.73 78.8 Favored 'General case' 0 CA--C 1.545 0.781 0 C-N-CA 124.466 1.106 . . . . 0.0 111.156 178.277 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 2.1 m-20 -74.13 -33.09 63.43 Favored 'General case' 0 N--CA 1.481 1.083 0 C-N-CA 123.31 0.644 . . . . 0.0 111.121 -178.909 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 69' ' ' VAL . . . . . 0.403 HG22 ' O ' ' A' ' 65' ' ' ASN . 89.8 t -63.03 -44.06 99.4 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.061 0 C-N-CA 123.367 0.667 . . . . 0.0 109.936 174.393 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -67.04 -5.18 12.01 Favored 'General case' 0 N--CA 1.484 1.268 0 C-N-CA 124.742 1.217 . . . . 0.0 112.709 -176.101 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 85.6 tttt -72.27 -50.68 25.34 Favored 'General case' 0 CA--C 1.545 0.754 0 C-N-CA 122.738 0.415 . . . . 0.0 109.912 173.908 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 14.5 t -91.53 -21.33 20.93 Favored 'General case' 0 N--CA 1.473 0.716 0 C-N-CA 123.374 0.67 . . . . 0.0 110.889 179.56 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -85.44 85.31 7.44 Favored 'General case' 0 C--O 1.241 0.653 0 CA-C-O 121.681 0.753 . . . . 0.0 109.407 178.428 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 74' ' ' ASN . . . . . 0.451 ' O ' ' HG ' ' A' ' 78' ' ' LEU . 28.0 p-10 -74.92 172.83 11.55 Favored 'General case' 0 N--CA 1.474 0.763 0 CA-C-N 114.494 -1.23 . . . . 0.0 109.885 176.854 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . 0.405 ' HA ' HD12 ' A' ' 78' ' ' LEU . 1.9 tpmt? -54.27 -40.73 68.1 Favored 'General case' 0 CA--C 1.552 1.05 0 C-N-CA 123.867 0.867 . . . . 0.0 111.519 -176.056 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 34.8 t70 -64.68 -40.38 95.3 Favored 'General case' 0 N--CA 1.478 0.943 0 C-N-CA 124.293 1.037 . . . . 0.0 112.122 179.457 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 34.5 t60 -59.35 -42.89 92.58 Favored 'General case' 0 N--CA 1.485 1.32 0 C-N-CA 124.076 0.951 . . . . 0.0 110.363 178.974 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . 0.507 HD11 HD12 ' A' ' 44' ' ' ILE . 34.0 mt -60.32 -46.26 90.51 Favored 'General case' 0 C--O 1.218 -0.578 0 CA-C-N 114.296 -1.32 . . . . 0.0 111.377 -176.174 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 79' ' ' VAL . . . . . 0.512 ' HA ' HD13 ' A' ' 34' ' ' LEU . 60.2 t -63.68 -46.84 93.59 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.631 0 O-C-N 124.367 1.042 . . . . 0.0 110.743 -178.728 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 34.5 m -60.05 -50.51 73.44 Favored 'General case' 0 N--CA 1.478 0.94 0 CA-C-N 115.61 -0.723 . . . . 0.0 111.259 179.392 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 81' ' ' ALA . . . . . 0.453 ' HB2' HD11 ' A' ' 62' ' ' LEU . . . -66.4 -43.55 85.51 Favored 'General case' 0 N--CA 1.474 0.747 0 C-N-CA 123.767 0.827 . . . . 0.0 111.31 -177.286 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 82' ' ' TYR . . . . . 0.525 ' OH ' ' HB2' ' A' ' 27' ' ' ARG . 78.6 t80 -58.22 -58.93 6.3 Favored 'General case' 0 N--CA 1.473 0.721 0 C-N-CA 124.024 0.93 . . . . 0.0 110.379 -178.262 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 83' ' ' ASN . . . . . . . . . . . . . 16.6 m-80 -59.47 -39.69 84.51 Favored 'General case' 0 N--CA 1.48 1.063 0 C-N-CA 123.546 0.738 . . . . 0.0 111.011 -175.042 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 3.7 m-70 -65.07 -33.89 77.11 Favored 'General case' 0 N--CA 1.478 0.943 0 C-N-CA 123.765 0.826 . . . . 0.0 112.605 179.969 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 40.6 tp -59.18 -52.1 67.16 Favored 'General case' 0 N--CA 1.479 1.021 0 CA-C-O 121.519 0.676 . . . . 0.0 110.847 -176.811 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 86' ' ' PHE . . . . . 0.427 ' HA ' ' HE2' ' A' ' 91' ' ' PHE . 21.6 m-85 -76.27 -29.47 57.44 Favored 'General case' 0 N--CA 1.473 0.702 0 CA-C-N 114.106 -1.406 . . . . 0.0 111.165 -177.933 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 11.2 tp10 -61.01 -27.65 68.47 Favored 'General case' 0 N--CA 1.48 1.045 0 C-N-CA 124.734 1.214 . . . . 0.0 111.981 -179.905 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 31.5 p -128.46 -4.37 5.4 Favored 'General case' 0 N--CA 1.484 1.231 0 C-N-CA 123.74 0.816 . . . . 0.0 111.613 -177.761 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 44.7 mtmt 58.05 50.15 10.54 Favored 'General case' 0 N--CA 1.485 1.317 0 C-N-CA 124.614 1.166 . . . . 0.0 112.168 178.687 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 99.5 mtt180 -80.93 -5.43 57.45 Favored 'General case' 0 N--CA 1.481 1.077 0 CA-C-N 115.698 -0.683 . . . . 0.0 111.627 178.208 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 91' ' ' PHE . . . . . 0.427 ' HE2' ' HA ' ' A' ' 86' ' ' PHE . 48.9 p90 -71.98 163.61 27.56 Favored 'General case' 0 N--CA 1.474 0.763 0 C-N-CA 123.53 0.732 . . . . 0.0 110.674 167.416 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 92' ' ' LYS . . . . . 0.461 ' HG2' ' O ' ' A' ' 51' ' ' HIS . 32.2 mmmt . . . . . 0 C--O 1.252 1.194 0 C-N-CA 123.466 0.707 . . . . 0.0 110.674 -176.226 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 CA--C 1.542 0.664 0 CA-C-O 120.845 0.355 . . . . 0.0 111.177 . . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -85.1 -42.4 14.83 Favored 'General case' 0 N--CA 1.474 0.753 0 C-N-CA 123.5 0.72 . . . . 0.0 109.423 178.197 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 29' ' ' TRP . . . . . . . . . . . . . 6.6 m-90 -123.48 153.7 40.14 Favored 'General case' 0 N--CA 1.476 0.835 0 C-N-CA 124.571 1.148 . . . . 0.0 108.935 177.966 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 30' ' ' THR . . . . . 0.425 ' O ' ' HG ' ' A' ' 34' ' ' LEU . 55.9 p -87.49 170.59 11.21 Favored 'General case' 0 N--CA 1.475 0.812 0 C-N-CA 123.007 0.523 . . . . 0.0 110.095 -178.92 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 8.1 p -56.13 -46.23 80.98 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.312 0 C-N-CA 123.909 0.884 . . . . 0.0 113.206 -168.435 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 1.2 pm0 -75.77 -29.85 58.93 Favored 'General case' 0 N--CA 1.48 1.035 0 C-N-CA 123.615 0.766 . . . . 0.0 111.416 178.553 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 43.1 mt-30 -62.63 -29.04 70.33 Favored 'General case' 0 N--CA 1.491 1.605 0 CA-C-N 118.227 0.467 . . . . 0.0 110.705 172.538 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . 0.425 ' HG ' ' O ' ' A' ' 30' ' ' THR . 42.1 mt -72.85 -39.61 66.38 Favored 'General case' 0 N--CA 1.472 0.662 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.49 174.798 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 47.5 mtm105 -71.68 -20.23 61.96 Favored 'General case' 0 N--CA 1.478 0.945 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.967 176.444 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 46.9 t -64.23 123.25 18.63 Favored 'General case' 0 C--O 1.238 0.494 0 C-N-CA 123.455 0.702 . . . . 0.0 110.334 179.819 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 33.4 mt-10 -62.58 -19.22 63.48 Favored 'General case' 0 CA--C 1.547 0.836 0 C-N-CA 124.484 1.114 . . . . 0.0 111.512 178.909 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 82.9 mt-30 -61.8 -50.29 72.91 Favored 'General case' 0 N--CA 1.472 0.633 0 C-N-CA 124.37 1.068 . . . . 0.0 110.341 176.487 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . 0.417 HD21 ' HA ' ' A' ' 34' ' ' LEU . 62.1 tp -72.62 123.67 89.83 Favored Pre-proline 0 CA--C 1.55 0.948 0 CA-C-N 115.396 -0.82 . . . . 0.0 109.783 -178.917 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 39.9 Cg_exo -61.7 149.43 89.97 Favored 'Trans proline' 0 C--N 1.378 2.095 0 C-N-CA 123.157 2.571 . . . . 0.0 113.532 175.105 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 41' ' ' LYS . . . . . 0.608 ' HG2' ' HD3' ' A' ' 75' ' ' LYS . 42.4 mtpt -67.01 -43.51 82.68 Favored 'General case' 0 N--CA 1.477 0.897 0 C-N-CA 124.321 1.048 . . . . 0.0 110.211 179.05 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 11.9 ptmm? -56.18 -36.63 68.57 Favored 'General case' 0 N--CA 1.476 0.859 0 C-N-CA 125.193 1.397 . . . . 0.0 112.864 179.458 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -64.87 -41.08 95.94 Favored 'General case' 0 N--CA 1.476 0.871 0 O-C-N 123.753 0.658 . . . . 0.0 111.281 179.888 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 43.8 mt -67.35 -48.23 78.46 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.961 0 C-N-CA 122.927 0.491 . . . . 0.0 110.085 179.206 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 82.1 mt -59.5 -43.96 91.86 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.05 0 CA-C-N 115.529 -0.76 . . . . 0.0 110.795 -179.875 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 88.3 tttt -63.81 -37.61 88.03 Favored 'General case' 0 N--CA 1.476 0.864 0 O-C-N 123.972 0.795 . . . . 0.0 111.159 -179.859 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 37.8 t80 -63.51 -54.03 42.76 Favored 'General case' 0 N--CA 1.477 0.901 0 CA-C-N 115.266 -0.879 . . . . 0.0 110.638 176.185 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 86.6 mt -68.65 -30.74 69.5 Favored 'General case' 0 N--CA 1.478 0.94 0 C-N-CA 123.642 0.777 . . . . 0.0 111.892 -173.108 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . 0.503 ' HA ' HD21 ' A' ' 57' ' ' LEU . 3.5 pt20 -81.62 -26.6 34.72 Favored 'General case' 0 N--CA 1.483 1.185 0 N-CA-C 111.62 0.23 . . . . 0.0 111.62 -179.085 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 12.1 tp10 -62.07 -38.7 89.8 Favored 'General case' 0 N--CA 1.479 1.014 0 C-N-CA 123.7 0.8 . . . . 0.0 111.815 -179.118 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 16.5 p80 -122.09 -25.67 4.88 Favored 'General case' 0 N--CA 1.493 1.71 0 N-CA-C 112.814 0.672 . . . . 0.0 112.814 -175.832 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . 0.477 ' HA2' ' HA ' ' A' ' 91' ' ' PHE . . . -61.54 139.58 47.12 Favored Glycine 0 C--N 1.347 1.145 0 CA-C-O 119.628 -0.54 . . . . 0.0 112.374 173.761 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 53' ' ' SER . . . . . 0.468 ' O ' ' HG ' ' A' ' 57' ' ' LEU . 28.7 t -63.57 151.88 40.26 Favored 'General case' 0 N--CA 1.481 1.084 0 C-N-CA 123.523 0.729 . . . . 0.0 111.476 -179.008 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 26.9 t70 -55.45 -37.04 67.2 Favored 'General case' 0 N--CA 1.483 1.189 0 O-C-N 124.309 1.006 . . . . 0.0 111.727 178.046 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 46.0 m -66.13 -42.19 89.45 Favored 'General case' 0 CA--C 1.543 0.71 0 O-C-N 123.84 0.712 . . . . 0.0 111.142 177.312 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 56' ' ' PHE . . . . . 0.439 ' HB2' ' HB3' ' A' ' 90' ' ' ARG . 27.6 t80 -60.57 -41.86 95.48 Favored 'General case' 0 N--CA 1.482 1.174 0 C-N-CA 123.714 0.805 . . . . 0.0 110.365 174.497 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . 0.503 HD21 ' HA ' ' A' ' 49' ' ' GLN . 65.0 mt -69.95 -37.73 75.92 Favored 'General case' 0 N--CA 1.47 0.539 0 CA-C-N 115.514 -0.767 . . . . 0.0 111.079 -176.815 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -67.38 -49.2 64.91 Favored 'General case' 0 N--CA 1.482 1.142 0 C-N-CA 123.332 0.653 . . . . 0.0 110.865 -179.74 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 47.1 mt-10 -59.87 -32.04 70.34 Favored 'General case' 0 N--CA 1.477 0.885 0 CA-C-N 115.318 -0.855 . . . . 0.0 111.96 178.183 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 41.1 m80 -116.13 14.39 15.95 Favored 'General case' 0 N--CA 1.485 1.278 0 N-CA-C 112.881 0.697 . . . . 0.0 112.881 -174.805 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 57.6 mttp 57.07 20.6 5.62 Favored 'General case' 0 N--CA 1.498 1.962 0 N-CA-C 114.167 1.173 . . . . 0.0 114.167 172.995 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 94.9 mt -83.64 -10.7 58.04 Favored 'General case' 0 N--CA 1.482 1.172 0 C-N-CA 122.822 0.449 . . . . 0.0 111.951 -174.847 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 2.5 pp -81.96 176.33 9.64 Favored 'General case' 0 N--CA 1.481 1.112 0 CA-C-O 121.31 0.576 . . . . 0.0 111.144 175.481 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 90.17 -148.9 19.97 Favored Glycine 0 C--N 1.336 0.583 0 CA-C-N 114.686 -1.143 . . . . 0.0 111.823 177.973 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 9.8 m120 -77.03 119.77 21.22 Favored 'General case' 0 N--CA 1.468 0.441 0 N-CA-C 108.68 -0.859 . . . . 0.0 108.68 176.283 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 64.1 mt -54.08 -48.06 65.49 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.051 0 C-N-CA 123.709 0.804 . . . . 0.0 110.157 178.698 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 61.3 pttt -54.12 -38.75 65.75 Favored 'General case' 0 N--CA 1.485 1.293 0 C-N-CA 124.022 0.929 . . . . 0.0 112.461 178.563 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 8.1 t30 -68.32 -45.64 72.41 Favored 'General case' 0 N--CA 1.478 0.941 0 C-N-CA 123.319 0.647 . . . . 0.0 110.692 179.524 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 69' ' ' VAL . . . . . 0.441 ' HA ' HG23 ' A' ' 72' ' ' THR . 44.9 t -71.94 -31.88 42.22 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.974 0 CA-C-N 115.58 -0.737 . . . . 0.0 110.714 -178.075 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -73.09 -14.94 61.49 Favored 'General case' 0 N--CA 1.479 1.007 0 C-N-CA 123.697 0.799 . . . . 0.0 112.212 -177.413 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 16.8 ptpt -99.3 -48.78 4.69 Favored 'General case' 0 CA--C 1.547 0.851 0 CA-C-N 118.11 0.414 . . . . 0.0 111.41 170.605 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 72' ' ' THR . . . . . 0.441 HG23 ' HA ' ' A' ' 69' ' ' VAL . 7.6 t -73.39 -35.34 65.89 Favored 'General case' 0 N--CA 1.487 1.419 0 C-N-CA 122.937 0.495 . . . . 0.0 112.027 -171.157 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -100.92 130.55 46.94 Favored 'General case' 0 N--CA 1.472 0.669 0 C-N-CA 123.699 0.799 . . . . 0.0 109.425 177.485 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 29.1 p-10 -82.98 173.81 11.46 Favored 'General case' 0 N--CA 1.484 1.27 0 C-N-CA 123.491 0.716 . . . . 0.0 111.216 -174.45 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . 0.608 ' HD3' ' HG2' ' A' ' 41' ' ' LYS . 15.7 tptm -64.25 -39.8 94.7 Favored 'General case' 0 N--CA 1.477 0.898 0 C-N-CA 123.676 0.79 . . . . 0.0 111.176 -174.403 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 22.3 t70 -64.41 -38.41 90.93 Favored 'General case' 0 N--CA 1.482 1.142 0 C-N-CA 124.009 0.924 . . . . 0.0 111.053 -177.212 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 77' ' ' HIS . . . . . 0.431 ' HD2' HD22 ' A' ' 78' ' ' LEU . 33.0 t60 -55.39 -43.58 75.31 Favored 'General case' 0 N--CA 1.481 1.076 0 C-N-CA 124.696 1.198 . . . . 0.0 110.56 173.902 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . 0.431 HD22 ' HD2' ' A' ' 77' ' ' HIS . 25.5 mt -67.74 -40.26 84.15 Favored 'General case' 0 N--CA 1.477 0.894 0 C-N-CA 123.882 0.873 . . . . 0.0 111.103 -175.663 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 79' ' ' VAL . . . . . 0.405 HG21 ' O ' ' A' ' 75' ' ' LYS . 45.2 t -66.55 -45.01 89.79 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.821 0 C-N-CA 123.801 0.841 . . . . 0.0 110.118 179.276 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 33.1 m -60.72 -42.91 98.23 Favored 'General case' 0 N--CA 1.482 1.171 0 C-N-CA 123.599 0.76 . . . . 0.0 111.117 179.08 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -66.87 -39.9 87.69 Favored 'General case' 0 N--CA 1.476 0.868 0 C-N-CA 123.705 0.802 . . . . 0.0 110.992 178.87 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 82' ' ' TYR . . . . . 0.427 ' O ' ' HB3' ' A' ' 85' ' ' LEU . 5.5 t80 -56.67 -55.64 31.47 Favored 'General case' 0 C--O 1.218 -0.557 0 C-N-CA 124.663 1.185 . . . . 0.0 110.908 177.035 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 83' ' ' ASN . . . . . . . . . . . . . 59.7 m-80 -67.33 -40.51 85.91 Favored 'General case' 0 N--CA 1.486 1.352 0 C-N-CA 122.52 0.328 . . . . 0.0 111.143 -174.58 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 55.4 m170 -66.51 -24.3 66.37 Favored 'General case' 0 N--CA 1.483 1.222 0 C-N-CA 123.771 0.829 . . . . 0.0 111.612 177.415 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 85' ' ' LEU . . . . . 0.427 ' HB3' ' O ' ' A' ' 82' ' ' TYR . 53.9 tp -59.3 -54.73 43.44 Favored 'General case' 0 N--CA 1.479 0.982 0 CA-C-O 121.327 0.584 . . . . 0.0 110.822 175.16 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 45.0 m-85 -73.77 -30.4 62.75 Favored 'General case' 0 N--CA 1.475 0.777 0 CA-C-N 114.515 -1.22 . . . . 0.0 110.798 -176.627 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 44.3 tt0 -65.29 -24.6 67.34 Favored 'General case' 0 N--CA 1.482 1.137 0 C-N-CA 124.076 0.95 . . . . 0.0 112.48 -175.95 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 10.1 p -125.16 -4.2 7.44 Favored 'General case' 0 N--CA 1.478 0.949 0 C-N-CA 123.731 0.812 . . . . 0.0 110.921 177.765 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 94.3 mttt 56.23 49.75 14.73 Favored 'General case' 0 N--CA 1.485 1.293 0 C-N-CA 124.364 1.066 . . . . 0.0 111.48 -175.806 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 90' ' ' ARG . . . . . 0.439 ' HB3' ' HB2' ' A' ' 56' ' ' PHE . 54.4 mtt85 -68.95 -13.27 62.34 Favored 'General case' 0 N--CA 1.488 1.44 0 C-N-CA 124.791 1.237 . . . . 0.0 112.891 178.018 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 91' ' ' PHE . . . . . 0.477 ' HA ' ' HA2' ' A' ' 52' ' ' GLY . 4.2 p90 -68.14 139.96 56.16 Favored 'General case' 0 N--CA 1.475 0.816 0 C-N-CA 122.442 0.297 . . . . 0.0 110.787 175.295 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 C--O 1.256 1.406 0 C-N-CA 124.441 1.097 . . . . 0.0 108.286 172.357 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 27.7 ptt180 . . . . . 0 CA--C 1.543 0.683 0 CA-C-O 121.518 0.675 . . . . 0.0 110.457 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -74.84 -22.38 58.72 Favored 'General case' 0 CA--C 1.54 0.575 0 CA-C-N 114.912 -1.04 . . . . 0.0 112.668 -167.047 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 29' ' ' TRP . . . . . . . . . . . . . 3.9 m-90 -138.89 150.71 46.27 Favored 'General case' 0 N--CA 1.478 0.945 0 C-N-CA 123.829 0.852 . . . . 0.0 110.902 -168.529 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 37.7 p -90.4 173.78 7.92 Favored 'General case' 0 N--CA 1.471 0.593 0 CA-C-N 115.37 -0.832 . . . . 0.0 109.05 170.404 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . 0.522 ' HA ' HD13 ' A' ' 34' ' ' LEU . 10.5 p -59.29 -34.3 53.57 Favored 'Isoleucine or valine' 0 CA--C 1.557 1.248 0 C-N-CA 123.741 0.816 . . . . 0.0 112.362 -174.689 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 12.5 pt-20 -70.48 -35.67 73.41 Favored 'General case' 0 N--CA 1.481 1.098 0 C-N-CA 123.589 0.756 . . . . 0.0 111.028 176.816 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 22.5 mm-40 -72.64 -30.4 64.27 Favored 'General case' 0 CA--C 1.546 0.803 0 C-N-CA 123.103 0.561 . . . . 0.0 110.798 176.184 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . 0.522 HD13 ' HA ' ' A' ' 31' ' ' VAL . 93.1 mt -72.27 -37.78 68.98 Favored 'General case' 0 N--CA 1.476 0.839 0 C-N-CA 123.674 0.79 . . . . 0.0 112.287 -179.0 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 12.0 ptt180 -76.43 -22.56 54.5 Favored 'General case' 0 N--CA 1.479 1.019 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.275 176.508 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 41.5 t -58.39 109.91 0.87 Allowed 'General case' 0 C--N 1.356 0.859 0 O-C-N 124.017 0.823 . . . . 0.0 111.829 -173.593 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 9.9 pt-20 -62.27 -21.08 64.93 Favored 'General case' 0 N--CA 1.484 1.261 0 C-N-CA 124.771 1.228 . . . . 0.0 112.541 179.453 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 12.0 mm100 -67.85 -32.82 73.61 Favored 'General case' 0 N--CA 1.473 0.715 0 C-N-CA 123.941 0.896 . . . . 0.0 110.356 176.437 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 3.5 tt -73.38 127.59 88.71 Favored Pre-proline 0 CA--C 1.547 0.861 0 N-CA-C 108.024 -1.102 . . . . 0.0 108.024 175.866 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 53.0 Cg_exo -55.41 126.35 22.21 Favored 'Trans proline' 0 C--N 1.378 2.088 0 C-N-CA 122.546 2.164 . . . . 0.0 112.365 174.015 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 41' ' ' LYS . . . . . 0.751 ' HG2' ' HD3' ' A' ' 75' ' ' LYS . 35.9 mtmm -58.08 -37.78 75.13 Favored 'General case' 0 N--CA 1.48 1.069 0 C-N-CA 124.348 1.059 . . . . 0.0 110.483 177.58 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 18.8 ptpt -62.19 -35.9 80.25 Favored 'General case' 0 N--CA 1.472 0.626 0 CA-C-N 114.777 -1.101 . . . . 0.0 111.9 175.498 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 43' ' ' ASP . . . . . 0.402 ' HA ' ' HE3' ' A' ' 46' ' ' LYS . 30.2 t70 -69.82 -32.72 71.3 Favored 'General case' 0 CA--C 1.545 0.757 0 C-N-CA 122.444 0.298 . . . . 0.0 110.82 -174.338 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 56.2 mt -66.57 -52.4 46.45 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.148 0 N-CA-C 109.575 -0.528 . . . . 0.0 109.575 174.217 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 45' ' ' ILE . . . . . 0.445 HD13 HG12 ' A' ' 69' ' ' VAL . 76.4 mt -58.49 -33.38 48.0 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.333 0 C-N-CA 124.451 1.1 . . . . 0.0 111.654 178.95 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 46' ' ' LYS . . . . . 0.402 ' HE3' ' HA ' ' A' ' 43' ' ' ASP . 33.0 ttmt -61.68 -41.94 98.24 Favored 'General case' 0 N--CA 1.48 1.028 0 C-N-CA 124.394 1.078 . . . . 0.0 110.796 179.233 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 2.0 t80 -70.89 -37.66 73.01 Favored 'General case' 0 CA--C 1.548 0.884 0 CA-C-N 114.488 -1.233 . . . . 0.0 109.858 177.698 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . 0.461 HD23 ' HA ' ' A' ' 82' ' ' TYR . 93.1 mt -68.89 -31.84 71.05 Favored 'General case' 0 N--CA 1.476 0.862 0 C-N-CA 123.481 0.712 . . . . 0.0 112.488 -178.73 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . 0.53 ' HA ' HD22 ' A' ' 57' ' ' LEU . 3.8 pt20 -85.07 -28.03 25.91 Favored 'General case' 0 N--CA 1.479 1.012 0 C-N-CA 122.103 0.161 . . . . 0.0 111.393 176.081 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 42.7 tt0 -61.22 -35.17 76.48 Favored 'General case' 0 N--CA 1.479 1.007 0 O-C-N 123.767 0.667 . . . . 0.0 111.26 -178.176 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 59.7 m-70 -112.86 -44.68 3.27 Favored 'General case' 0 N--CA 1.469 0.524 0 CA-C-N 115.798 -0.637 . . . . 0.0 110.022 -179.066 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . 0.427 ' HA2' ' HA ' ' A' ' 91' ' ' PHE . . . -57.07 131.28 51.97 Favored Glycine 0 C--N 1.354 1.564 0 O-C-N 123.912 0.757 . . . . 0.0 114.318 -175.328 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 44.1 m -72.58 166.12 23.34 Favored 'General case' 0 CA--C 1.54 0.57 0 C-N-CA 124.07 0.948 . . . . 0.0 111.736 -177.159 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 23.3 t70 -54.17 -38.77 65.93 Favored 'General case' 0 N--CA 1.481 1.083 0 CA-C-N 115.001 -0.999 . . . . 0.0 112.574 -175.233 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 20.2 t -67.05 -37.98 85.04 Favored 'General case' 0 CA--C 1.55 0.966 0 O-C-N 123.55 0.531 . . . . 0.0 111.098 -179.532 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 56' ' ' PHE . . . . . 0.483 ' HD1' HH11 ' A' ' 90' ' ' ARG . 53.4 t80 -67.02 -41.04 87.3 Favored 'General case' 0 N--CA 1.486 1.332 0 C-N-CA 123.632 0.773 . . . . 0.0 110.109 176.049 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . 0.53 HD22 ' HA ' ' A' ' 49' ' ' GLN . 39.0 mt -69.56 -55.25 10.68 Favored 'General case' 0 N--CA 1.471 0.595 0 CA-C-N 115.829 -0.623 . . . . 0.0 110.666 -175.802 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -61.55 -29.1 69.79 Favored 'General case' 0 N--CA 1.487 1.386 0 C-N-CA 124.394 1.078 . . . . 0.0 112.742 -174.109 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 50.6 mt-10 -54.39 -45.64 72.94 Favored 'General case' 0 N--CA 1.484 1.246 0 C-N-CA 122.798 0.439 . . . . 0.0 111.497 174.508 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 37.5 t-80 -114.07 4.14 15.54 Favored 'General case' 0 N--CA 1.48 1.042 0 C-N-CA 122.845 0.458 . . . . 0.0 111.345 -176.104 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 32.5 mmtp 49.29 60.5 3.72 Favored 'General case' 0 N--CA 1.476 0.831 0 C-N-CA 124.672 1.189 . . . . 0.0 111.301 -171.867 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . 0.484 ' HA ' HG13 ' A' ' 69' ' ' VAL . 95.2 mt -85.17 -14.77 45.89 Favored 'General case' 0 N--CA 1.481 1.11 0 CA-C-N 115.013 -0.994 . . . . 0.0 110.214 174.417 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 1.1 pp -76.66 171.11 15.22 Favored 'General case' 0 CA--C 1.545 0.769 0 C-N-CA 124.098 0.959 . . . . 0.0 110.739 173.556 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 88.4 -146.62 19.62 Favored Glycine 0 C--N 1.341 0.821 0 CA-C-N 115.61 -0.723 . . . . 0.0 111.921 -179.922 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 38.8 m-80 -72.73 113.12 9.41 Favored 'General case' 0 N--CA 1.478 0.947 0 N-CA-C 108.578 -0.897 . . . . 0.0 108.578 175.228 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 17.9 mt -55.9 -39.63 57.98 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.208 0 O-C-N 124.266 0.979 . . . . 0.0 110.335 -177.5 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 60.9 pttt -60.9 -39.76 90.54 Favored 'General case' 0 N--CA 1.478 0.961 0 C-N-CA 124.928 1.291 . . . . 0.0 112.246 178.302 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 28.3 t-20 -73.86 -36.47 64.86 Favored 'General case' 0 N--CA 1.477 0.899 0 C-N-CA 123.704 0.802 . . . . 0.0 109.984 -177.061 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 69' ' ' VAL . . . . . 0.484 HG13 ' HA ' ' A' ' 62' ' ' LEU . 58.7 t -63.53 -45.55 97.46 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.622 0 CA-C-N 114.984 -1.007 . . . . 0.0 109.522 172.17 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -67.59 -17.95 64.81 Favored 'General case' 0 N--CA 1.477 0.925 0 C-N-CA 124.582 1.153 . . . . 0.0 112.363 -177.068 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 25.3 ttpp -76.43 -43.66 39.19 Favored 'General case' 0 CA--C 1.539 0.55 0 C-N-CA 123.122 0.569 . . . . 0.0 110.469 175.524 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 15.1 t -99.94 -9.6 22.61 Favored 'General case' 0 CA--C 1.558 1.286 0 C-N-CA 123.848 0.859 . . . . 0.0 113.092 -171.304 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -87.79 160.02 18.2 Favored 'General case' 0 N--CA 1.484 1.25 0 C-N-CA 123.257 0.623 . . . . 0.0 110.553 179.544 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 50.4 t30 -110.16 129.99 55.62 Favored 'General case' 0 N--CA 1.48 1.066 0 C-N-CA 124.3 1.04 . . . . 0.0 109.321 -175.822 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . 0.751 ' HD3' ' HG2' ' A' ' 41' ' ' LYS . 22.7 tptp -59.48 -40.23 86.29 Favored 'General case' 0 N--CA 1.492 1.652 0 C-N-CA 123.977 0.911 . . . . 0.0 112.165 -169.932 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 3.5 p30 -74.74 -29.02 61.02 Favored 'General case' 0 N--CA 1.484 1.257 0 O-C-N 123.227 0.329 . . . . 0.0 111.05 -177.347 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 27.7 t60 -73.47 -28.74 62.11 Favored 'General case' 0 CA--C 1.549 0.935 0 C-N-CA 123.005 0.522 . . . . 0.0 110.062 173.341 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 83.1 mt -65.47 -32.84 74.67 Favored 'General case' 0 N--CA 1.49 1.547 0 C-N-CA 122.918 0.487 . . . . 0.0 110.596 175.147 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 79' ' ' VAL . . . . . 0.518 HG21 ' HB3' ' A' ' 34' ' ' LEU . 40.8 t -62.18 -47.94 90.75 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.139 0 C-N-CA 124.193 0.997 . . . . 0.0 109.658 172.718 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 16.0 m -64.53 -48.13 76.22 Favored 'General case' 0 N--CA 1.47 0.548 0 CA-C-N 114.176 -1.374 . . . . 0.0 111.841 -175.785 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -67.55 -34.02 76.22 Favored 'General case' 0 N--CA 1.477 0.923 0 C-N-CA 123.766 0.826 . . . . 0.0 111.176 -177.601 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 82' ' ' TYR . . . . . 0.461 ' HA ' HD23 ' A' ' 48' ' ' LEU . 81.4 t80 -60.19 -54.95 39.72 Favored 'General case' 0 N--CA 1.469 0.519 0 C-N-CA 124.487 1.115 . . . . 0.0 110.669 177.788 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 83' ' ' ASN . . . . . . . . . . . . . 90.6 m-20 -69.77 -31.11 68.88 Favored 'General case' 0 CA--C 1.54 0.565 0 CA-C-N 114.847 -1.069 . . . . 0.0 110.574 -178.021 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 2.8 m-70 -70.32 -28.44 65.16 Favored 'General case' 0 N--CA 1.485 1.282 0 C-N-CA 123.576 0.75 . . . . 0.0 111.607 174.734 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 44.9 tp -60.29 -53.26 59.72 Favored 'General case' 0 N--CA 1.478 0.968 0 CA-C-O 121.739 0.781 . . . . 0.0 109.911 -178.724 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 86' ' ' PHE . . . . . 0.448 ' HA ' ' HE2' ' A' ' 91' ' ' PHE . 6.3 m-85 -75.48 -31.4 60.22 Favored 'General case' 0 CA--C 1.549 0.935 0 CA-C-N 113.771 -1.559 . . . . 0.0 111.079 -175.42 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 10.4 tp10 -69.16 -40.49 78.15 Favored 'General case' 0 N--CA 1.482 1.158 0 C-N-CA 124.103 0.961 . . . . 0.0 111.719 -173.436 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 37.0 p -109.56 2.8 20.61 Favored 'General case' 0 N--CA 1.484 1.256 0 C-N-CA 123.28 0.632 . . . . 0.0 111.689 -178.622 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 89' ' ' LYS . . . . . 0.44 ' HA ' ' CE2' ' A' ' 91' ' ' PHE . 48.7 mtpt 59.34 44.7 14.94 Favored 'General case' 0 N--CA 1.478 0.949 0 C-N-CA 124.391 1.076 . . . . 0.0 112.225 179.843 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 90' ' ' ARG . . . . . 0.483 HH11 ' HD1' ' A' ' 56' ' ' PHE . 20.5 mtt180 -67.94 -7.39 28.16 Favored 'General case' 0 N--CA 1.486 1.355 0 C-N-CA 124.426 1.09 . . . . 0.0 113.266 178.547 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 91' ' ' PHE . . . . . 0.448 ' HE2' ' HA ' ' A' ' 86' ' ' PHE . 36.7 p90 -77.67 161.91 27.41 Favored 'General case' 0 CA--C 1.541 0.603 0 C-N-CA 124.118 0.967 . . . . 0.0 111.651 171.622 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 61.7 tttm . . . . . 0 C--O 1.25 1.112 0 C-N-CA 124.177 0.991 . . . . 0.0 109.581 178.178 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 9.8 ptp85 . . . . . 0 CA--C 1.544 0.75 0 CA-C-O 120.944 0.402 . . . . 0.0 111.132 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -95.78 -15.85 22.29 Favored 'General case' 0 N--CA 1.476 0.871 0 C-N-CA 123.185 0.594 . . . . 0.0 110.936 -176.237 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 29' ' ' TRP . . . . . . . . . . . . . 8.5 m-90 -142.94 157.78 44.24 Favored 'General case' 0 N--CA 1.482 1.155 0 C-N-CA 123.983 0.913 . . . . 0.0 109.879 -174.623 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 11.9 m -82.49 161.71 22.29 Favored 'General case' 0 CA--C 1.549 0.928 0 N-CA-C 108.065 -1.087 . . . . 0.0 108.065 168.495 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . 0.534 ' HA ' HD11 ' A' ' 34' ' ' LEU . 4.6 p -52.92 -39.64 32.91 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.399 0 C-N-CA 123.924 0.89 . . . . 0.0 111.796 -179.757 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 11.4 pt-20 -66.39 -43.21 86.49 Favored 'General case' 0 N--CA 1.479 1.022 0 C-N-CA 124.716 1.206 . . . . 0.0 111.263 177.483 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 48.1 mt-30 -64.7 -32.68 74.46 Favored 'General case' 0 N--CA 1.477 0.923 0 C-N-CA 123.525 0.73 . . . . 0.0 110.935 -179.038 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . 0.534 HD11 ' HA ' ' A' ' 31' ' ' VAL . 51.6 mt -66.36 -50.35 63.83 Favored 'General case' 0 N--CA 1.47 0.548 0 O-C-N 124.112 0.883 . . . . 0.0 110.965 176.012 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 29.8 mtp180 -68.72 -18.99 64.34 Favored 'General case' 0 N--CA 1.475 0.795 0 C-N-CA 124.38 1.072 . . . . 0.0 111.665 -178.139 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 46.6 t -60.34 123.85 18.52 Favored 'General case' 0 CA--C 1.544 0.742 0 O-C-N 123.657 0.598 . . . . 0.0 110.251 176.162 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -55.53 -28.94 57.76 Favored 'General case' 0 CA--C 1.549 0.935 0 C-N-CA 125.057 1.343 . . . . 0.0 112.981 -177.056 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 91.3 mt-30 -65.17 -34.97 79.66 Favored 'General case' 0 N--CA 1.48 1.041 0 C-N-CA 123.927 0.891 . . . . 0.0 112.362 -177.774 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . 0.443 HD21 ' HD2' ' A' ' 40' ' ' PRO . 1.2 tt -69.2 123.09 87.53 Favored Pre-proline 0 N--CA 1.488 1.433 0 N-CA-C 109.154 -0.684 . . . . 0.0 109.154 -178.904 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 40' ' ' PRO . . . . . 0.455 ' HB2' ' HG2' ' A' ' 42' ' ' LYS . 35.1 Cg_endo -62.82 128.95 24.57 Favored 'Trans proline' 0 C--N 1.37 1.709 0 C-N-CA 122.149 1.899 . . . . 0.0 112.02 173.278 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 35.9 mtmm -56.71 -36.7 69.98 Favored 'General case' 0 N--CA 1.483 1.186 0 C-N-CA 123.922 0.889 . . . . 0.0 111.671 178.603 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . 0.455 ' HG2' ' HB2' ' A' ' 40' ' ' PRO . 19.2 ptpt -58.9 -34.39 71.62 Favored 'General case' 0 N--CA 1.474 0.772 0 C-N-CA 124.015 0.926 . . . . 0.0 111.6 -177.856 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 3.4 t70 -73.47 -36.22 65.81 Favored 'General case' 0 CA--C 1.54 0.594 0 CA-C-N 115.457 -0.792 . . . . 0.0 109.707 -176.415 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 44' ' ' ILE . . . . . 0.4 ' HB ' HD12 ' A' ' 78' ' ' LEU . 38.1 mt -68.61 -46.79 79.4 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.927 0 CA-C-N 115.742 -0.663 . . . . 0.0 110.023 177.702 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 74.7 mt -55.52 -42.82 69.92 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.593 0 C-N-CA 123.754 0.821 . . . . 0.0 110.495 174.88 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 38.2 ttpt -59.24 -36.43 75.44 Favored 'General case' 0 CA--C 1.55 0.945 0 C-N-CA 124.516 1.126 . . . . 0.0 111.178 179.154 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 18.7 t80 -69.69 -47.72 62.2 Favored 'General case' 0 N--CA 1.48 1.057 0 CA-C-N 115.634 -0.712 . . . . 0.0 111.027 176.272 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 90.5 mt -71.82 -32.79 67.92 Favored 'General case' 0 N--CA 1.476 0.851 0 C-N-CA 123.935 0.894 . . . . 0.0 112.885 -171.588 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . 0.41 ' HA ' HD21 ' A' ' 57' ' ' LEU . 3.5 pt20 -82.44 -27.95 31.61 Favored 'General case' 0 N--CA 1.484 1.264 0 CA-C-N 117.747 0.249 . . . . 0.0 111.231 -179.989 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 9.9 tp10 -69.69 -33.66 72.86 Favored 'General case' 0 N--CA 1.475 0.79 0 C-N-CA 123.353 0.661 . . . . 0.0 110.797 -179.402 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 66.2 m80 -112.06 -43.15 3.61 Favored 'General case' 0 N--CA 1.474 0.756 0 CA-C-N 115.309 -0.86 . . . . 0.0 112.381 -171.182 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . 0.416 ' HA2' ' HA ' ' A' ' 91' ' ' PHE . . . -65.41 132.74 35.64 Favored Glycine 0 N--CA 1.47 0.923 0 CA-C-O 119.346 -0.696 . . . . 0.0 111.899 171.976 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 20.1 t -80.28 168.52 18.95 Favored 'General case' 0 N--CA 1.48 1.073 0 CA-C-N 117.342 0.571 . . . . 0.0 110.165 -178.074 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 6.2 p-10 -58.87 -34.61 71.8 Favored 'General case' 0 N--CA 1.488 1.463 0 C-N-CA 124.345 1.058 . . . . 0.0 113.661 -169.313 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 23.1 m -72.93 -24.99 60.88 Favored 'General case' 0 N--CA 1.484 1.249 0 C-N-CA 122.748 0.419 . . . . 0.0 111.733 -179.421 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 56' ' ' PHE . . . . . 0.462 ' HB2' ' HB3' ' A' ' 90' ' ' ARG . 63.9 t80 -75.68 -49.93 16.89 Favored 'General case' 0 C--O 1.241 0.641 0 C-N-CA 123.445 0.698 . . . . 0.0 109.264 169.002 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . 0.41 HD21 ' HA ' ' A' ' 49' ' ' GLN . 62.0 mt -59.72 -50.64 73.04 Favored 'General case' 0 C--O 1.211 -0.938 0 CA-C-N 114.879 -1.055 . . . . 0.0 112.068 -168.892 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -60.42 -38.64 84.7 Favored 'General case' 0 N--CA 1.482 1.169 0 C-N-CA 123.497 0.719 . . . . 0.0 112.215 -175.403 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 12.3 mm-40 -67.27 -23.25 65.66 Favored 'General case' 0 N--CA 1.478 0.939 0 C-N-CA 123.176 0.59 . . . . 0.0 112.114 179.297 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 88.1 m-70 -115.99 7.28 14.31 Favored 'General case' 0 N--CA 1.484 1.274 0 C-N-CA 123.554 0.742 . . . . 0.0 111.332 176.275 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 48.3 mtpt 47.33 44.81 16.49 Favored 'General case' 0 N--CA 1.488 1.472 0 C-N-CA 125.119 1.368 . . . . 0.0 112.948 -178.934 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 66.8 mt -94.04 -11.42 30.76 Favored 'General case' 0 N--CA 1.478 0.951 0 C-N-CA 124.04 0.936 . . . . 0.0 111.931 -179.07 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 1.4 pp -79.44 -178.06 6.09 Favored 'General case' 0 N--CA 1.484 1.254 0 CA-C-O 121.357 0.598 . . . . 0.0 111.793 178.762 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 77.35 -142.44 27.14 Favored Glycine 0 C--N 1.341 0.828 0 CA-C-N 114.827 -1.078 . . . . 0.0 112.17 177.557 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 79.3 m-20 -82.04 131.06 35.24 Favored 'General case' 0 N--CA 1.469 0.481 0 N-CA-C 109.173 -0.677 . . . . 0.0 109.173 177.866 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 69.8 mt -57.49 -40.47 74.85 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.055 0 C-N-CA 123.478 0.711 . . . . 0.0 110.568 179.519 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 38.8 mtmm -55.19 -48.22 74.14 Favored 'General case' 0 N--CA 1.485 1.285 0 C-N-CA 123.332 0.653 . . . . 0.0 111.69 177.01 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 3.3 m-20 -54.46 -41.71 69.79 Favored 'General case' 0 N--CA 1.49 1.558 0 C-N-CA 123.742 0.817 . . . . 0.0 111.606 177.905 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 22.3 t -73.07 -38.77 56.16 Favored 'Isoleucine or valine' 0 CA--C 1.551 0.996 0 CA-C-N 115.648 -0.705 . . . . 0.0 110.454 179.396 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -73.78 -26.46 60.65 Favored 'General case' 0 N--CA 1.488 1.432 0 C-N-CA 123.485 0.714 . . . . 0.0 112.592 -173.254 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 22.4 ptmt -81.88 -18.66 43.0 Favored 'General case' 0 N--CA 1.485 1.293 0 C-N-CA 122.704 0.402 . . . . 0.0 111.817 -176.232 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 9.5 t -118.42 -34.8 3.94 Favored 'General case' 0 N--CA 1.484 1.234 0 C-N-CA 123.146 0.578 . . . . 0.0 111.754 -174.56 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . 0.441 ' HB1' ' ND1' ' A' ' 77' ' ' HIS . . . -98.35 141.25 31.47 Favored 'General case' 0 N--CA 1.471 0.586 0 C-N-CA 123.455 0.702 . . . . 0.0 110.219 -174.332 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 74' ' ' ASN . . . . . 0.435 ' ND2' ' HB3' ' A' ' 76' ' ' ASP . 26.9 p-10 -97.25 175.5 6.25 Favored 'General case' 0 N--CA 1.474 0.761 0 C-N-CA 123.603 0.761 . . . . 0.0 111.014 -176.043 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . 0.44 ' O ' HG23 ' A' ' 79' ' ' VAL . 32.0 ttmt -70.06 -38.82 75.88 Favored 'General case' 0 CA--C 1.541 0.602 0 C-N-CA 123.958 0.903 . . . . 0.0 111.269 -177.357 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 76' ' ' ASP . . . . . 0.435 ' HB3' ' ND2' ' A' ' 74' ' ' ASN . 24.0 t70 -58.77 -37.14 75.63 Favored 'General case' 0 N--CA 1.488 1.467 0 C-N-CA 123.577 0.751 . . . . 0.0 110.929 179.022 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 77' ' ' HIS . . . . . 0.441 ' ND1' ' HB1' ' A' ' 73' ' ' ALA . 4.1 t-80 -59.09 -47.56 84.81 Favored 'General case' 0 N--CA 1.476 0.86 0 C-N-CA 124.543 1.137 . . . . 0.0 110.818 173.262 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . 0.4 HD12 ' HB ' ' A' ' 44' ' ' ILE . 70.7 mt -65.68 -41.33 92.56 Favored 'General case' 0 N--CA 1.477 0.898 0 C-N-CA 123.372 0.669 . . . . 0.0 111.58 -172.268 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 79' ' ' VAL . . . . . 0.532 HG21 ' HB3' ' A' ' 34' ' ' LEU . 45.7 t -67.14 -44.71 87.75 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.697 0 C-N-CA 123.985 0.914 . . . . 0.0 110.552 -179.243 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 99.6 m -59.33 -50.01 75.62 Favored 'General case' 0 N--CA 1.477 0.876 0 C-N-CA 123.535 0.734 . . . . 0.0 110.924 176.185 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -62.35 -38.02 87.91 Favored 'General case' 0 N--CA 1.477 0.895 0 C-N-CA 123.545 0.738 . . . . 0.0 111.028 179.618 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 82' ' ' TYR . . . . . 0.412 ' O ' ' HB3' ' A' ' 85' ' ' LEU . 7.6 t80 -56.31 -54.16 48.75 Favored 'General case' 0 N--CA 1.476 0.854 0 C-N-CA 124.867 1.267 . . . . 0.0 111.614 177.67 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 83' ' ' ASN . . . . . . . . . . . . . 64.7 m-80 -66.14 -45.71 80.07 Favored 'General case' 0 N--CA 1.483 1.182 0 C-N-CA 122.849 0.46 . . . . 0.0 110.524 -176.953 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 15.2 m-70 -64.58 -26.16 68.29 Favored 'General case' 0 N--CA 1.481 1.097 0 C-N-CA 124.096 0.958 . . . . 0.0 111.295 -179.35 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 85' ' ' LEU . . . . . 0.413 HD11 ' HB3' ' A' ' 91' ' ' PHE . 25.2 tp -58.18 -54.28 48.72 Favored 'General case' 0 N--CA 1.481 1.109 0 C-N-CA 123.679 0.792 . . . . 0.0 110.724 176.59 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 86' ' ' PHE . . . . . 0.401 ' HA ' ' HE2' ' A' ' 91' ' ' PHE . 8.8 m-85 -74.87 -30.59 61.37 Favored 'General case' 0 CA--C 1.544 0.713 0 CA-C-N 113.539 -1.664 . . . . 0.0 111.0 -176.873 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 10.9 tp10 -67.69 -32.5 73.2 Favored 'General case' 0 N--CA 1.475 0.811 0 C-N-CA 124.144 0.978 . . . . 0.0 111.476 -174.436 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 43.3 p -113.94 -9.07 13.07 Favored 'General case' 0 N--CA 1.477 0.923 0 C-N-CA 123.972 0.909 . . . . 0.0 110.982 179.806 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 52.6 mtpt 62.93 41.1 8.82 Favored 'General case' 0 N--CA 1.481 1.081 0 C-N-CA 124.492 1.117 . . . . 0.0 112.415 174.338 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 90' ' ' ARG . . . . . 0.462 ' HB3' ' HB2' ' A' ' 56' ' ' PHE . 54.2 mtt180 -76.82 -5.81 49.79 Favored 'General case' 0 N--CA 1.487 1.423 0 C-N-CA 124.189 0.996 . . . . 0.0 112.735 -178.893 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 91' ' ' PHE . . . . . 0.416 ' HA ' ' HA2' ' A' ' 52' ' ' GLY . 5.5 p90 -61.9 150.8 36.52 Favored 'General case' 0 N--CA 1.472 0.664 0 C-N-CA 123.041 0.536 . . . . 0.0 112.309 175.475 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 86.2 tttt . . . . . 0 CA--C 1.549 0.914 0 CA-C-N 114.819 -1.082 . . . . 0.0 109.631 -179.155 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.475 0.785 0 N-CA-C 112.566 0.58 . . . . 0.0 112.566 . . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -89.68 -29.51 18.73 Favored 'General case' 0 CA--C 1.544 0.748 0 CA-C-N 115.888 -0.597 . . . . 0.0 109.423 174.125 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 29' ' ' TRP . . . . . . . . . . . . . 6.8 m-90 -141.12 160.59 39.76 Favored 'General case' 0 N--CA 1.487 1.418 0 C-N-CA 124.301 1.041 . . . . 0.0 110.018 -177.925 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 74.5 p -88.44 170.23 11.09 Favored 'General case' 0 N--CA 1.472 0.643 0 C-N-CA 123.172 0.589 . . . . 0.0 109.463 175.261 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . 0.488 ' HA ' HD11 ' A' ' 34' ' ' LEU . 14.5 p -62.22 -37.15 77.84 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.416 0 C-N-CA 123.154 0.582 . . . . 0.0 111.817 -173.143 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 9.9 pt-20 -70.32 -34.04 72.22 Favored 'General case' 0 N--CA 1.479 0.98 0 C-N-CA 124.167 0.987 . . . . 0.0 111.304 177.682 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 16.0 mm100 -70.82 -36.17 72.82 Favored 'General case' 0 N--CA 1.475 0.785 0 C-N-CA 122.809 0.444 . . . . 0.0 110.701 173.385 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . 0.542 ' HA ' HD21 ' A' ' 39' ' ' LEU . 92.1 mt -66.07 -53.58 36.53 Favored 'General case' 0 N--CA 1.475 0.792 0 C-N-CA 123.195 0.598 . . . . 0.0 110.614 -177.383 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 9.7 ptp180 -66.35 -21.19 66.24 Favored 'General case' 0 N--CA 1.477 0.879 0 CA-C-N 115.071 -0.968 . . . . 0.0 111.742 -174.323 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 42.0 t -57.11 126.78 28.76 Favored 'General case' 0 C--N 1.354 0.766 0 C-N-CA 123.941 0.897 . . . . 0.0 110.84 176.372 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 16.4 mp0 -63.91 -32.92 74.61 Favored 'General case' 0 CA--C 1.544 0.741 0 C-N-CA 123.339 0.655 . . . . 0.0 110.864 -179.616 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 1.8 mp0 -78.2 0.65 24.26 Favored 'General case' 0 N--CA 1.478 0.959 0 C-N-CA 123.597 0.759 . . . . 0.0 112.318 179.237 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . 0.542 HD21 ' HA ' ' A' ' 34' ' ' LEU . 62.4 tp -97.96 111.22 58.64 Favored Pre-proline 0 C--O 1.248 0.996 0 N-CA-C 106.5 -1.667 . . . . 0.0 106.5 158.58 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 32.5 Cg_exo -58.02 135.48 68.92 Favored 'Trans proline' 0 C--N 1.382 2.303 0 C-N-CA 122.662 2.241 . . . . 0.0 112.459 -178.981 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 41' ' ' LYS . . . . . 0.542 ' HG2' ' HE3' ' A' ' 75' ' ' LYS . 53.7 mtpt -56.71 -37.57 71.12 Favored 'General case' 0 N--CA 1.476 0.861 0 C-N-CA 124.885 1.274 . . . . 0.0 111.372 179.675 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 18.1 ptpt -63.31 -32.16 73.5 Favored 'General case' 0 C--O 1.217 -0.622 0 O-C-N 124.117 0.886 . . . . 0.0 112.08 -178.2 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 2.5 m-20 -65.32 -41.17 94.26 Favored 'General case' 0 N--CA 1.487 1.376 0 CA-C-O 120.782 0.325 . . . . 0.0 110.868 176.187 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 57.7 mt -69.16 -50.48 52.5 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.887 0 C-N-CA 123.468 0.707 . . . . 0.0 110.34 -178.835 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 75.8 mt -62.02 -38.5 80.93 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.062 0 C-N-CA 123.513 0.725 . . . . 0.0 110.867 179.495 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -58.09 -50.34 73.8 Favored 'General case' 0 N--CA 1.482 1.141 0 N-CA-C 108.86 -0.793 . . . . 0.0 108.86 175.63 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 27.7 t80 -58.65 -51.92 67.86 Favored 'General case' 0 CA--C 1.548 0.866 0 O-C-N 124.515 1.135 . . . . 0.0 111.069 -178.813 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 92.6 mt -69.62 -30.55 68.3 Favored 'General case' 0 N--CA 1.475 0.803 0 C-N-CA 123.822 0.849 . . . . 0.0 112.203 -173.826 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 2.9 pt20 -82.07 -26.11 33.96 Favored 'General case' 0 N--CA 1.484 1.258 0 C-N-CA 122.384 0.273 . . . . 0.0 110.629 177.174 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 43.1 tt0 -68.71 -22.47 64.34 Favored 'General case' 0 N--CA 1.484 1.243 0 C-N-CA 124.07 0.948 . . . . 0.0 111.811 -177.69 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 56.5 p-80 -127.79 -26.53 2.93 Favored 'General case' 0 N--CA 1.487 1.406 0 N-CA-C 112.635 0.606 . . . . 0.0 112.635 178.013 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -66.57 138.82 36.26 Favored Glycine 0 C--N 1.344 1.007 0 CA-C-O 119.506 -0.608 . . . . 0.0 112.715 178.924 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 53' ' ' SER . . . . . 0.438 ' O ' ' HG ' ' A' ' 57' ' ' LEU . 47.4 t -65.77 147.25 53.68 Favored 'General case' 0 N--CA 1.478 0.933 0 N-CA-C 109.677 -0.49 . . . . 0.0 109.677 178.515 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 8.8 p-10 -61.58 -28.18 69.16 Favored 'General case' 0 N--CA 1.485 1.303 0 C-N-CA 123.529 0.732 . . . . 0.0 111.937 -174.872 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 42.0 p -62.85 -44.13 96.96 Favored 'General case' 0 CA--C 1.552 1.05 0 C-N-CA 124.371 1.068 . . . . 0.0 111.141 174.836 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 67.2 t80 -64.27 -45.78 86.58 Favored 'General case' 0 N--CA 1.482 1.146 0 C-N-CA 124.277 1.031 . . . . 0.0 109.733 174.185 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . 0.438 ' HG ' ' O ' ' A' ' 53' ' ' SER . 75.7 mt -63.6 -29.7 70.91 Favored 'General case' 0 C--O 1.214 -0.775 0 CA-C-N 114.415 -1.266 . . . . 0.0 111.161 -176.073 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -71.34 -47.96 53.27 Favored 'General case' 0 N--CA 1.475 0.788 0 C-N-CA 123.237 0.615 . . . . 0.0 110.884 176.189 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 41.0 mt-10 -58.35 -36.12 72.97 Favored 'General case' 0 N--CA 1.491 1.583 0 C-N-CA 123.907 0.883 . . . . 0.0 111.661 178.082 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 41.2 m-70 -107.42 -2.05 20.9 Favored 'General case' 0 N--CA 1.486 1.339 0 C-N-CA 123.465 0.706 . . . . 0.0 112.062 -174.454 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 95.8 mttt 54.33 38.61 29.77 Favored 'General case' 0 N--CA 1.492 1.648 0 C-N-CA 124.678 1.191 . . . . 0.0 112.775 -179.935 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 85.9 mt -88.26 -8.89 54.53 Favored 'General case' 0 N--CA 1.479 0.986 0 C-N-CA 123.15 0.58 . . . . 0.0 111.164 176.653 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -80.17 166.78 21.12 Favored 'General case' 0 N--CA 1.485 1.318 0 CA-C-O 120.917 0.389 . . . . 0.0 111.168 174.632 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 92.63 -168.76 30.8 Favored Glycine 0 C--N 1.34 0.799 0 CA-C-N 115.22 -0.9 . . . . 0.0 112.155 -179.477 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 16.0 m120 -60.79 120.43 10.11 Favored 'General case' 0 N--CA 1.472 0.626 0 C-N-CA 123.232 0.613 . . . . 0.0 109.668 179.306 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 26.9 mt -61.33 -47.9 91.36 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.766 0 C-N-CA 124.039 0.936 . . . . 0.0 111.65 -167.069 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.66 -31.85 72.8 Favored 'General case' 0 N--CA 1.487 1.4 0 C-N-CA 123.748 0.819 . . . . 0.0 111.369 177.615 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 6.0 t30 -69.89 -36.43 75.43 Favored 'General case' 0 N--CA 1.483 1.22 0 C-N-CA 124.429 1.092 . . . . 0.0 110.609 178.396 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 47.7 t -73.06 -34.98 46.97 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.925 0 CA-C-N 115.83 -0.623 . . . . 0.0 109.502 172.274 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -73.44 -6.7 47.99 Favored 'General case' 0 N--CA 1.477 0.922 0 C-N-CA 124.207 1.003 . . . . 0.0 113.062 -174.538 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 22.3 ptmt -97.5 -26.66 14.75 Favored 'General case' 0 N--CA 1.48 1.052 0 CA-C-N 118.507 0.594 . . . . 0.0 112.271 173.454 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 8.8 t -112.08 -36.72 5.27 Favored 'General case' 0 N--CA 1.484 1.236 0 N-CA-C 112.787 0.662 . . . . 0.0 112.787 -166.734 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -91.2 102.46 15.18 Favored 'General case' 0 N--CA 1.472 0.661 0 N-CA-C 107.927 -1.138 . . . . 0.0 107.927 177.558 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 74' ' ' ASN . . . . . 0.437 ' O ' ' HG ' ' A' ' 78' ' ' LEU . 9.4 p30 -65.96 167.67 9.35 Favored 'General case' 0 N--CA 1.486 1.35 0 C-N-CA 123.863 0.865 . . . . 0.0 112.093 -169.687 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . 0.542 ' HE3' ' HG2' ' A' ' 41' ' ' LYS . 4.7 tppp? -63.08 -41.32 99.39 Favored 'General case' 0 CA--C 1.55 0.965 0 C-N-CA 122.9 0.48 . . . . 0.0 112.257 -174.014 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 19.1 t70 -60.38 -36.92 79.18 Favored 'General case' 0 N--CA 1.492 1.674 0 C-N-CA 123.52 0.728 . . . . 0.0 110.817 178.561 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 77' ' ' HIS . . . . . 0.403 ' HB3' ' O ' ' A' ' 74' ' ' ASN . 29.9 t60 -63.78 -39.73 94.95 Favored 'General case' 0 N--CA 1.479 0.983 0 C-N-CA 125.257 1.423 . . . . 0.0 110.466 175.206 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . 0.437 ' HG ' ' O ' ' A' ' 74' ' ' ASN . 40.9 mt -70.42 -38.89 74.66 Favored 'General case' 0 N--CA 1.487 1.417 0 C-N-CA 123.427 0.691 . . . . 0.0 111.91 -177.742 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 69.1 t -64.52 -46.09 93.7 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.904 0 C-N-CA 123.994 0.918 . . . . 0.0 110.27 179.526 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 51.1 m -62.14 -42.63 99.43 Favored 'General case' 0 N--CA 1.479 0.986 0 C-N-CA 123.418 0.687 . . . . 0.0 111.259 177.497 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -62.74 -43.4 98.9 Favored 'General case' 0 N--CA 1.477 0.882 0 C-N-CA 123.585 0.754 . . . . 0.0 110.837 177.676 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 82' ' ' TYR . . . . . . . . . . . . . 17.4 t80 -52.92 -57.9 8.74 Favored 'General case' 0 N--CA 1.473 0.691 0 C-N-CA 124.754 1.221 . . . . 0.0 110.519 178.751 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 83' ' ' ASN . . . . . . . . . . . . . 52.9 m-80 -64.9 -43.9 91.33 Favored 'General case' 0 N--CA 1.481 1.092 0 N-CA-C 112.429 0.529 . . . . 0.0 112.429 -171.067 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 88.6 m-70 -70.88 -24.42 62.49 Favored 'General case' 0 N--CA 1.48 1.062 0 C-N-CA 123.687 0.795 . . . . 0.0 112.083 -178.397 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 17.3 tp -58.76 -53.45 58.19 Favored 'General case' 0 N--CA 1.485 1.279 0 CA-C-O 121.903 0.858 . . . . 0.0 110.888 175.859 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 86' ' ' PHE . . . . . 0.415 ' HA ' ' HE2' ' A' ' 91' ' ' PHE . 56.7 m-85 -72.81 -36.35 67.52 Favored 'General case' 0 C--O 1.234 0.261 0 CA-C-N 113.937 -1.483 . . . . 0.0 110.87 -178.419 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 40.2 tt0 -59.33 -48.85 80.09 Favored 'General case' 0 N--CA 1.473 0.692 0 O-C-N 124.008 0.817 . . . . 0.0 112.202 -171.835 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 19.0 p -109.99 16.32 21.98 Favored 'General case' 0 N--CA 1.475 0.808 0 C-N-CA 123.241 0.616 . . . . 0.0 111.542 -178.897 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 47.3 mmtm 57.61 37.66 27.55 Favored 'General case' 0 N--CA 1.488 1.447 0 C-N-CA 123.95 0.9 . . . . 0.0 111.98 170.743 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 52.6 mtt-85 -70.79 -8.32 51.54 Favored 'General case' 0 N--CA 1.482 1.136 0 C-N-CA 124.126 0.97 . . . . 0.0 112.78 -176.621 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 91' ' ' PHE . . . . . 0.415 ' HE2' ' HA ' ' A' ' 86' ' ' PHE . 13.9 p90 -76.98 157.19 31.39 Favored 'General case' 0 N--CA 1.469 0.491 0 C-N-CA 123.139 0.576 . . . . 0.0 111.499 173.747 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 11.7 tmtt? . . . . . 0 CA--C 1.544 0.733 0 N-CA-C 107.062 -1.458 . . . . 0.0 107.062 -179.502 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.475 0.804 0 CA-C-O 120.607 0.241 . . . . 0.0 111.572 . . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -108.98 -39.47 5.29 Favored 'General case' 0 N--CA 1.476 0.839 0 C-N-CA 123.23 0.612 . . . . 0.0 110.551 179.941 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 29' ' ' TRP . . . . . . . . . . . . . 3.6 m-90 -128.92 144.98 51.34 Favored 'General case' 0 N--CA 1.481 1.079 0 C-N-CA 123.972 0.909 . . . . 0.0 109.023 -176.495 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 20.2 p -83.53 169.6 15.27 Favored 'General case' 0 N--CA 1.474 0.77 0 C-N-CA 122.947 0.499 . . . . 0.0 109.789 -178.519 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . 0.549 ' HA ' HD12 ' A' ' 34' ' ' LEU . 7.4 p -56.98 -34.9 45.76 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.378 0 C-N-CA 122.887 0.475 . . . . 0.0 111.737 -173.844 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 12.9 pt-20 -67.19 -41.18 86.3 Favored 'General case' 0 N--CA 1.474 0.742 0 C-N-CA 123.814 0.846 . . . . 0.0 111.457 177.251 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 12.9 mm-40 -68.9 -35.24 76.62 Favored 'General case' 0 N--CA 1.477 0.902 0 C-N-CA 123.328 0.651 . . . . 0.0 111.266 178.792 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . 0.549 HD12 ' HA ' ' A' ' 31' ' ' VAL . 66.3 mt -65.73 -45.64 81.88 Favored 'General case' 0 N--CA 1.472 0.643 0 O-C-N 123.618 0.573 . . . . 0.0 111.0 -179.693 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 93.0 mtt-85 -79.01 -15.86 57.67 Favored 'General case' 0 CA--C 1.546 0.815 0 CA-C-N 115.419 -0.81 . . . . 0.0 111.352 179.637 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 40.0 t -63.83 138.65 58.57 Favored 'General case' 0 N--CA 1.48 1.057 0 C-N-CA 123.235 0.614 . . . . 0.0 111.414 -179.597 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 12.4 pt-20 -65.65 -18.86 65.63 Favored 'General case' 0 CA--C 1.551 1.014 0 C-N-CA 124.563 1.145 . . . . 0.0 111.97 179.989 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 76.3 mt-30 -73.42 -51.36 17.53 Favored 'General case' 0 CA--C 1.54 0.568 0 C-N-CA 124.116 0.966 . . . . 0.0 111.072 -177.984 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 46.7 tp -70.62 120.43 78.8 Favored Pre-proline 0 N--CA 1.478 0.941 0 CA-C-O 118.702 -0.666 . . . . 0.0 110.399 -176.189 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 24.6 Cg_exo -63.61 138.83 66.65 Favored 'Trans proline' 0 C--N 1.385 2.451 0 C-N-CA 122.747 2.298 . . . . 0.0 112.059 -179.19 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 21.5 ptmt -69.84 -32.36 70.72 Favored 'General case' 0 CA--C 1.537 0.444 0 C-N-CA 123.585 0.754 . . . . 0.0 110.825 -177.335 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 21.6 pttp -70.61 -28.83 65.15 Favored 'General case' 0 N--CA 1.474 0.753 0 C-N-CA 123.527 0.731 . . . . 0.0 110.915 175.994 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 28.0 t70 -69.24 -36.5 77.25 Favored 'General case' 0 N--CA 1.477 0.896 0 C-N-CA 122.543 0.337 . . . . 0.0 110.298 176.194 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 47.8 mt -66.34 -53.57 35.02 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.988 0 C-N-CA 122.878 0.471 . . . . 0.0 109.979 176.551 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 86.7 mt -55.91 -39.98 59.97 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.388 0 C-N-CA 123.959 0.903 . . . . 0.0 111.162 179.746 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 40.1 ttmt -57.49 -45.53 84.78 Favored 'General case' 0 N--CA 1.473 0.694 0 C-N-CA 123.703 0.801 . . . . 0.0 110.891 178.591 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 11.8 t80 -63.73 -48.29 77.63 Favored 'General case' 0 N--CA 1.471 0.606 0 O-C-N 123.897 0.748 . . . . 0.0 110.357 177.843 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 85.3 mt -68.86 -31.19 69.96 Favored 'General case' 0 CA--C 1.544 0.746 0 C-N-CA 123.201 0.6 . . . . 0.0 112.314 -172.742 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 3.2 pt20 -84.61 -36.36 22.07 Favored 'General case' 0 N--CA 1.484 1.25 0 N-CA-C 111.674 0.25 . . . . 0.0 111.674 179.79 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 12.6 tp10 -69.14 -39.17 78.99 Favored 'General case' 0 N--CA 1.481 1.125 0 CA-C-O 121.587 0.708 . . . . 0.0 110.252 179.781 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 3.0 t60 -93.43 -49.85 5.72 Favored 'General case' 0 N--CA 1.47 0.548 0 CA-C-N 114.63 -1.168 . . . . 0.0 110.467 -173.349 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . 0.464 ' HA2' ' HA ' ' A' ' 91' ' ' PHE . . . -65.0 144.9 48.76 Favored Glycine 0 C--N 1.349 1.262 0 O-C-N 123.527 0.517 . . . . 0.0 113.185 173.253 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 34.5 t -89.67 166.45 13.59 Favored 'General case' 0 CA--C 1.55 0.971 0 C-N-CA 123.744 0.817 . . . . 0.0 110.669 -178.494 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 48.7 m-20 -58.0 -36.16 72.26 Favored 'General case' 0 N--CA 1.494 1.757 0 C-N-CA 123.912 0.885 . . . . 0.0 112.978 -169.175 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 40.2 t -64.0 -31.59 72.83 Favored 'General case' 0 N--CA 1.476 0.847 0 C-N-CA 123.605 0.762 . . . . 0.0 111.493 -178.299 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 85.4 t80 -76.21 -45.7 31.85 Favored 'General case' 0 CA--C 1.546 0.825 0 C-N-CA 123.497 0.719 . . . . 0.0 110.282 171.285 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 45.7 mt -65.03 -33.44 76.04 Favored 'General case' 0 N--CA 1.478 0.935 0 CA-C-N 115.175 -0.921 . . . . 0.0 112.845 -169.701 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -68.4 -48.53 64.46 Favored 'General case' 0 N--CA 1.475 0.784 0 C-N-CA 122.62 0.368 . . . . 0.0 110.475 178.739 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 10.0 mm-40 -62.31 -33.5 74.8 Favored 'General case' 0 N--CA 1.476 0.87 0 CA-C-N 115.771 -0.649 . . . . 0.0 111.045 -178.484 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 34.5 m-70 -105.99 4.33 29.29 Favored 'General case' 0 N--CA 1.479 0.99 0 C-N-CA 123.223 0.609 . . . . 0.0 112.297 -178.214 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 46.0 mmtm 56.14 28.2 12.67 Favored 'General case' 0 N--CA 1.498 1.933 0 C-N-CA 124.377 1.071 . . . . 0.0 113.164 174.855 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . 0.479 HD13 ' HB3' ' A' ' 81' ' ' ALA . 92.2 mt -88.43 -8.85 54.3 Favored 'General case' 0 N--CA 1.481 1.094 0 C-N-CA 123.609 0.763 . . . . 0.0 112.061 -178.214 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 1.4 pp -67.48 167.34 12.94 Favored 'General case' 0 N--CA 1.477 0.913 0 C-N-CA 122.92 0.488 . . . . 0.0 111.44 177.727 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 77.01 -154.81 43.62 Favored Glycine 0 C--N 1.338 0.674 0 CA-C-N 115.653 -0.703 . . . . 0.0 113.623 174.695 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 65' ' ' ASN . . . . . 0.405 ' O ' HG22 ' A' ' 69' ' ' VAL . 15.9 m120 -64.57 124.66 22.44 Favored 'General case' 0 N--CA 1.472 0.658 0 C-N-CA 123.698 0.799 . . . . 0.0 110.609 -176.952 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 49.7 mt -58.03 -45.83 88.1 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.974 0 C-N-CA 124.127 0.971 . . . . 0.0 110.546 -179.327 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 17.7 mtpp -51.46 -46.02 62.94 Favored 'General case' 0 N--CA 1.482 1.175 0 C-N-CA 124.642 1.177 . . . . 0.0 111.714 174.714 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 68' ' ' ASN . . . . . 0.431 ' O ' ' HG2' ' A' ' 71' ' ' LYS . 7.8 t30 -64.57 -40.77 96.16 Favored 'General case' 0 N--CA 1.478 0.943 0 C-N-CA 123.484 0.714 . . . . 0.0 111.02 -179.169 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 69' ' ' VAL . . . . . 0.405 HG22 ' O ' ' A' ' 65' ' ' ASN . 18.4 t -71.4 -32.14 45.59 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.094 0 CA-C-O 121.018 0.437 . . . . 0.0 110.038 178.074 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -76.55 -16.33 59.64 Favored 'General case' 0 N--CA 1.485 1.288 0 C-N-CA 123.635 0.774 . . . . 0.0 112.229 -177.122 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . 0.431 ' HG2' ' O ' ' A' ' 68' ' ' ASN . 20.0 ptmt -94.76 -17.35 22.25 Favored 'General case' 0 N--CA 1.479 1.003 0 C-N-CA 122.367 0.267 . . . . 0.0 111.521 178.925 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 13.1 t -114.29 -35.32 5.02 Favored 'General case' 0 N--CA 1.479 1.006 0 C-N-CA 122.89 0.476 . . . . 0.0 111.777 -172.087 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -99.59 119.66 38.42 Favored 'General case' 0 N--CA 1.47 0.544 0 C-N-CA 124.048 0.939 . . . . 0.0 109.702 -176.082 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 27.8 p-10 -74.67 169.7 17.29 Favored 'General case' 0 N--CA 1.481 1.096 0 C-N-CA 123.563 0.745 . . . . 0.0 111.226 -177.171 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 15.0 tptm -60.23 -39.05 85.29 Favored 'General case' 0 N--CA 1.481 1.081 0 C-N-CA 124.029 0.932 . . . . 0.0 110.929 -174.122 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 29.7 t70 -64.4 -38.46 91.11 Favored 'General case' 0 N--CA 1.475 0.793 0 C-N-CA 124.125 0.97 . . . . 0.0 111.338 -179.099 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 31.1 t60 -59.8 -37.43 79.11 Favored 'General case' 0 N--CA 1.481 1.084 0 C-N-CA 124.213 1.005 . . . . 0.0 110.446 176.492 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 27.2 mt -72.72 -35.36 67.56 Favored 'General case' 0 N--CA 1.478 0.931 0 CA-C-N 115.78 -0.645 . . . . 0.0 111.278 -174.954 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 21.5 t -69.86 -40.72 79.23 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.69 0 C-N-CA 123.306 0.642 . . . . 0.0 109.712 175.11 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 43.3 m -57.73 -45.1 86.26 Favored 'General case' 0 N--CA 1.478 0.928 0 C-N-CA 123.783 0.833 . . . . 0.0 110.489 175.118 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 81' ' ' ALA . . . . . 0.479 ' HB3' HD13 ' A' ' 62' ' ' LEU . . . -66.48 -43.53 85.18 Favored 'General case' 0 CA--C 1.534 0.335 0 CA-C-N 115.719 -0.673 . . . . 0.0 110.927 -179.592 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 82' ' ' TYR . . . . . 0.492 ' HD1' HD21 ' A' ' 83' ' ' ASN . 18.4 t80 -53.67 -56.39 17.69 Favored 'General case' 0 CA--C 1.543 0.676 0 C-N-CA 124.079 0.952 . . . . 0.0 110.409 176.816 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 83' ' ' ASN . . . . . 0.492 HD21 ' HD1' ' A' ' 82' ' ' TYR . 0.9 OUTLIER -55.68 -51.24 67.94 Favored 'General case' 0 N--CA 1.489 1.493 0 C-N-CA 123.46 0.704 . . . . 0.0 111.081 -175.824 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 66.4 m-70 -70.43 -22.83 62.67 Favored 'General case' 0 CA--C 1.543 0.707 0 C-N-CA 124.553 1.141 . . . . 0.0 112.567 -175.771 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 42.4 tp -63.19 -55.32 26.08 Favored 'General case' 0 N--CA 1.483 1.212 0 CA-C-O 121.603 0.716 . . . . 0.0 110.986 177.96 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 86' ' ' PHE . . . . . 0.483 ' HA ' ' HE1' ' A' ' 91' ' ' PHE . 37.2 m-85 -75.86 -28.78 58.31 Favored 'General case' 0 N--CA 1.474 0.735 0 CA-C-N 114.101 -1.409 . . . . 0.0 111.83 -175.744 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 11.6 tp10 -68.61 -18.49 64.32 Favored 'General case' 0 N--CA 1.479 1.017 0 C-N-CA 123.12 0.568 . . . . 0.0 112.063 -176.343 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 18.1 p -129.04 -1.42 5.21 Favored 'General case' 0 N--CA 1.479 0.985 0 C-N-CA 123.761 0.824 . . . . 0.0 111.811 -179.722 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 73.1 mmtt 59.57 38.78 22.1 Favored 'General case' 0 N--CA 1.487 1.397 0 C-N-CA 124.558 1.143 . . . . 0.0 111.71 177.301 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 62.2 mtt180 -73.23 -11.04 60.37 Favored 'General case' 0 N--CA 1.49 1.556 0 C-N-CA 123.625 0.77 . . . . 0.0 112.765 -178.232 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 91' ' ' PHE . . . . . 0.483 ' HE1' ' HA ' ' A' ' 86' ' ' PHE . 50.3 p90 -81.88 156.24 24.91 Favored 'General case' 0 C--O 1.242 0.666 0 C-N-CA 123.244 0.618 . . . . 0.0 110.946 171.872 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 33.2 ttpt . . . . . 0 C--O 1.253 1.272 0 N-CA-C 107.425 -1.324 . . . . 0.0 107.425 170.671 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 CA--C 1.539 0.529 0 CA-C-O 120.904 0.383 . . . . 0.0 110.734 . . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -78.82 -31.96 46.02 Favored 'General case' 0 N--CA 1.467 0.412 0 CA-C-N 115.452 -0.795 . . . . 0.0 109.643 176.243 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 29' ' ' TRP . . . . . . . . . . . . . 3.4 m-90 -129.25 142.67 50.78 Favored 'General case' 0 N--CA 1.463 0.192 0 C-N-CA 124.439 1.096 . . . . 0.0 109.043 -175.456 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 42.7 p -82.03 174.75 10.95 Favored 'General case' 0 N--CA 1.473 0.691 0 C-N-CA 123.085 0.554 . . . . 0.0 109.597 173.648 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 7.5 p -58.62 -39.01 74.61 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.328 0 C-N-CA 122.732 0.413 . . . . 0.0 111.423 -176.799 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 11.4 pt-20 -69.32 -39.43 78.21 Favored 'General case' 0 N--CA 1.48 1.074 0 C-N-CA 123.58 0.752 . . . . 0.0 111.53 178.311 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 52.9 mt-30 -63.56 -36.76 84.85 Favored 'General case' 0 N--CA 1.481 1.083 0 C-N-CA 122.888 0.475 . . . . 0.0 110.807 177.963 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 89.7 mt -60.94 -51.48 69.09 Favored 'General case' 0 N--CA 1.48 1.045 0 O-C-N 123.473 0.483 . . . . 0.0 109.866 176.878 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 43.7 mtm105 -65.36 -18.87 65.66 Favored 'General case' 0 C--N 1.353 0.74 0 CA-C-N 114.43 -1.259 . . . . 0.0 111.865 -175.718 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 44.8 t -56.47 123.91 16.38 Favored 'General case' 0 C--N 1.354 0.789 0 N-CA-C 109.649 -0.5 . . . . 0.0 109.649 173.316 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 28.9 mt-10 -57.98 -37.1 73.58 Favored 'General case' 0 N--CA 1.474 0.749 0 C-N-CA 124.452 1.101 . . . . 0.0 111.278 -177.854 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 74.7 mt-30 -64.25 -30.21 71.27 Favored 'General case' 0 N--CA 1.475 0.794 0 C-N-CA 123.79 0.836 . . . . 0.0 111.484 -178.14 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 4.1 tt -81.05 113.0 37.39 Favored Pre-proline 0 CA--C 1.549 0.935 0 N-CA-C 107.553 -1.277 . . . . 0.0 107.553 172.692 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 40' ' ' PRO . . . . . 0.517 ' HB2' ' HG2' ' A' ' 42' ' ' LYS . 11.3 Cg_exo -70.55 147.34 57.59 Favored 'Trans proline' 0 C--N 1.371 1.717 0 C-N-CA 122.906 2.404 . . . . 0.0 112.81 -179.222 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 52.4 mtmt -56.83 -29.11 62.49 Favored 'General case' 0 N--CA 1.478 0.951 0 C-N-CA 124.602 1.161 . . . . 0.0 112.23 177.026 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . 0.517 ' HG2' ' HB2' ' A' ' 40' ' ' PRO . 17.4 ptpt -66.3 -36.91 84.16 Favored 'General case' 0 N--CA 1.47 0.533 0 C-N-CA 123.342 0.657 . . . . 0.0 111.71 -179.754 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 43' ' ' ASP . . . . . 0.472 ' HA ' ' HE2' ' A' ' 46' ' ' LYS . 2.3 m-20 -67.16 -35.36 79.52 Favored 'General case' 0 N--CA 1.479 1.009 0 O-C-N 123.293 0.37 . . . . 0.0 111.229 178.948 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 37.6 mt -65.65 -54.12 31.43 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.748 0 O-C-N 123.708 0.63 . . . . 0.0 109.635 177.949 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 68.0 mt -58.02 -39.52 72.62 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.253 0 C-N-CA 123.489 0.716 . . . . 0.0 111.096 177.945 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 46' ' ' LYS . . . . . 0.472 ' HE2' ' HA ' ' A' ' 43' ' ' ASP . 36.5 ttpt -59.92 -43.24 95.0 Favored 'General case' 0 N--CA 1.478 0.956 0 C-N-CA 124.086 0.955 . . . . 0.0 110.88 179.301 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 22.5 t80 -64.4 -47.13 80.36 Favored 'General case' 0 CA--C 1.548 0.889 0 CA-C-N 114.962 -1.017 . . . . 0.0 110.947 176.874 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 87.3 mt -70.82 -30.53 66.99 Favored 'General case' 0 N--CA 1.472 0.665 0 CA-C-N 115.326 -0.852 . . . . 0.0 111.741 -174.723 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . 0.458 ' HA ' HD23 ' A' ' 57' ' ' LEU . 3.4 pt20 -84.15 -27.5 28.08 Favored 'General case' 0 N--CA 1.482 1.13 0 C-N-CA 122.639 0.375 . . . . 0.0 110.909 177.748 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 14.4 tp10 -56.72 -37.26 70.71 Favored 'General case' 0 N--CA 1.475 0.816 0 C-N-CA 124.167 0.987 . . . . 0.0 111.505 179.699 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 31.9 m80 -129.99 -21.59 2.98 Favored 'General case' 0 N--CA 1.476 0.83 0 N-CA-C 113.032 0.753 . . . . 0.0 113.032 -177.46 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -60.18 136.34 49.73 Favored Glycine 0 N--CA 1.474 1.204 0 CA-C-N 118.694 0.679 . . . . 0.0 112.818 176.27 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 53' ' ' SER . . . . . 0.413 ' O ' ' HG ' ' A' ' 57' ' ' LEU . 39.7 t -64.08 158.71 22.03 Favored 'General case' 0 N--CA 1.481 1.089 0 C-N-CA 123.618 0.767 . . . . 0.0 110.752 179.133 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 7.2 p-10 -66.14 -29.58 69.9 Favored 'General case' 0 N--CA 1.483 1.181 0 C-N-CA 123.37 0.668 . . . . 0.0 111.396 -171.853 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 42.1 t -71.85 -38.43 70.09 Favored 'General case' 0 N--CA 1.473 0.694 0 C-N-CA 123.555 0.742 . . . . 0.0 110.722 175.397 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 57.4 t80 -63.44 -44.35 94.79 Favored 'General case' 0 N--CA 1.479 0.995 0 N-CA-C 109.14 -0.689 . . . . 0.0 109.14 174.771 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . 0.458 HD23 ' HA ' ' A' ' 49' ' ' GLN . 62.0 mt -68.05 -31.65 71.45 Favored 'General case' 0 C--O 1.222 -0.345 0 CA-C-N 115.243 -0.889 . . . . 0.0 111.081 -178.599 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -71.19 -50.06 37.16 Favored 'General case' 0 N--CA 1.472 0.65 0 C-N-CA 123.001 0.52 . . . . 0.0 111.212 177.632 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 27.1 mm-40 -73.79 -16.41 61.16 Favored 'General case' 0 N--CA 1.477 0.912 0 N-CA-C 112.335 0.495 . . . . 0.0 112.335 -176.851 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 44.6 m-70 -114.19 1.18 14.46 Favored 'General case' 0 N--CA 1.489 1.48 0 C-N-CA 123.176 0.59 . . . . 0.0 111.74 176.8 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 74.6 mmtt 58.09 30.51 19.4 Favored 'General case' 0 N--CA 1.493 1.708 0 C-N-CA 124.613 1.165 . . . . 0.0 113.103 174.499 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . 0.437 HD11 ' HB2' ' A' ' 81' ' ' ALA . 65.6 mt -90.41 -6.96 54.32 Favored 'General case' 0 N--CA 1.487 1.394 0 C-N-CA 123.755 0.822 . . . . 0.0 111.988 -176.415 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -74.57 173.73 10.0 Favored 'General case' 0 N--CA 1.477 0.923 0 C-N-CA 123.06 0.544 . . . . 0.0 111.699 177.196 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 82.6 -165.84 44.75 Favored Glycine 0 C--O 1.246 0.868 0 CA-C-N 115.353 -0.839 . . . . 0.0 112.919 178.278 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 45.5 t-20 -68.2 125.09 25.28 Favored 'General case' 0 C--O 1.241 0.646 0 N-CA-C 109.014 -0.735 . . . . 0.0 109.014 176.884 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 66' ' ' ILE . . . . . 0.429 HD11 ' HB2' ' A' ' 46' ' ' LYS . 32.5 mt -58.5 -53.22 49.71 Favored 'Isoleucine or valine' 0 C--O 1.214 -0.811 0 O-C-N 124.317 1.01 . . . . 0.0 111.707 -169.885 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 22.9 pttp -59.41 -34.92 73.06 Favored 'General case' 0 N--CA 1.489 1.489 0 C-N-CA 123.886 0.875 . . . . 0.0 112.99 -172.051 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 47.9 t30 -65.4 -45.29 84.55 Favored 'General case' 0 N--CA 1.473 0.692 0 C-N-CA 123.452 0.701 . . . . 0.0 110.115 178.86 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 97.3 t -70.61 -43.44 77.63 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.787 0 CA-C-N 115.162 -0.926 . . . . 0.0 110.91 178.167 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -59.22 -50.56 73.54 Favored 'General case' 0 N--CA 1.479 1.009 0 C-N-CA 124.875 1.27 . . . . 0.0 112.603 -167.121 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 19.4 ptpt -55.53 -45.41 77.19 Favored 'General case' 0 CA--C 1.558 1.26 0 O-C-N 123.863 0.727 . . . . 0.0 112.063 -179.545 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 13.3 t -93.0 -9.72 38.83 Favored 'General case' 0 N--CA 1.479 1.01 0 C-N-CA 123.662 0.785 . . . . 0.0 111.874 -173.981 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -93.41 118.03 30.81 Favored 'General case' 0 N--CA 1.472 0.662 0 N-CA-C 108.62 -0.881 . . . . 0.0 108.62 173.306 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 29.2 p-10 -73.98 148.54 42.0 Favored 'General case' 0 C--O 1.239 0.535 0 N-CA-C 109.78 -0.452 . . . . 0.0 109.78 176.9 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 39.2 ttmt -63.94 -26.71 68.71 Favored 'General case' 0 CA--C 1.541 0.602 0 C-N-CA 123.559 0.744 . . . . 0.0 111.124 -174.435 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 28.3 t70 -59.74 -40.66 88.83 Favored 'General case' 0 CA--C 1.544 0.739 0 C-N-CA 124.272 1.029 . . . . 0.0 111.28 177.758 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 75.0 t60 -66.37 -39.34 89.05 Favored 'General case' 0 N--CA 1.474 0.77 0 C-N-CA 123.955 0.902 . . . . 0.0 110.086 175.66 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 29.7 mt -69.87 -36.46 75.5 Favored 'General case' 0 N--CA 1.481 1.1 0 C-N-CA 123.348 0.659 . . . . 0.0 112.009 -174.693 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 77.2 t -67.83 -42.83 86.3 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.668 0 C-N-CA 123.849 0.859 . . . . 0.0 109.659 177.295 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 51.5 m -61.09 -40.38 93.5 Favored 'General case' 0 CA--C 1.549 0.91 0 C-N-CA 122.882 0.473 . . . . 0.0 110.725 175.046 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 81' ' ' ALA . . . . . 0.437 ' HB2' HD11 ' A' ' 62' ' ' LEU . . . -65.82 -40.64 92.01 Favored 'General case' 0 N--CA 1.474 0.745 0 C-N-CA 123.497 0.719 . . . . 0.0 111.011 177.414 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 82' ' ' TYR . . . . . . . . . . . . . 13.9 t80 -58.59 -55.34 36.32 Favored 'General case' 0 CA--C 1.541 0.629 0 CA-C-N 114.532 -1.213 . . . . 0.0 110.989 179.206 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 83' ' ' ASN . . . . . . . . . . . . . 67.3 m-80 -64.7 -44.08 91.41 Favored 'General case' 0 N--CA 1.483 1.176 0 C-N-CA 122.454 0.302 . . . . 0.0 111.161 -174.129 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 25.2 m-70 -64.3 -26.63 68.57 Favored 'General case' 0 N--CA 1.485 1.315 0 C-N-CA 123.708 0.803 . . . . 0.0 111.845 179.155 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 85' ' ' LEU . . . . . 0.481 HD12 ' HB2' ' A' ' 90' ' ' ARG . 53.6 tp -58.34 -52.95 63.43 Favored 'General case' 0 N--CA 1.482 1.13 0 CA-C-O 121.219 0.533 . . . . 0.0 111.163 177.327 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 45.3 m-85 -75.61 -35.68 60.47 Favored 'General case' 0 N--CA 1.475 0.807 0 CA-C-N 115.041 -0.981 . . . . 0.0 111.65 -178.65 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 17.4 tp10 -60.29 -47.05 87.65 Favored 'General case' 0 N--CA 1.473 0.68 0 C-N-CA 124.162 0.985 . . . . 0.0 111.613 -172.516 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 7.6 p -117.04 11.84 14.38 Favored 'General case' 0 CA--C 1.548 0.87 0 C-N-CA 123.999 0.919 . . . . 0.0 111.236 -179.583 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 27.2 mtpp 55.14 56.8 6.11 Favored 'General case' 0 N--CA 1.486 1.336 0 C-N-CA 125.241 1.416 . . . . 0.0 112.251 168.604 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 90' ' ' ARG . . . . . 0.481 ' HB2' HD12 ' A' ' 85' ' ' LEU . 11.7 mmm180 -73.26 -16.81 61.38 Favored 'General case' 0 N--CA 1.484 1.266 0 CA-C-N 115.163 -0.926 . . . . 0.0 111.864 -176.971 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 91' ' ' PHE . . . . . . . . . . . . . 3.4 p90 -69.08 144.26 53.99 Favored 'General case' 0 CA--C 1.544 0.747 0 CA-C-O 121.631 0.729 . . . . 0.0 111.865 -179.533 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 6.7 mtpm? . . . . . 0 C--O 1.247 0.941 0 C-N-CA 125.379 1.472 . . . . 0.0 108.78 170.675 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.544 0.737 0 CA-C-O 120.867 0.365 . . . . 0.0 110.515 . . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -85.72 -38.86 17.82 Favored 'General case' 0 N--CA 1.472 0.638 0 CA-C-N 115.841 -0.618 . . . . 0.0 109.372 179.127 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 29' ' ' TRP . . . . . . . . . . . . . 5.1 m-90 -137.34 154.54 50.02 Favored 'General case' 0 N--CA 1.476 0.828 0 C-N-CA 124.669 1.188 . . . . 0.0 108.636 178.649 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 77.2 p -85.82 173.16 10.22 Favored 'General case' 0 N--CA 1.477 0.901 0 N-CA-C 109.683 -0.488 . . . . 0.0 109.683 174.266 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 8.0 p -56.96 -40.8 74.8 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.139 0 C-N-CA 123.762 0.825 . . . . 0.0 111.766 -177.396 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 10.2 pt-20 -71.43 -37.51 71.43 Favored 'General case' 0 N--CA 1.476 0.835 0 C-N-CA 123.782 0.833 . . . . 0.0 111.563 179.377 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 49.9 mt-30 -66.33 -36.06 81.95 Favored 'General case' 0 N--CA 1.474 0.736 0 C-N-CA 123.023 0.529 . . . . 0.0 110.99 175.915 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . 0.449 ' HB3' HG22 ' A' ' 79' ' ' VAL . 84.2 mt -65.05 -50.06 67.69 Favored 'General case' 0 N--CA 1.475 0.812 0 C-N-CA 123.21 0.604 . . . . 0.0 110.941 -179.788 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 35' ' ' ARG . . . . . 0.565 ' HA ' ' HD3' ' A' ' 75' ' ' LYS . 17.8 ptm180 -73.87 -14.89 61.15 Favored 'General case' 0 N--CA 1.477 0.923 0 CA-C-N 115.699 -0.682 . . . . 0.0 111.707 -178.325 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 47.7 t -56.56 129.46 40.96 Favored 'General case' 0 N--CA 1.478 0.944 0 C-N-CA 123.389 0.676 . . . . 0.0 111.043 179.242 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 33.5 mt-10 -67.67 -18.83 65.07 Favored 'General case' 0 N--CA 1.479 1.012 0 C-N-CA 124.353 1.061 . . . . 0.0 111.883 -177.659 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 13.7 mm100 -70.8 -28.29 64.54 Favored 'General case' 0 CA--C 1.542 0.645 0 C-N-CA 123.52 0.728 . . . . 0.0 111.309 175.406 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 4.6 tt -91.99 127.24 50.35 Favored Pre-proline 0 CA--C 1.561 1.38 0 N-CA-C 108.229 -1.026 . . . . 0.0 108.229 178.5 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 24.5 Cg_exo -68.8 -149.06 0.02 OUTLIER 'Trans proline' 0 C--N 1.378 2.117 0 C-N-CA 123.571 2.847 . . . . 0.0 113.524 171.512 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -122.83 -30.65 3.8 Favored 'General case' 0 N--CA 1.482 1.134 0 C-N-CA 123.526 0.731 . . . . 0.0 111.169 177.559 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . 0.507 ' HA ' HD12 ' A' ' 45' ' ' ILE . 19.3 pttp -61.03 -39.27 89.15 Favored 'General case' 0 N--CA 1.486 1.335 0 C-N-CA 123.899 0.88 . . . . 0.0 112.776 -171.799 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 15.4 p-10 -69.7 -32.75 71.52 Favored 'General case' 0 CA--C 1.544 0.735 0 C-N-CA 122.697 0.399 . . . . 0.0 111.372 176.678 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 42.3 mt -67.18 -44.1 88.02 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.357 0 C-N-CA 122.315 0.246 . . . . 0.0 110.343 176.378 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 45' ' ' ILE . . . . . 0.507 HD12 ' HA ' ' A' ' 42' ' ' LYS . 67.3 mt -55.33 -44.27 74.74 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.325 0 C-N-CA 123.506 0.722 . . . . 0.0 110.011 175.21 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 46' ' ' LYS . . . . . 0.414 ' O ' ' HB2' ' A' ' 50' ' ' GLU . 55.0 tttp -58.37 -44.63 88.94 Favored 'General case' 0 CA--C 1.542 0.67 0 O-C-N 124.213 0.946 . . . . 0.0 110.845 178.414 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 23.7 t80 -59.63 -49.47 77.63 Favored 'General case' 0 N--CA 1.483 1.218 0 O-C-N 123.773 0.671 . . . . 0.0 111.219 177.318 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 97.7 mt -70.0 -31.8 69.67 Favored 'General case' 0 CA--C 1.544 0.731 0 C-N-CA 123.579 0.752 . . . . 0.0 112.115 -174.472 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 3.4 pt20 -84.23 -31.1 25.2 Favored 'General case' 0 N--CA 1.488 1.458 0 CA-C-N 117.711 0.232 . . . . 0.0 111.556 179.004 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . 0.414 ' HB2' ' O ' ' A' ' 46' ' ' LYS . 7.1 tp10 -63.9 -27.41 69.13 Favored 'General case' 0 N--CA 1.486 1.363 0 C-N-CA 124.168 0.987 . . . . 0.0 111.539 -175.576 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 52.0 m80 -120.95 -33.02 3.83 Favored 'General case' 0 N--CA 1.469 0.519 0 CA-C-N 115.072 -0.967 . . . . 0.0 111.422 -173.624 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -75.97 156.5 47.55 Favored Glycine 0 C--N 1.352 1.418 0 O-C-N 123.314 0.384 . . . . 0.0 113.597 -174.746 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 20.7 t -87.79 172.06 9.93 Favored 'General case' 0 N--CA 1.476 0.841 0 C-N-CA 123.583 0.753 . . . . 0.0 110.898 177.715 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 14.9 m-20 -60.27 -42.19 94.86 Favored 'General case' 0 N--CA 1.479 0.993 0 C-N-CA 124.436 1.094 . . . . 0.0 112.811 -171.206 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 32.9 t -70.42 -27.92 64.65 Favored 'General case' 0 N--CA 1.477 0.911 0 C-N-CA 123.299 0.64 . . . . 0.0 111.25 -176.545 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 56' ' ' PHE . . . . . 0.455 ' HD1' HH11 ' A' ' 90' ' ' ARG . 32.3 t80 -67.73 -46.22 72.79 Favored 'General case' 0 N--CA 1.482 1.155 0 CA-C-O 121.443 0.64 . . . . 0.0 110.085 174.149 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 66.0 mt -69.97 -44.87 68.57 Favored 'General case' 0 CA--C 1.538 0.492 0 CA-C-N 114.81 -1.086 . . . . 0.0 110.577 -175.854 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -54.65 -24.44 21.62 Favored 'General case' 0 N--CA 1.484 1.26 0 C-N-CA 125.674 1.59 . . . . 0.0 113.399 -176.815 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 53.8 mt-10 -54.37 -51.35 65.08 Favored 'General case' 0 N--CA 1.482 1.144 0 C-N-CA 123.512 0.725 . . . . 0.0 111.354 -179.459 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 15.9 t60 -119.03 13.79 13.05 Favored 'General case' 0 N--CA 1.487 1.384 0 C-N-CA 122.697 0.399 . . . . 0.0 111.241 175.778 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 61.7 mttp 56.82 65.29 1.43 Allowed 'General case' 0 N--CA 1.478 0.931 0 C-N-CA 124.417 1.087 . . . . 0.0 111.175 -176.184 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . 0.513 ' HA ' HG11 ' A' ' 69' ' ' VAL . 77.9 mt -86.24 -9.5 56.38 Favored 'General case' 0 N--CA 1.477 0.921 0 C-N-CA 123.972 0.909 . . . . 0.0 110.042 176.767 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 1.5 pp -80.43 156.06 26.8 Favored 'General case' 0 CA--C 1.545 0.783 0 C-N-CA 124.303 1.041 . . . . 0.0 110.781 177.201 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 90.03 -149.69 20.51 Favored Glycine 0 C--N 1.34 0.79 0 CA-C-N 115.696 -0.684 . . . . 0.0 112.732 178.327 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 65' ' ' ASN . . . . . 0.427 ' O ' HG23 ' A' ' 69' ' ' VAL . 82.3 m-20 -65.05 113.45 3.92 Favored 'General case' 0 N--CA 1.48 1.025 0 C-N-CA 123.927 0.891 . . . . 0.0 110.427 -177.001 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 70.4 mt -59.44 -42.92 89.24 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.125 0 C-N-CA 123.928 0.891 . . . . 0.0 110.605 -176.591 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 17.9 mtpp -55.61 -47.62 76.24 Favored 'General case' 0 CA--C 1.545 0.757 0 C-N-CA 124.063 0.945 . . . . 0.0 111.208 177.643 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 68' ' ' ASN . . . . . 0.51 ' O ' ' HG2' ' A' ' 71' ' ' LYS . 7.0 t30 -61.8 -42.83 99.5 Favored 'General case' 0 N--CA 1.479 0.984 0 C-N-CA 123.599 0.759 . . . . 0.0 111.336 176.068 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 69' ' ' VAL . . . . . 0.513 HG11 ' HA ' ' A' ' 62' ' ' LEU . 87.9 t -68.93 -30.13 45.76 Favored 'Isoleucine or valine' 0 CA--C 1.554 1.109 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.856 -178.988 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -65.82 -8.12 19.91 Favored 'General case' 0 N--CA 1.492 1.652 0 N-CA-C 114.363 1.246 . . . . 0.0 114.363 -173.929 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . 0.51 ' HG2' ' O ' ' A' ' 68' ' ' ASN . 64.7 pttt -91.54 -24.47 19.61 Favored 'General case' 0 N--CA 1.483 1.198 0 C-N-CA 122.88 0.472 . . . . 0.0 111.328 178.593 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 6.9 t -111.9 -27.94 8.25 Favored 'General case' 0 N--CA 1.474 0.772 0 C-N-CA 123.584 0.754 . . . . 0.0 110.996 -176.465 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . 0.462 ' HB3' HD23 ' A' ' 78' ' ' LEU . . . -73.39 85.28 1.48 Allowed 'General case' 0 C--O 1.243 0.756 0 N-CA-C 108.586 -0.894 . . . . 0.0 108.586 178.435 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 7.6 p30 -73.92 142.93 45.93 Favored 'General case' 0 C--O 1.239 0.529 0 CA-C-N 113.559 -1.655 . . . . 0.0 109.023 179.347 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . 0.565 ' HD3' ' HA ' ' A' ' 35' ' ' ARG . 40.4 ttmt -60.49 -34.16 73.65 Favored 'General case' 0 CA--C 1.538 0.492 0 C-N-CA 124.383 1.073 . . . . 0.0 111.419 -174.294 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 27.8 t70 -58.04 -39.91 79.58 Favored 'General case' 0 N--CA 1.472 0.671 0 C-N-CA 123.626 0.77 . . . . 0.0 111.175 177.922 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 73.6 t60 -71.21 -42.42 68.97 Favored 'General case' 0 C--O 1.213 -0.856 0 C-N-CA 123.633 0.773 . . . . 0.0 110.253 176.186 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . 0.462 HD23 ' HB3' ' A' ' 73' ' ' ALA . 98.2 mt -67.36 -31.21 71.3 Favored 'General case' 0 N--CA 1.483 1.187 0 N-CA-C 113.051 0.76 . . . . 0.0 113.051 -170.893 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 79' ' ' VAL . . . . . 0.449 HG22 ' HB3' ' A' ' 34' ' ' LEU . 60.0 t -71.58 -46.55 62.41 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.782 0 C-N-CA 123.407 0.683 . . . . 0.0 109.66 174.335 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 34.9 m -63.73 -32.38 73.86 Favored 'General case' 0 N--CA 1.477 0.877 0 CA-C-N 115.431 -0.804 . . . . 0.0 110.921 176.775 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -74.96 -37.52 61.93 Favored 'General case' 0 N--CA 1.473 0.713 0 C-N-CA 124.183 0.993 . . . . 0.0 110.358 179.639 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 82' ' ' TYR . . . . . . . . . . . . . 35.7 t80 -55.25 -55.22 33.87 Favored 'General case' 0 N--CA 1.472 0.673 0 C-N-CA 124.428 1.091 . . . . 0.0 109.954 173.676 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 83' ' ' ASN . . . . . . . . . . . . . 68.5 m-80 -64.59 -41.68 96.09 Favored 'General case' 0 N--CA 1.482 1.133 0 C-N-CA 122.639 0.376 . . . . 0.0 110.842 -178.396 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 16.6 t-160 -67.47 -27.45 67.03 Favored 'General case' 0 N--CA 1.485 1.28 0 C-N-CA 124.037 0.935 . . . . 0.0 110.787 -178.684 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -59.72 -53.05 62.53 Favored 'General case' 0 N--CA 1.48 1.075 0 C-N-CA 124.182 0.993 . . . . 0.0 109.822 -179.448 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 32.2 m-85 -74.08 -28.28 61.31 Favored 'General case' 0 CA--C 1.547 0.849 0 CA-C-N 114.22 -1.354 . . . . 0.0 111.462 -179.963 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 9.4 tm-20 -73.19 -26.76 61.29 Favored 'General case' 0 N--CA 1.48 1.058 0 C-N-CA 124.149 0.979 . . . . 0.0 111.498 -174.345 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 23.0 p -116.79 -7.16 11.51 Favored 'General case' 0 N--CA 1.479 0.98 0 C-N-CA 123.315 0.646 . . . . 0.0 111.403 178.05 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 41.5 mtmt 59.79 35.29 22.03 Favored 'General case' 0 N--CA 1.487 1.387 0 C-N-CA 124.197 0.999 . . . . 0.0 111.901 175.212 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 90' ' ' ARG . . . . . 0.455 HH11 ' HD1' ' A' ' 56' ' ' PHE . 99.4 mtt180 -62.91 -15.74 56.39 Favored 'General case' 0 N--CA 1.49 1.569 0 N-CA-C 113.562 0.949 . . . . 0.0 113.562 -173.26 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 91' ' ' PHE . . . . . . . . . . . . . 21.9 p90 -71.37 162.08 30.02 Favored 'General case' 0 C--N 1.321 -0.654 0 C-N-CA 123.722 0.809 . . . . 0.0 111.904 172.645 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 1.4 tmtp? . . . . . 0 C--O 1.243 0.734 0 N-CA-C 105.668 -1.975 . . . . 0.0 105.668 167.294 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 36.0 ttp180 . . . . . 0 CA--C 1.534 0.334 0 N-CA-C 108.542 -0.91 . . . . 0.0 108.542 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -89.64 -18.02 27.29 Favored 'General case' 0 CA--C 1.543 0.703 0 CA-C-N 114.324 -1.307 . . . . 0.0 111.751 -172.498 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 29' ' ' TRP . . . . . . . . . . . . . 5.7 m-90 -130.51 139.25 50.51 Favored 'General case' 0 N--CA 1.473 0.718 0 C-N-CA 123.856 0.863 . . . . 0.0 109.792 -174.221 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 73.8 p -80.27 167.31 20.44 Favored 'General case' 0 C--O 1.242 0.702 0 N-CA-C 108.329 -0.989 . . . . 0.0 108.329 171.796 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . 0.567 ' HA ' HD12 ' A' ' 34' ' ' LEU . 9.5 p -62.81 -30.04 48.51 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.89 0 CA-C-N 117.572 0.169 . . . . 0.0 111.376 -174.946 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 9.9 pt-20 -68.76 -40.49 79.72 Favored 'General case' 0 C--N 1.359 0.981 0 C-N-CA 123.067 0.547 . . . . 0.0 110.706 175.185 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 52.6 mt-30 -64.14 -41.71 97.09 Favored 'General case' 0 N--CA 1.482 1.148 0 C-N-CA 123.002 0.521 . . . . 0.0 110.599 178.151 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . 0.567 HD12 ' HA ' ' A' ' 31' ' ' VAL . 84.3 mt -60.29 -52.99 62.91 Favored 'General case' 0 N--CA 1.47 0.555 0 O-C-N 124.361 1.038 . . . . 0.0 111.219 -178.539 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 16.6 ptm180 -72.74 -23.19 60.81 Favored 'General case' 0 N--CA 1.475 0.818 0 O-C-N 124.418 1.074 . . . . 0.0 110.768 -175.876 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 24.7 t -63.19 123.3 18.28 Favored 'General case' 0 C--N 1.356 0.853 0 C-N-CA 123.032 0.533 . . . . 0.0 110.291 -177.788 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 12.0 pt-20 -65.01 -21.01 66.78 Favored 'General case' 0 N--CA 1.474 0.754 0 C-N-CA 123.858 0.863 . . . . 0.0 112.521 -177.653 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 94.8 mt-30 -68.56 -26.91 65.65 Favored 'General case' 0 CA--C 1.542 0.655 0 C-N-CA 123.749 0.82 . . . . 0.0 110.905 177.265 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 60.5 tp -83.14 117.97 70.23 Favored Pre-proline 0 N--CA 1.478 0.942 0 N-CA-C 108.363 -0.976 . . . . 0.0 108.363 169.511 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 40' ' ' PRO . . . . . 0.598 ' HG2' ' HB2' ' A' ' 43' ' ' ASP . 30.1 Cg_endo -64.01 141.23 76.21 Favored 'Trans proline' 0 C--N 1.376 2.004 0 C-N-CA 122.175 1.916 . . . . 0.0 112.254 176.414 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 50.5 mtmt -61.24 -32.68 72.47 Favored 'General case' 0 N--CA 1.474 0.748 0 C-N-CA 124.203 1.001 . . . . 0.0 111.026 178.832 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . 0.58 ' HG2' ' HB2' ' A' ' 40' ' ' PRO . 17.8 ptpt -65.99 -31.52 72.46 Favored 'General case' 0 N--CA 1.469 0.517 0 C-N-CA 123.858 0.863 . . . . 0.0 111.021 -179.568 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 43' ' ' ASP . . . . . 0.598 ' HB2' ' HG2' ' A' ' 40' ' ' PRO . 2.4 t70 -67.05 -38.05 85.13 Favored 'General case' 0 N--CA 1.481 1.089 0 N-CA-C 109.391 -0.596 . . . . 0.0 109.391 -178.246 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 44' ' ' ILE . . . . . 0.515 ' O ' ' HG ' ' A' ' 48' ' ' LEU . 23.6 mt -67.34 -53.93 28.3 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.765 0 CA-C-N 115.17 -0.923 . . . . 0.0 109.705 177.411 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 73.8 mt -60.09 -36.18 66.03 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.733 0 C-N-CA 123.655 0.782 . . . . 0.0 111.955 -178.453 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 33.8 ttpt -53.86 -45.19 70.91 Favored 'General case' 0 N--CA 1.48 1.052 0 C-N-CA 124.364 1.066 . . . . 0.0 110.479 174.314 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 31.9 t80 -67.51 -45.62 75.26 Favored 'General case' 0 CA--C 1.551 1.0 0 CA-C-N 114.353 -1.294 . . . . 0.0 111.442 177.384 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . 0.515 ' HG ' ' O ' ' A' ' 44' ' ' ILE . 73.9 mt -65.55 -34.25 77.81 Favored 'General case' 0 N--CA 1.477 0.923 0 C-N-CA 123.857 0.863 . . . . 0.0 111.673 -172.903 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . 0.421 ' HA ' HD21 ' A' ' 57' ' ' LEU . 3.4 pt20 -83.92 -28.03 28.16 Favored 'General case' 0 N--CA 1.481 1.081 0 C-N-CA 122.637 0.375 . . . . 0.0 110.766 176.004 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 11.5 tp10 -61.83 -48.91 78.47 Favored 'General case' 0 N--CA 1.482 1.134 0 C-N-CA 123.699 0.8 . . . . 0.0 110.73 179.1 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 1.1 m80 -140.59 22.86 2.32 Favored 'General case' 0 N--CA 1.482 1.135 0 N-CA-C 113.203 0.816 . . . . 0.0 113.203 -171.23 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -84.99 -144.18 6.76 Favored Glycine 0 CA--C 1.534 1.243 0 N-CA-C 109.375 -1.49 . . . . 0.0 109.375 157.467 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 53' ' ' SER . . . . . 0.449 ' O ' ' HG ' ' A' ' 57' ' ' LEU . 28.1 t -149.67 162.68 39.75 Favored 'General case' 0 N--CA 1.478 0.932 0 CA-C-N 117.59 0.695 . . . . 0.0 109.847 174.77 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 4.0 p30 -52.48 -36.04 54.07 Favored 'General case' 0 N--CA 1.487 1.377 0 C-N-CA 124.485 1.114 . . . . 0.0 112.988 -174.424 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 20.4 m -70.69 -43.43 69.04 Favored 'General case' 0 CA--C 1.546 0.791 0 C-N-CA 123.706 0.802 . . . . 0.0 110.762 179.623 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 56' ' ' PHE . . . . . 0.42 ' HE2' ' HB3' ' A' ' 48' ' ' LEU . 66.2 t80 -60.41 -38.92 85.56 Favored 'General case' 0 N--CA 1.483 1.196 0 C-N-CA 124.16 0.984 . . . . 0.0 110.348 174.474 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . 0.449 ' HG ' ' O ' ' A' ' 53' ' ' SER . 51.6 mt -73.9 -32.49 63.6 Favored 'General case' 0 C--O 1.211 -0.936 0 CA-C-N 115.012 -0.994 . . . . 0.0 110.485 -178.983 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -69.92 -47.15 63.55 Favored 'General case' 0 N--CA 1.483 1.18 0 C-N-CA 123.334 0.654 . . . . 0.0 111.391 179.024 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 42.2 mt-10 -55.15 -47.11 75.58 Favored 'General case' 0 N--CA 1.486 1.364 0 C-N-CA 123.631 0.773 . . . . 0.0 111.003 179.196 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 28.6 m80 -107.76 4.68 25.88 Favored 'General case' 0 CA--C 1.543 0.705 0 CA-C-N 115.583 -0.735 . . . . 0.0 111.871 -170.088 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 48.9 mtmt 55.73 39.24 30.81 Favored 'General case' 0 N--CA 1.492 1.639 0 C-N-CA 123.91 0.884 . . . . 0.0 111.824 176.754 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . 0.506 ' HA ' HG11 ' A' ' 69' ' ' VAL . 73.2 mt -88.12 -6.48 57.87 Favored 'General case' 0 N--CA 1.479 0.998 0 C-N-CA 123.93 0.892 . . . . 0.0 111.099 -179.723 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 1.8 pp -73.04 159.99 32.75 Favored 'General case' 0 N--CA 1.474 0.771 0 C-N-CA 124.011 0.924 . . . . 0.0 111.513 174.34 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 92.22 -168.46 31.1 Favored Glycine 0 CA--C 1.524 0.621 0 CA-C-N 115.518 -0.764 . . . . 0.0 112.682 179.729 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 16.1 m120 -62.37 126.15 26.35 Favored 'General case' 0 N--CA 1.478 0.948 0 C-N-CA 123.635 0.774 . . . . 0.0 109.831 -179.58 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 54.8 mt -57.09 -48.12 82.53 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.86 0 O-C-N 124.268 0.98 . . . . 0.0 112.434 -168.543 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 22.4 pttp -65.38 -31.55 72.72 Favored 'General case' 0 N--CA 1.482 1.159 0 C-N-CA 123.688 0.795 . . . . 0.0 111.575 -178.137 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 48.9 t30 -66.75 -41.77 87.26 Favored 'General case' 0 N--CA 1.481 1.121 0 C-N-CA 123.372 0.669 . . . . 0.0 109.862 176.458 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 69' ' ' VAL . . . . . 0.506 HG11 ' HA ' ' A' ' 62' ' ' LEU . 38.4 t -69.04 -34.57 64.56 Favored 'Isoleucine or valine' 0 C--O 1.212 -0.889 0 CA-C-N 115.03 -0.986 . . . . 0.0 109.644 175.31 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -75.37 -2.14 27.11 Favored 'General case' 0 N--CA 1.484 1.23 0 C-N-CA 123.683 0.793 . . . . 0.0 111.341 179.372 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 40.2 ttmt -95.06 -49.63 5.44 Favored 'General case' 0 CA--C 1.547 0.83 0 C-N-CA 123.554 0.742 . . . . 0.0 110.347 172.313 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 15.1 t -83.03 -33.63 26.44 Favored 'General case' 0 CA--C 1.555 1.167 0 C-N-CA 123.435 0.694 . . . . 0.0 111.955 -172.679 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -92.41 118.16 30.66 Favored 'General case' 0 N--CA 1.47 0.563 0 C-N-CA 123.972 0.909 . . . . 0.0 109.735 -179.452 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 74' ' ' ASN . . . . . 0.428 ' O ' ' HB3' ' A' ' 77' ' ' HIS . 24.0 p-10 -76.73 168.41 20.13 Favored 'General case' 0 N--CA 1.476 0.835 0 C-N-CA 123.173 0.589 . . . . 0.0 110.042 173.328 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . 0.427 ' HD3' ' O ' ' A' ' 34' ' ' LEU . 32.3 ttmt -71.99 -32.3 67.08 Favored 'General case' 0 CA--C 1.543 0.703 0 C-N-CA 122.78 0.432 . . . . 0.0 111.709 -175.184 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 33.9 t70 -60.74 -28.58 68.8 Favored 'General case' 0 N--CA 1.487 1.409 0 C-N-CA 123.283 0.633 . . . . 0.0 111.527 177.354 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 77' ' ' HIS . . . . . 0.471 ' HD2' HD23 ' A' ' 78' ' ' LEU . 42.1 t60 -71.2 -48.91 48.68 Favored 'General case' 0 CA--C 1.552 1.045 0 C-N-CA 125.055 1.342 . . . . 0.0 109.978 172.211 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . 0.471 HD23 ' HD2' ' A' ' 77' ' ' HIS . 77.6 mt -67.22 -45.79 75.76 Favored 'General case' 0 N--CA 1.487 1.408 0 N-CA-C 113.454 0.909 . . . . 0.0 113.454 -169.132 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 79' ' ' VAL . . . . . 0.517 HG21 ' HB3' ' A' ' 34' ' ' LEU . 61.9 t -59.53 -42.06 86.83 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.218 0 O-C-N 123.941 0.775 . . . . 0.0 110.207 -177.812 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 24.8 m -62.54 -44.41 96.4 Favored 'General case' 0 N--CA 1.476 0.847 0 CA-C-N 115.203 -0.908 . . . . 0.0 111.496 177.815 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -66.42 -39.35 88.89 Favored 'General case' 0 N--CA 1.48 1.041 0 C-N-CA 123.55 0.74 . . . . 0.0 110.7 -179.803 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 82' ' ' TYR . . . . . . . . . . . . . 86.6 t80 -63.13 -54.56 35.87 Favored 'General case' 0 N--CA 1.471 0.621 0 C-N-CA 124.387 1.075 . . . . 0.0 111.105 -177.328 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 83' ' ' ASN . . . . . . . . . . . . . 67.8 m-80 -68.71 -35.76 77.57 Favored 'General case' 0 N--CA 1.481 1.115 0 C-N-CA 123.055 0.542 . . . . 0.0 110.96 -177.492 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 37.9 t60 -63.97 -30.54 71.61 Favored 'General case' 0 N--CA 1.483 1.218 0 C-N-CA 123.859 0.863 . . . . 0.0 110.647 174.292 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 85' ' ' LEU . . . . . 0.421 HD12 HD21 ' A' ' 48' ' ' LEU . 1.5 tt -60.1 -51.93 67.53 Favored 'General case' 0 N--CA 1.479 1.018 0 C-N-CA 123.467 0.707 . . . . 0.0 109.522 -176.842 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 35.0 m-85 -73.11 -31.89 64.61 Favored 'General case' 0 N--CA 1.48 1.055 0 CA-C-N 115.499 -0.773 . . . . 0.0 110.991 -179.108 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 9.7 tp10 -60.68 -41.61 95.42 Favored 'General case' 0 N--CA 1.477 0.911 0 C-N-CA 124.345 1.058 . . . . 0.0 111.699 -177.114 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 12.2 p -120.32 3.73 10.81 Favored 'General case' 0 N--CA 1.477 0.916 0 C-N-CA 124.152 0.981 . . . . 0.0 111.779 -175.602 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 56.2 mtpt 53.85 70.17 0.63 Allowed 'General case' 0 N--CA 1.48 1.038 0 C-N-CA 124.673 1.189 . . . . 0.0 111.787 178.634 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 26.3 mmm180 -80.12 14.33 1.93 Allowed 'General case' 0 N--CA 1.493 1.693 0 C-N-CA 124.241 1.016 . . . . 0.0 112.369 -179.722 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 91' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -65.15 163.25 15.4 Favored 'General case' 0 N--CA 1.479 1.012 0 C-N-CA 123.671 0.788 . . . . 0.0 110.839 -177.854 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 23.1 ttmm . . . . . 0 C--O 1.254 1.338 0 CA-C-N 115.256 -0.884 . . . . 0.0 109.287 174.952 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.545 0.786 0 CA-C-O 121.128 0.49 . . . . 0.0 111.3 . . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -78.97 -34.56 44.13 Favored 'General case' 0 CA--C 1.535 0.39 0 N-CA-C 108.697 -0.853 . . . . 0.0 108.697 173.348 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 29' ' ' TRP . . . . . . . . . . . . . 4.7 m-90 -134.13 149.83 51.1 Favored 'General case' 0 N--CA 1.476 0.835 0 C-N-CA 124.679 1.192 . . . . 0.0 108.344 178.782 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 21.6 p -91.72 178.1 6.01 Favored 'General case' 0 N--CA 1.478 0.929 0 C-N-CA 122.814 0.446 . . . . 0.0 110.916 -178.482 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 7.2 p -54.34 -45.78 68.96 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.608 0 N-CA-C 113.441 0.904 . . . . 0.0 113.441 -169.873 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . 0.408 ' HA ' ' HG2' ' A' ' 35' ' ' ARG . 1.3 pm0 -71.42 -31.3 67.07 Favored 'General case' 0 N--CA 1.476 0.843 0 C-N-CA 123.133 0.573 . . . . 0.0 111.447 179.305 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 23.4 mm-40 -71.28 -32.98 69.33 Favored 'General case' 0 N--CA 1.476 0.844 0 C-N-CA 123.139 0.576 . . . . 0.0 110.613 175.69 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 70.3 mt -81.34 -27.3 35.0 Favored 'General case' 0 N--CA 1.475 0.797 0 C-N-CA 123.79 0.836 . . . . 0.0 111.827 -176.25 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 35' ' ' ARG . . . . . 0.408 ' HG2' ' HA ' ' A' ' 32' ' ' GLU . 3.6 ptm180 -82.68 -25.26 33.2 Favored 'General case' 0 N--CA 1.479 0.983 0 CA-C-O 119.669 -0.205 . . . . 0.0 110.829 169.715 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 37.1 t -59.94 125.33 23.23 Favored 'General case' 0 N--CA 1.486 1.36 0 C-N-CA 124.093 0.957 . . . . 0.0 112.111 -172.974 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 10.9 tp10 -65.46 -17.16 64.34 Favored 'General case' 0 CA--C 1.555 1.161 0 C-N-CA 124.487 1.115 . . . . 0.0 111.558 178.534 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 71.3 mt-30 -62.89 -38.59 91.51 Favored 'General case' 0 N--CA 1.476 0.869 0 C-N-CA 123.852 0.861 . . . . 0.0 110.418 173.377 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . 0.487 HD12 ' HD2' ' A' ' 40' ' ' PRO . 51.4 tp -86.52 128.09 58.22 Favored Pre-proline 0 N--CA 1.482 1.134 0 C-N-CA 123.777 0.831 . . . . 0.0 110.016 177.573 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 40' ' ' PRO . . . . . 0.487 ' HD2' HD12 ' A' ' 39' ' ' LEU . 39.0 Cg_endo -70.14 134.26 26.78 Favored 'Trans proline' 0 C--N 1.379 2.144 0 C-N-CA 122.363 2.042 . . . . 0.0 112.318 173.168 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 41' ' ' LYS . . . . . 0.501 ' HB3' ' HD3' ' A' ' 75' ' ' LYS . 21.5 pttp -76.95 -20.01 56.65 Favored 'General case' 0 N--CA 1.48 1.051 0 N-CA-C 113.235 0.828 . . . . 0.0 113.235 -173.213 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . 0.533 ' HA ' HD12 ' A' ' 45' ' ' ILE . 60.1 pttt -63.77 -30.76 71.82 Favored 'General case' 0 N--CA 1.478 0.941 0 C-N-CA 122.966 0.507 . . . . 0.0 110.706 171.256 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -73.94 -26.25 60.4 Favored 'General case' 0 N--CA 1.479 0.996 0 C-N-CA 122.967 0.507 . . . . 0.0 111.596 177.692 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 39.3 mt -74.55 -43.99 47.75 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.971 0 N-CA-C 109.438 -0.578 . . . . 0.0 109.438 174.846 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 45' ' ' ILE . . . . . 0.533 HD12 ' HA ' ' A' ' 42' ' ' LYS . 77.9 mt -53.89 -46.85 64.57 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.165 0 C-N-CA 123.358 0.663 . . . . 0.0 109.314 172.119 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 29.0 ttpp -63.79 -39.37 94.1 Favored 'General case' 0 CA--C 1.538 0.519 0 CA-C-N 114.467 -1.242 . . . . 0.0 110.893 -177.948 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 26.5 t80 -64.64 -54.31 33.77 Favored 'General case' 0 N--CA 1.473 0.693 0 O-C-N 123.969 0.793 . . . . 0.0 110.623 177.13 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 95.8 mt -69.03 -29.69 67.91 Favored 'General case' 0 N--CA 1.474 0.726 0 C-N-CA 123.656 0.782 . . . . 0.0 111.846 -173.03 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 3.0 pt20 -79.45 -26.21 41.81 Favored 'General case' 0 N--CA 1.48 1.039 0 C-N-CA 122.222 0.209 . . . . 0.0 110.621 176.646 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 10.7 tp10 -61.23 -37.71 84.03 Favored 'General case' 0 N--CA 1.482 1.159 0 C-N-CA 123.679 0.791 . . . . 0.0 111.269 -179.477 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 31.2 p-80 -124.34 -32.21 3.2 Favored 'General case' 0 N--CA 1.485 1.32 0 N-CA-C 113.253 0.834 . . . . 0.0 113.253 -174.24 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -61.83 139.84 46.78 Favored Glycine 0 C--N 1.348 1.198 0 CA-C-N 118.221 0.464 . . . . 0.0 113.6 178.115 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 53' ' ' SER . . . . . 0.457 ' O ' ' HG ' ' A' ' 57' ' ' LEU . 44.1 t -60.14 148.36 36.33 Favored 'General case' 0 N--CA 1.48 1.057 0 C-N-CA 123.582 0.753 . . . . 0.0 111.597 179.556 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 14.2 m-20 -61.52 -32.9 72.96 Favored 'General case' 0 N--CA 1.487 1.419 0 C-N-CA 123.65 0.78 . . . . 0.0 112.489 -174.181 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 21.5 m -67.42 -41.93 84.05 Favored 'General case' 0 CA--C 1.544 0.716 0 O-C-N 123.607 0.567 . . . . 0.0 110.402 177.827 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 56' ' ' PHE . . . . . 0.51 ' HB2' ' HD3' ' A' ' 90' ' ' ARG . 62.4 t80 -60.98 -43.9 98.14 Favored 'General case' 0 N--CA 1.477 0.882 0 C-N-CA 123.849 0.86 . . . . 0.0 109.934 174.027 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . 0.457 ' HG ' ' O ' ' A' ' 53' ' ' SER . 73.1 mt -64.53 -44.49 90.67 Favored 'General case' 0 C--O 1.209 -1.068 0 CA-C-N 115.097 -0.956 . . . . 0.0 110.491 -177.506 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -61.72 -45.28 94.64 Favored 'General case' 0 N--CA 1.482 1.138 0 C-N-CA 123.655 0.782 . . . . 0.0 111.393 -177.39 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 46.7 mt-10 -60.38 -36.58 78.39 Favored 'General case' 0 N--CA 1.482 1.168 0 C-N-CA 123.666 0.787 . . . . 0.0 112.006 177.668 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 53.2 m80 -105.11 6.82 33.51 Favored 'General case' 0 N--CA 1.487 1.393 0 C-N-CA 122.967 0.507 . . . . 0.0 112.132 -177.59 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 68.8 mmtt 59.96 27.22 16.57 Favored 'General case' 0 N--CA 1.488 1.436 0 C-N-CA 125.094 1.358 . . . . 0.0 112.981 175.65 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 70.1 mt -81.92 -21.51 37.3 Favored 'General case' 0 N--CA 1.483 1.198 0 C-N-CA 124.157 0.983 . . . . 0.0 112.669 -174.703 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -78.09 170.04 17.27 Favored 'General case' 0 N--CA 1.485 1.283 0 CA-C-O 120.809 0.337 . . . . 0.0 111.683 179.818 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 90.96 -157.55 25.23 Favored Glycine 0 C--N 1.341 0.848 0 CA-C-N 115.391 -0.822 . . . . 0.0 112.367 177.303 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 17.8 m120 -69.41 115.93 9.25 Favored 'General case' 0 N--CA 1.47 0.567 0 C-N-CA 123.62 0.768 . . . . 0.0 110.205 -179.437 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 65.7 mt -54.29 -50.35 57.11 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.967 0 C-N-CA 124.515 1.126 . . . . 0.0 112.187 -173.758 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 67' ' ' LYS . . . . . 0.424 ' H ' ' HD2' ' A' ' 67' ' ' LYS . 0.0 OUTLIER -60.92 -41.64 96.59 Favored 'General case' 0 N--CA 1.48 1.049 0 O-C-N 123.774 0.671 . . . . 0.0 109.661 -175.898 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 49.5 t30 -61.35 -47.82 84.11 Favored 'General case' 0 N--CA 1.479 1.008 0 CA-C-N 115.075 -0.966 . . . . 0.0 110.975 176.959 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 85.8 t -62.28 -32.35 54.57 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.099 0 C-N-CA 123.585 0.754 . . . . 0.0 110.732 178.676 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -70.69 8.02 0.97 Allowed 'General case' 0 CA--C 1.554 1.134 0 C-N-CA 123.738 0.815 . . . . 0.0 112.976 -178.453 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 16.5 ptpt -94.81 -27.4 15.78 Favored 'General case' 0 N--CA 1.484 1.255 0 CA-C-N 119.179 0.9 . . . . 0.0 110.824 169.69 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 10.2 t -109.23 -28.94 8.74 Favored 'General case' 0 N--CA 1.482 1.155 0 C-N-CA 123.732 0.813 . . . . 0.0 111.045 -175.207 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -80.62 86.36 5.89 Favored 'General case' 0 C--O 1.237 0.447 0 C-N-CA 123.511 0.724 . . . . 0.0 109.656 -178.66 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 3.9 p-10 -70.27 160.95 31.26 Favored 'General case' 0 C--O 1.239 0.538 0 CA-C-N 114.489 -1.232 . . . . 0.0 110.389 174.877 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . 0.501 ' HD3' ' HB3' ' A' ' 41' ' ' LYS . 13.3 tptm -61.19 -47.73 84.79 Favored 'General case' 0 N--CA 1.471 0.59 0 CA-C-N 115.712 -0.676 . . . . 0.0 111.3 -166.923 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 4.4 p30 -69.43 -29.94 67.76 Favored 'General case' 0 N--CA 1.485 1.3 0 CA-C-N 115.975 -0.557 . . . . 0.0 111.649 -176.304 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 74.5 t60 -59.83 -41.53 91.53 Favored 'General case' 0 N--CA 1.481 1.099 0 C-N-CA 123.883 0.873 . . . . 0.0 110.128 173.094 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . 0.44 ' CD1' ' HB2' ' A' ' 41' ' ' LYS . 83.5 mt -74.1 -28.95 61.6 Favored 'General case' 0 N--CA 1.47 0.533 0 CA-C-N 115.242 -0.89 . . . . 0.0 112.24 -176.92 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 79' ' ' VAL . . . . . 0.406 HG23 ' O ' ' A' ' 75' ' ' LYS . 21.3 t -73.73 -39.1 52.49 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.914 0 N-CA-C 109.732 -0.47 . . . . 0.0 109.732 173.553 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 29.2 m -67.5 -36.62 81.44 Favored 'General case' 0 N--CA 1.48 1.061 0 C-N-CA 122.895 0.478 . . . . 0.0 111.098 176.094 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -68.34 -39.65 81.84 Favored 'General case' 0 N--CA 1.473 0.688 0 C-N-CA 123.378 0.671 . . . . 0.0 109.955 175.663 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 82' ' ' TYR . . . . . . . . . . . . . 15.2 t80 -53.57 -58.86 5.67 Favored 'General case' 0 CA--C 1.542 0.65 0 CA-C-N 115.084 -0.962 . . . . 0.0 110.217 174.859 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 83' ' ' ASN . . . . . . . . . . . . . 49.4 m-80 -64.72 -31.19 72.3 Favored 'General case' 0 N--CA 1.481 1.112 0 C-N-CA 122.749 0.42 . . . . 0.0 111.501 -175.513 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 6.4 t60 -65.7 -45.66 81.91 Favored 'General case' 0 CA--C 1.549 0.938 0 C-N-CA 123.471 0.708 . . . . 0.0 110.267 178.218 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 85' ' ' LEU . . . . . 0.415 HD11 ' HB2' ' A' ' 90' ' ' ARG . 20.2 tp -57.13 -54.72 43.57 Favored 'General case' 0 N--CA 1.49 1.531 0 C-N-CA 123.701 0.8 . . . . 0.0 112.34 -172.691 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 83.0 m-85 -74.6 -21.73 59.32 Favored 'General case' 0 CA--C 1.543 0.697 0 CA-C-N 113.625 -1.625 . . . . 0.0 111.409 -174.519 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 7.9 tp10 -82.91 -10.84 58.62 Favored 'General case' 0 N--CA 1.478 0.96 0 C-N-CA 123.165 0.586 . . . . 0.0 111.601 178.524 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 31.4 p -125.5 -3.17 7.34 Favored 'General case' 0 N--CA 1.483 1.211 0 C-N-CA 123.617 0.767 . . . . 0.0 110.94 178.691 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 74.4 mmtt 61.04 23.84 13.99 Favored 'General case' 0 N--CA 1.486 1.359 0 C-N-CA 125.033 1.333 . . . . 0.0 113.125 174.052 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 90' ' ' ARG . . . . . 0.51 ' HD3' ' HB2' ' A' ' 56' ' ' PHE . 51.1 mtt180 -65.15 -18.87 65.67 Favored 'General case' 0 N--CA 1.491 1.605 0 N-CA-C 113.812 1.041 . . . . 0.0 113.812 -170.296 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 91' ' ' PHE . . . . . . . . . . . . . 24.6 p90 -59.68 145.65 44.08 Favored 'General case' 0 N--CA 1.476 0.841 0 C-N-CA 122.688 0.395 . . . . 0.0 111.571 177.56 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 14.1 mmmm . . . . . 0 CA--C 1.554 1.107 0 C-N-CA 124.736 1.214 . . . . 0.0 111.561 -167.27 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 CA--C 1.547 0.858 0 N-CA-C 108.341 -0.985 . . . . 0.0 108.341 . . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -128.9 -17.57 3.94 Favored 'General case' 0 N--CA 1.482 1.169 0 N-CA-C 112.543 0.572 . . . . 0.0 112.543 -167.537 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 29' ' ' TRP . . . . . . . . . . . . . 2.1 m-90 -126.27 138.1 53.57 Favored 'General case' 0 N--CA 1.481 1.101 0 C-N-CA 122.606 0.362 . . . . 0.0 110.143 -167.765 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 8.4 m -81.83 161.95 23.02 Favored 'General case' 0 CA--C 1.549 0.935 0 N-CA-C 108.191 -1.04 . . . . 0.0 108.191 171.353 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . 0.494 ' HA ' HD11 ' A' ' 34' ' ' LEU . 60.1 t -57.48 -33.3 43.95 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.485 0 C-N-CA 123.003 0.521 . . . . 0.0 110.74 -177.483 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 12.0 pt-20 -68.07 -38.56 82.53 Favored 'General case' 0 N--CA 1.478 0.97 0 C-N-CA 124.558 1.143 . . . . 0.0 111.83 176.026 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 43.2 mt-30 -65.49 -37.76 87.76 Favored 'General case' 0 N--CA 1.48 1.044 0 C-N-CA 122.54 0.336 . . . . 0.0 110.467 176.552 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . 0.5 HD12 ' CD2' ' A' ' 82' ' ' TYR . 72.9 mt -65.15 -56.45 12.83 Favored 'General case' 0 C--N 1.347 0.492 0 O-C-N 123.969 0.793 . . . . 0.0 110.233 -178.516 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 40.2 ptt180 -65.01 -24.47 67.51 Favored 'General case' 0 N--CA 1.481 1.1 0 CA-C-N 115.331 -0.85 . . . . 0.0 111.194 -173.517 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 33.6 t -65.39 116.09 6.33 Favored 'General case' 0 C--O 1.24 0.582 0 N-CA-C 108.599 -0.889 . . . . 0.0 108.599 173.408 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 5.2 tp10 -73.76 -7.01 50.48 Favored 'General case' 0 CA--C 1.553 1.065 0 C-N-CA 123.189 0.596 . . . . 0.0 110.844 -174.668 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 70.8 mt-30 -55.28 -39.29 69.66 Favored 'General case' 0 N--CA 1.479 0.986 0 C-N-CA 124.417 1.087 . . . . 0.0 110.049 167.801 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 3.6 tt -78.88 124.8 84.82 Favored Pre-proline 0 CA--C 1.557 1.221 0 N-CA-C 107.926 -1.139 . . . . 0.0 107.926 173.961 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 40.9 Cg_exo -59.49 -178.54 0.16 Allowed 'Trans proline' 0 C--N 1.379 2.167 0 C-N-CA 123.475 2.783 . . . . 0.0 113.98 171.36 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 52.0 mtmt -106.16 -20.15 13.49 Favored 'General case' 0 N--CA 1.473 0.697 0 CA-C-N 115.901 -0.591 . . . . 0.0 110.808 178.686 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 18.9 ptpt -62.08 -47.21 85.66 Favored 'General case' 0 N--CA 1.474 0.769 0 C-N-CA 123.726 0.811 . . . . 0.0 112.089 -174.764 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 43' ' ' ASP . . . . . 0.528 ' HA ' ' HE2' ' A' ' 46' ' ' LYS . 9.4 p-10 -73.86 -27.95 61.34 Favored 'General case' 0 N--CA 1.472 0.625 0 CA-C-N 116.07 -0.514 . . . . 0.0 111.907 -174.256 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 32.6 mt -68.66 -56.08 13.58 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.944 0 N-CA-C 109.735 -0.469 . . . . 0.0 109.735 175.88 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 79.9 mt -54.77 -38.47 43.96 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.544 0 C-N-CA 123.558 0.743 . . . . 0.0 110.654 175.812 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 46' ' ' LYS . . . . . 0.528 ' HE2' ' HA ' ' A' ' 43' ' ' ASP . 38.6 ttpt -62.63 -45.56 92.28 Favored 'General case' 0 N--CA 1.48 1.054 0 C-N-CA 124.092 0.957 . . . . 0.0 111.721 179.602 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 47' ' ' PHE . . . . . 0.465 ' HE2' ' HZ ' ' A' ' 86' ' ' PHE . 24.3 t80 -66.72 -44.51 81.39 Favored 'General case' 0 N--CA 1.476 0.852 0 CA-C-N 115.719 -0.673 . . . . 0.0 111.295 179.808 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 83.6 mt -71.04 -30.3 66.45 Favored 'General case' 0 CA--C 1.539 0.526 0 CA-C-N 115.516 -0.765 . . . . 0.0 111.2 -175.435 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . 0.457 ' HA ' HD22 ' A' ' 57' ' ' LEU . 2.9 pt20 -81.44 -26.76 35.05 Favored 'General case' 0 N--CA 1.479 1.014 0 O-C-N 123.245 0.34 . . . . 0.0 110.764 175.638 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 10.8 tp10 -62.29 -43.4 98.92 Favored 'General case' 0 N--CA 1.477 0.878 0 C-N-CA 123.611 0.764 . . . . 0.0 110.95 179.196 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 0.7 OUTLIER -107.66 -36.17 6.51 Favored 'General case' 0 N--CA 1.476 0.836 0 CA-C-N 115.94 -0.573 . . . . 0.0 111.682 -171.167 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . 0.555 ' HA2' ' HA ' ' A' ' 91' ' ' PHE . . . -61.85 143.62 48.71 Favored Glycine 0 C--N 1.353 1.508 0 N-CA-C 114.431 0.532 . . . . 0.0 114.431 -177.757 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 92.4 p -78.74 174.7 11.17 Favored 'General case' 0 N--CA 1.485 1.321 0 C-N-CA 123.908 0.883 . . . . 0.0 111.217 -179.081 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 6.8 m-20 -57.24 -44.44 83.85 Favored 'General case' 0 N--CA 1.491 1.585 0 C-N-CA 123.494 0.718 . . . . 0.0 110.95 179.815 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 39.5 t -63.48 -32.68 74.19 Favored 'General case' 0 CA--C 1.548 0.896 0 CA-C-N 115.13 -0.941 . . . . 0.0 111.579 -179.119 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 54.7 t80 -74.27 -48.88 25.78 Favored 'General case' 0 N--CA 1.477 0.887 0 CA-C-O 120.864 0.364 . . . . 0.0 110.53 175.741 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . 0.457 HD22 ' HA ' ' A' ' 49' ' ' GLN . 37.2 mt -70.11 -36.64 74.99 Favored 'General case' 0 N--CA 1.478 0.941 0 CA-C-N 115.427 -0.806 . . . . 0.0 112.398 -169.296 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -71.03 -49.83 40.71 Favored 'General case' 0 N--CA 1.474 0.729 0 C-N-CA 122.919 0.488 . . . . 0.0 111.106 -179.717 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 39.2 mm-40 -69.25 -20.69 63.94 Favored 'General case' 0 N--CA 1.478 0.97 0 N-CA-C 112.745 0.646 . . . . 0.0 112.745 -179.164 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 62.8 m80 -108.77 -3.2 17.95 Favored 'General case' 0 N--CA 1.483 1.213 0 C-N-CA 123.1 0.56 . . . . 0.0 111.459 176.791 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 50.5 mtmt 59.46 28.36 17.72 Favored 'General case' 0 N--CA 1.495 1.79 0 C-N-CA 124.369 1.068 . . . . 0.0 112.732 174.5 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . 0.479 HD12 ' HB1' ' A' ' 81' ' ' ALA . 87.3 mt -88.98 -7.46 55.96 Favored 'General case' 0 N--CA 1.486 1.364 0 C-N-CA 123.776 0.831 . . . . 0.0 112.373 -174.232 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 2.2 pp -78.3 176.72 9.04 Favored 'General case' 0 N--CA 1.479 0.985 0 C-N-CA 123.029 0.532 . . . . 0.0 110.952 177.135 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 78.32 -162.13 49.29 Favored Glycine 0 CA--C 1.526 0.724 0 CA-C-N 115.685 -0.689 . . . . 0.0 113.505 176.816 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -64.6 113.38 3.68 Favored 'General case' 0 N--CA 1.477 0.921 0 C-N-CA 123.524 0.73 . . . . 0.0 109.185 -179.621 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 82.4 mt -54.6 -47.45 72.28 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.947 0 O-C-N 124.123 0.89 . . . . 0.0 111.775 -173.77 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -65.68 -30.29 70.96 Favored 'General case' 0 N--CA 1.483 1.186 0 N-CA-C 111.999 0.37 . . . . 0.0 111.999 -177.494 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 68' ' ' ASN . . . . . 0.483 ' O ' ' HG2' ' A' ' 71' ' ' LYS . 60.0 t30 -73.57 -34.58 65.19 Favored 'General case' 0 N--CA 1.483 1.188 0 C-N-CA 123.356 0.662 . . . . 0.0 110.268 178.141 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 67.1 t -72.94 -34.13 45.3 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.875 0 CA-C-N 115.536 -0.756 . . . . 0.0 110.082 172.247 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -75.75 1.86 13.67 Favored 'General case' 0 N--CA 1.484 1.242 0 C-N-CA 124.112 0.965 . . . . 0.0 112.953 -175.481 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . 0.483 ' HG2' ' O ' ' A' ' 68' ' ' ASN . 18.0 ptpt -94.7 -17.92 21.78 Favored 'General case' 0 N--CA 1.482 1.166 0 CA-C-N 118.186 0.448 . . . . 0.0 110.666 172.891 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 14.1 t -129.09 -12.98 4.58 Favored 'General case' 0 CA--C 1.547 0.84 0 C-N-CA 123.356 0.662 . . . . 0.0 111.861 -169.707 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -99.87 98.29 9.09 Favored 'General case' 0 N--CA 1.472 0.645 0 N-CA-C 107.999 -1.111 . . . . 0.0 107.999 174.863 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 26.6 p-10 -71.33 169.69 14.72 Favored 'General case' 0 N--CA 1.48 1.039 0 O-C-N 123.331 0.395 . . . . 0.0 110.388 -178.546 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . 0.469 ' O ' HG23 ' A' ' 79' ' ' VAL . 3.4 tppp? -61.46 -40.47 94.62 Favored 'General case' 0 CA--C 1.545 0.755 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.911 -175.81 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 23.2 m-20 -58.13 -41.11 82.97 Favored 'General case' 0 N--CA 1.486 1.374 0 C-N-CA 123.485 0.714 . . . . 0.0 111.473 -179.977 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 75.3 t60 -61.44 -40.45 94.52 Favored 'General case' 0 N--CA 1.479 0.993 0 C-N-CA 124.047 0.939 . . . . 0.0 110.827 175.72 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 58.3 mt -75.77 -28.44 58.44 Favored 'General case' 0 N--CA 1.48 1.034 0 C-N-CA 123.234 0.614 . . . . 0.0 112.54 -176.037 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 79' ' ' VAL . . . . . 0.469 HG23 ' O ' ' A' ' 75' ' ' LYS . 61.5 t -67.54 -48.27 77.47 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.704 0 N-CA-C 108.703 -0.851 . . . . 0.0 108.703 172.76 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 53.7 m -60.56 -39.96 89.9 Favored 'General case' 0 CA--C 1.542 0.659 0 CA-C-N 114.828 -1.078 . . . . 0.0 111.124 177.453 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 81' ' ' ALA . . . . . 0.479 ' HB1' HD12 ' A' ' 62' ' ' LEU . . . -70.12 -42.72 72.26 Favored 'General case' 0 CA--C 1.542 0.637 0 C-N-CA 123.049 0.54 . . . . 0.0 111.588 -178.9 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 82' ' ' TYR . . . . . 0.5 ' CD2' HD12 ' A' ' 34' ' ' LEU . 90.2 t80 -62.89 -55.89 22.1 Favored 'General case' 0 N--CA 1.479 0.995 0 C-N-CA 123.982 0.913 . . . . 0.0 110.797 -179.067 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 83' ' ' ASN . . . . . . . . . . . . . 60.8 m-80 -65.1 -46.98 78.83 Favored 'General case' 0 N--CA 1.48 1.041 0 C-N-CA 122.714 0.406 . . . . 0.0 111.589 -175.846 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 26.3 m-70 -67.04 -23.99 65.95 Favored 'General case' 0 N--CA 1.482 1.16 0 C-N-CA 123.511 0.724 . . . . 0.0 112.086 -179.121 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 21.1 tp -59.11 -54.44 47.02 Favored 'General case' 0 N--CA 1.483 1.182 0 CA-C-O 121.205 0.526 . . . . 0.0 110.553 177.5 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 86' ' ' PHE . . . . . 0.465 ' HZ ' ' HE2' ' A' ' 47' ' ' PHE . 6.3 m-85 -75.36 -29.75 60.01 Favored 'General case' 0 N--CA 1.471 0.586 0 CA-C-N 114.242 -1.344 . . . . 0.0 110.874 -176.1 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 22.8 tt0 -54.78 -40.31 69.3 Favored 'General case' 0 N--CA 1.481 1.12 0 C-N-CA 124.732 1.213 . . . . 0.0 111.105 176.378 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 40.7 p -111.62 -7.3 14.28 Favored 'General case' 0 CA--C 1.544 0.719 0 C-N-CA 124.279 1.031 . . . . 0.0 111.381 -176.634 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 89' ' ' LYS . . . . . 0.588 ' HB3' ' HZ1' ' A' ' 89' ' ' LYS . 8.5 mtpm? 52.84 43.26 31.74 Favored 'General case' 0 N--CA 1.481 1.11 0 C-N-CA 124.778 1.231 . . . . 0.0 111.91 -177.812 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 94.1 mtt180 -69.59 -9.01 52.29 Favored 'General case' 0 N--CA 1.49 1.528 0 C-N-CA 123.746 0.818 . . . . 0.0 113.004 179.845 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 91' ' ' PHE . . . . . 0.555 ' HA ' ' HA2' ' A' ' 52' ' ' GLY . 21.1 p90 -65.95 133.94 51.91 Favored 'General case' 0 CA--C 1.546 0.79 0 CA-C-O 120.973 0.416 . . . . 0.0 111.492 174.084 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 61.3 tttp . . . . . 0 C--O 1.252 1.216 0 CA-C-N 115.322 -0.853 . . . . 0.0 108.854 173.599 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 27' ' ' ARG . . . . . 0.506 ' HB2' ' OH ' ' A' ' 82' ' ' TYR . 0.0 OUTLIER . . . . . 0 CA--C 1.542 0.657 0 CA-C-O 121.103 0.478 . . . . 0.0 110.918 . . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -91.39 -34.96 14.66 Favored 'General case' 0 N--CA 1.469 0.525 0 CA-C-N 115.099 -0.955 . . . . 0.0 111.436 -169.222 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 29' ' ' TRP . . . . . . . . . . . . . 4.4 m-90 -115.17 149.86 36.98 Favored 'General case' 0 N--CA 1.469 0.48 0 CA-C-N 115.51 -0.768 . . . . 0.0 111.433 -169.443 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 80.8 p -90.74 168.98 11.35 Favored 'General case' 0 CA--C 1.54 0.574 0 CA-C-N 115.275 -0.875 . . . . 0.0 109.223 172.512 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . 0.488 ' HA ' HD13 ' A' ' 34' ' ' LEU . 2.6 p -52.17 -41.66 33.8 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.416 0 C-N-CA 123.737 0.815 . . . . 0.0 112.633 -177.214 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 12.7 pt-20 -73.77 -36.44 65.09 Favored 'General case' 0 N--CA 1.478 0.961 0 C-N-CA 124.135 0.974 . . . . 0.0 112.111 -178.398 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 52.7 mt-30 -61.1 -38.58 86.82 Favored 'General case' 0 N--CA 1.49 1.538 0 C-N-CA 122.705 0.402 . . . . 0.0 110.101 175.267 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . 0.495 HD11 ' CD2' ' A' ' 82' ' ' TYR . 36.1 mt -63.03 -41.32 99.5 Favored 'General case' 0 N--CA 1.473 0.699 0 CA-C-N 115.466 -0.788 . . . . 0.0 110.626 178.266 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 32.5 mtp180 -70.44 -30.31 67.13 Favored 'General case' 0 N--CA 1.478 0.939 0 C-N-CA 123.352 0.661 . . . . 0.0 111.518 -179.636 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 34.0 t -66.13 114.07 4.98 Favored 'General case' 0 N--CA 1.473 0.715 0 C-N-CA 123.308 0.643 . . . . 0.0 110.41 -179.949 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . 0.497 ' HA ' ' HZ1' ' A' ' 75' ' ' LYS . 41.0 mt-10 -73.32 -10.98 60.32 Favored 'General case' 0 CA--C 1.55 0.951 0 C-N-CA 123.454 0.702 . . . . 0.0 112.297 -176.642 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 79.1 mm-40 -55.57 -37.81 68.51 Favored 'General case' 0 N--CA 1.488 1.428 0 C-N-CA 123.695 0.798 . . . . 0.0 109.703 166.257 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 4.8 tt -78.44 128.87 76.42 Favored Pre-proline 0 CA--C 1.553 1.065 0 N-CA-C 107.329 -1.36 . . . . 0.0 107.329 170.746 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 47.5 Cg_exo -60.2 172.55 2.41 Favored 'Trans proline' 0 C--N 1.373 1.844 0 C-N-CA 123.259 2.639 . . . . 0.0 114.63 176.464 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 55.9 mtmt -93.36 -32.17 14.37 Favored 'General case' 0 N--CA 1.475 0.786 0 C-N-CA 123.662 0.785 . . . . 0.0 110.706 173.213 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 21.3 ptmt -63.83 -41.39 97.85 Favored 'General case' 0 CA--C 1.545 0.761 0 C-N-CA 123.911 0.884 . . . . 0.0 112.475 -172.801 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 30.4 p-10 -71.2 -32.37 68.76 Favored 'General case' 0 N--CA 1.481 1.103 0 C-N-CA 123.142 0.577 . . . . 0.0 111.912 -175.753 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 33.5 mt -68.85 -48.87 68.39 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.198 0 N-CA-C 109.982 -0.377 . . . . 0.0 109.982 176.079 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 79.6 mt -60.71 -39.97 83.34 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.364 0 C-N-CA 123.102 0.561 . . . . 0.0 110.938 178.005 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 84.7 tttt -62.76 -44.21 96.79 Favored 'General case' 0 CA--C 1.544 0.735 0 CA-C-N 115.436 -0.802 . . . . 0.0 110.784 177.788 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 1.0 OUTLIER -57.94 -52.08 66.99 Favored 'General case' 0 N--CA 1.484 1.256 0 O-C-N 124.248 0.967 . . . . 0.0 109.324 177.518 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . 0.471 HD23 ' HA ' ' A' ' 82' ' ' TYR . 96.3 mt -67.4 -31.6 71.92 Favored 'General case' 0 N--CA 1.471 0.612 0 CA-C-N 114.906 -1.043 . . . . 0.0 113.052 -174.732 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . 0.487 ' HA ' HD21 ' A' ' 57' ' ' LEU . 3.4 pt20 -84.18 -27.4 28.08 Favored 'General case' 0 N--CA 1.482 1.162 0 CA-C-N 117.886 0.312 . . . . 0.0 111.359 178.483 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 40.3 tt0 -75.19 -36.83 61.4 Favored 'General case' 0 N--CA 1.474 0.754 0 C-N-CA 123.387 0.675 . . . . 0.0 111.346 179.611 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 69.1 m80 -107.87 -35.46 6.64 Favored 'General case' 0 N--CA 1.476 0.855 0 CA-C-N 115.562 -0.745 . . . . 0.0 112.06 -173.163 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -66.67 172.89 27.4 Favored Glycine 0 CA--C 1.528 0.883 0 CA-C-N 117.691 0.223 . . . . 0.0 113.346 176.314 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 53' ' ' SER . . . . . 0.453 ' O ' ' HG ' ' A' ' 57' ' ' LEU . 64.0 p -94.32 161.42 14.25 Favored 'General case' 0 N--CA 1.48 1.033 0 C-N-CA 123.154 0.582 . . . . 0.0 109.825 176.514 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 5.1 p-10 -63.26 -34.27 77.31 Favored 'General case' 0 N--CA 1.485 1.283 0 C-N-CA 122.897 0.479 . . . . 0.0 111.757 -176.384 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 23.1 t -67.86 -39.6 83.75 Favored 'General case' 0 N--CA 1.481 1.076 0 C-N-CA 123.619 0.768 . . . . 0.0 110.44 177.821 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 47.7 t80 -59.78 -37.66 79.68 Favored 'General case' 0 N--CA 1.483 1.208 0 C-N-CA 124.191 0.996 . . . . 0.0 110.161 172.972 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . 0.487 HD21 ' HA ' ' A' ' 49' ' ' GLN . 49.0 mt -74.9 -39.01 61.71 Favored 'General case' 0 C--O 1.216 -0.684 0 CA-C-N 115.836 -0.62 . . . . 0.0 112.012 -177.911 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -66.89 -46.74 73.97 Favored 'General case' 0 N--CA 1.481 1.086 0 CA-C-O 121.344 0.592 . . . . 0.0 110.435 -178.444 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 43.4 mt-10 -66.2 -26.11 67.24 Favored 'General case' 0 CA--C 1.55 0.954 0 CA-C-N 114.939 -1.028 . . . . 0.0 112.264 178.942 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 33.1 m80 -116.7 9.18 13.96 Favored 'General case' 0 N--CA 1.493 1.691 0 N-CA-C 112.888 0.699 . . . . 0.0 112.888 -178.862 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 34.1 mmtp 57.81 26.57 13.34 Favored 'General case' 0 N--CA 1.498 1.934 0 C-N-CA 124.224 1.01 . . . . 0.0 113.34 173.11 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . 0.413 HD12 ' HB1' ' A' ' 81' ' ' ALA . 73.1 mt -87.36 -9.67 54.19 Favored 'General case' 0 N--CA 1.485 1.303 0 C-N-CA 123.72 0.808 . . . . 0.0 112.187 -176.379 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 1.8 pp -80.13 165.85 22.06 Favored 'General case' 0 N--CA 1.479 0.99 0 C-N-CA 122.725 0.41 . . . . 0.0 111.002 175.923 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 92.9 -162.32 26.25 Favored Glycine 0 C--N 1.339 0.729 0 CA-C-N 115.307 -0.861 . . . . 0.0 111.891 -178.877 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 65' ' ' ASN . . . . . 0.435 ' O ' HG21 ' A' ' 69' ' ' VAL . 28.6 t-20 -69.77 122.25 18.83 Favored 'General case' 0 N--CA 1.467 0.401 0 N-CA-C 109.564 -0.532 . . . . 0.0 109.564 -178.921 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 62.6 mt -60.57 -44.6 97.07 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.376 0 C-N-CA 124.19 0.996 . . . . 0.0 111.305 -169.904 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 41.1 mtpt -57.31 -43.07 82.95 Favored 'General case' 0 CA--C 1.548 0.899 0 C-N-CA 124.495 1.118 . . . . 0.0 111.118 177.201 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 68' ' ' ASN . . . . . 0.448 ' O ' ' HG2' ' A' ' 71' ' ' LYS . 5.9 t30 -72.87 -29.86 63.52 Favored 'General case' 0 CA--C 1.55 0.964 0 CA-C-N 115.31 -0.859 . . . . 0.0 111.09 -178.857 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 69' ' ' VAL . . . . . 0.435 HG21 ' O ' ' A' ' 65' ' ' ASN . 57.7 t -72.11 -39.1 64.98 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.058 0 N-CA-C 109.798 -0.445 . . . . 0.0 109.798 173.527 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -71.18 -8.38 53.14 Favored 'General case' 0 N--CA 1.479 1.011 0 C-N-CA 124.145 0.978 . . . . 0.0 112.903 -175.272 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . 0.448 ' HG2' ' O ' ' A' ' 68' ' ' ASN . 53.1 pttt -88.38 -19.93 25.97 Favored 'General case' 0 N--CA 1.481 1.089 0 CA-C-N 117.872 0.305 . . . . 0.0 110.51 177.781 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 10.3 t -128.85 -13.76 4.6 Favored 'General case' 0 N--CA 1.478 0.932 0 C-N-CA 123.587 0.755 . . . . 0.0 111.862 -167.716 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -103.81 100.99 10.8 Favored 'General case' 0 N--CA 1.469 0.508 0 N-CA-C 107.514 -1.291 . . . . 0.0 107.514 175.336 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 25.6 p-10 -71.04 174.2 6.56 Favored 'General case' 0 N--CA 1.478 0.965 0 C-N-CA 122.884 0.474 . . . . 0.0 111.113 -173.249 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . 0.497 ' HZ1' ' HA ' ' A' ' 37' ' ' GLU . 9.2 tptm -64.57 -38.09 89.8 Favored 'General case' 0 CA--C 1.545 0.778 0 C-N-CA 122.598 0.359 . . . . 0.0 110.846 -173.274 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 28.5 m-20 -64.32 -35.8 82.05 Favored 'General case' 0 N--CA 1.48 1.039 0 C-N-CA 123.508 0.723 . . . . 0.0 111.237 178.849 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 18.8 t60 -60.62 -42.32 96.63 Favored 'General case' 0 N--CA 1.482 1.15 0 C-N-CA 124.159 0.984 . . . . 0.0 110.503 176.538 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 42.2 mt -68.34 -37.31 80.39 Favored 'General case' 0 N--CA 1.473 0.716 0 CA-C-N 115.159 -0.928 . . . . 0.0 111.528 -175.528 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 79' ' ' VAL . . . . . 0.474 ' HA ' HD12 ' A' ' 34' ' ' LEU . 47.2 t -62.89 -49.12 84.9 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.751 0 C-N-CA 124.025 0.93 . . . . 0.0 110.008 175.495 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 70.7 m -60.81 -46.27 91.17 Favored 'General case' 0 CA--C 1.545 0.761 0 CA-C-N 114.293 -1.321 . . . . 0.0 111.681 -179.045 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 81' ' ' ALA . . . . . 0.413 ' HB1' HD12 ' A' ' 62' ' ' LEU . . . -68.84 -43.32 75.73 Favored 'General case' 0 N--CA 1.478 0.975 0 C-N-CA 123.516 0.727 . . . . 0.0 111.443 -177.639 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 82' ' ' TYR . . . . . 0.506 ' OH ' ' HB2' ' A' ' 27' ' ' ARG . 86.5 t80 -58.64 -55.31 36.77 Favored 'General case' 0 N--CA 1.476 0.853 0 C-N-CA 124.276 1.03 . . . . 0.0 110.408 -179.334 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 83' ' ' ASN . . . . . . . . . . . . . 93.0 m-20 -64.9 -34.7 79.02 Favored 'General case' 0 N--CA 1.477 0.879 0 C-N-CA 123.43 0.692 . . . . 0.0 111.545 -175.992 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 24.5 m170 -72.29 -26.81 62.12 Favored 'General case' 0 N--CA 1.487 1.419 0 C-N-CA 123.225 0.61 . . . . 0.0 112.354 176.965 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 85' ' ' LEU . . . . . 0.496 ' HG ' ' HD2' ' A' ' 91' ' ' PHE . 43.5 tp -57.1 -53.09 61.99 Favored 'General case' 0 N--CA 1.485 1.31 0 CA-C-O 121.935 0.874 . . . . 0.0 110.768 178.223 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 86' ' ' PHE . . . . . 0.422 ' HA ' ' HE2' ' A' ' 91' ' ' PHE . 31.7 m-85 -74.2 -32.23 62.95 Favored 'General case' 0 CA--C 1.54 0.587 0 CA-C-N 113.532 -1.667 . . . . 0.0 110.974 -177.916 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 34.2 tt0 -61.26 -44.86 96.55 Favored 'General case' 0 N--CA 1.48 1.055 0 C-N-CA 123.928 0.891 . . . . 0.0 111.847 -176.2 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 37.4 p -109.59 6.67 24.12 Favored 'General case' 0 CA--C 1.544 0.743 0 C-N-CA 123.644 0.778 . . . . 0.0 111.418 -176.004 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 13.4 mmmm 57.14 35.09 25.82 Favored 'General case' 0 N--CA 1.492 1.629 0 C-N-CA 124.471 1.108 . . . . 0.0 111.504 173.644 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 47.2 mtt-85 -65.74 -24.02 66.86 Favored 'General case' 0 N--CA 1.491 1.624 0 N-CA-C 113.518 0.933 . . . . 0.0 113.518 -172.146 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 91' ' ' PHE . . . . . 0.496 ' HD2' ' HG ' ' A' ' 85' ' ' LEU . 5.5 p90 -57.51 161.56 3.44 Favored 'General case' 0 CA--C 1.551 0.996 0 N-CA-C 114.351 1.241 . . . . 0.0 114.351 -172.946 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 16.3 ptmt . . . . . 0 CA--C 1.562 1.413 0 C-N-CA 126.101 1.76 . . . . 0.0 113.573 -171.198 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.547 0.847 0 CA-C-O 121.391 0.615 . . . . 0.0 111.135 . . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -82.0 -29.72 31.94 Favored 'General case' 0 N--CA 1.473 0.695 0 CA-C-N 115.193 -0.912 . . . . 0.0 108.787 176.439 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 29' ' ' TRP . . . . . . . . . . . . . 4.8 m-90 -134.63 146.51 49.63 Favored 'General case' 0 N--CA 1.464 0.274 0 CA-C-N 114.065 -1.425 . . . . 0.0 108.95 -177.28 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 22.7 p -86.59 175.35 8.36 Favored 'General case' 0 N--CA 1.472 0.641 0 N-CA-C 108.967 -0.753 . . . . 0.0 108.967 170.375 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . 0.474 HG22 HH21 ' A' ' 35' ' ' ARG . 14.8 p -62.21 -31.92 53.07 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.214 0 C-N-CA 122.693 0.397 . . . . 0.0 111.319 -176.157 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 12.5 pt-20 -70.99 -38.78 72.71 Favored 'General case' 0 N--CA 1.48 1.063 0 C-N-CA 124.003 0.921 . . . . 0.0 111.79 176.681 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 53.1 mt-30 -69.11 -38.15 78.76 Favored 'General case' 0 N--CA 1.477 0.92 0 C-N-CA 122.921 0.488 . . . . 0.0 110.554 176.171 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . 0.473 HD12 ' HA ' ' A' ' 31' ' ' VAL . 87.3 mt -63.48 -50.93 67.75 Favored 'General case' 0 N--CA 1.48 1.062 0 C-N-CA 123.482 0.713 . . . . 0.0 111.171 -178.719 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 35' ' ' ARG . . . . . 0.474 HH21 HG22 ' A' ' 31' ' ' VAL . 18.6 ptp180 -69.89 -12.93 61.99 Favored 'General case' 0 CA--C 1.553 1.067 0 O-C-N 124.18 0.925 . . . . 0.0 111.474 -175.97 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 35.7 t -63.23 118.27 7.73 Favored 'General case' 0 N--CA 1.472 0.635 0 C-N-CA 123.387 0.675 . . . . 0.0 109.219 173.721 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 14.1 pt-20 -64.4 -30.21 71.25 Favored 'General case' 0 CA--C 1.548 0.879 0 C-N-CA 123.376 0.67 . . . . 0.0 111.725 -176.893 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 77.6 mt-30 -66.91 -19.06 65.66 Favored 'General case' 0 N--CA 1.484 1.252 0 C-N-CA 123.652 0.781 . . . . 0.0 111.584 179.942 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 1.8 tt -79.12 116.4 59.91 Favored Pre-proline 0 CA--C 1.551 1.008 0 N-CA-C 106.429 -1.693 . . . . 0.0 106.429 170.795 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 19.2 Cg_endo -58.57 119.97 7.55 Favored 'Trans proline' 0 C--N 1.378 2.085 0 C-N-CA 122.722 2.281 . . . . 0.0 111.62 177.011 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 58.2 pttt -56.65 -30.48 63.4 Favored 'General case' 0 N--CA 1.48 1.068 0 C-N-CA 125.039 1.335 . . . . 0.0 112.67 -177.987 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . 0.424 ' HA ' HD13 ' A' ' 45' ' ' ILE . 22.5 pttp -71.41 -31.96 67.84 Favored 'General case' 0 CA--C 1.545 0.755 0 C-N-CA 123.408 0.683 . . . . 0.0 110.796 -179.486 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -73.28 -25.94 60.88 Favored 'General case' 0 N--CA 1.478 0.926 0 C-N-CA 123.028 0.531 . . . . 0.0 110.814 177.624 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 59.9 mt -67.68 -51.18 53.66 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.93 0 N-CA-C 109.294 -0.632 . . . . 0.0 109.294 171.649 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 45' ' ' ILE . . . . . 0.424 HD13 ' HA ' ' A' ' 42' ' ' LYS . 62.8 mt -54.25 -41.84 53.97 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.694 0 C-N-CA 123.827 0.851 . . . . 0.0 110.41 175.911 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 37.1 ttpt -63.45 -41.65 98.65 Favored 'General case' 0 CA--C 1.543 0.68 0 C-N-CA 124.625 1.17 . . . . 0.0 111.419 -178.089 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 27.4 t80 -66.02 -47.63 73.8 Favored 'General case' 0 N--CA 1.479 0.999 0 CA-C-N 115.794 -0.639 . . . . 0.0 111.015 178.116 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 84.9 mt -70.41 -29.83 66.55 Favored 'General case' 0 N--CA 1.471 0.61 0 C-N-CA 123.883 0.873 . . . . 0.0 111.947 -174.287 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 2.9 pt20 -79.57 -26.61 41.31 Favored 'General case' 0 N--CA 1.484 1.248 0 O-C-N 123.13 0.269 . . . . 0.0 110.482 175.163 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 43.5 tt0 -66.14 -26.98 67.69 Favored 'General case' 0 N--CA 1.482 1.153 0 C-N-CA 123.697 0.799 . . . . 0.0 112.003 -177.332 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 51' ' ' HIS . . . . . 0.469 ' NE2' HD11 ' A' ' 85' ' ' LEU . 47.7 p-80 -126.62 -17.01 5.14 Favored 'General case' 0 N--CA 1.486 1.334 0 N-CA-C 112.952 0.723 . . . . 0.0 112.952 -179.645 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -73.19 142.99 32.45 Favored Glycine 0 N--CA 1.472 1.052 0 CA-C-N 118.132 0.424 . . . . 0.0 112.593 176.247 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 53' ' ' SER . . . . . 0.43 ' O ' ' HG ' ' A' ' 57' ' ' LEU . 32.7 t -76.1 155.18 34.96 Favored 'General case' 0 N--CA 1.48 1.039 0 C-N-CA 123.142 0.577 . . . . 0.0 110.26 177.052 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 22.1 m-20 -63.73 -31.83 73.12 Favored 'General case' 0 N--CA 1.492 1.634 0 C-N-CA 123.204 0.602 . . . . 0.0 112.493 -170.473 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 28.9 t -70.05 -28.26 65.31 Favored 'General case' 0 N--CA 1.474 0.76 0 C-N-CA 123.179 0.592 . . . . 0.0 110.869 179.575 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 82.1 t80 -74.92 -48.97 21.86 Favored 'General case' 0 CA--C 1.545 0.759 0 N-CA-C 109.589 -0.523 . . . . 0.0 109.589 170.102 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . 0.43 ' HG ' ' O ' ' A' ' 53' ' ' SER . 79.0 mt -60.07 -46.62 88.96 Favored 'General case' 0 C--O 1.213 -0.839 0 CA-C-N 115.144 -0.934 . . . . 0.0 111.867 -169.965 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -64.63 -44.8 89.35 Favored 'General case' 0 N--CA 1.481 1.105 0 C-N-CA 123.729 0.811 . . . . 0.0 111.704 -177.361 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 19.1 mm-40 -62.03 -21.66 65.08 Favored 'General case' 0 N--CA 1.483 1.204 0 C-N-CA 123.186 0.595 . . . . 0.0 112.192 177.39 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 21.3 m80 -113.95 1.15 14.62 Favored 'General case' 0 N--CA 1.488 1.448 0 C-N-CA 123.611 0.764 . . . . 0.0 111.098 179.083 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 38.4 mtmm 56.99 25.68 10.96 Favored 'General case' 0 N--CA 1.483 1.202 0 C-N-CA 125.47 1.508 . . . . 0.0 113.706 -179.91 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . 0.449 HD12 ' HB2' ' A' ' 81' ' ' ALA . 90.0 mt -76.09 -14.77 60.18 Favored 'General case' 0 N--CA 1.477 0.886 0 C-N-CA 123.006 0.523 . . . . 0.0 112.344 -178.597 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 2.0 pp -86.08 174.99 8.8 Favored 'General case' 0 N--CA 1.479 1.013 0 CA-C-O 121.018 0.437 . . . . 0.0 110.946 176.109 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 84.53 -163.35 38.76 Favored Glycine 0 C--N 1.344 0.994 0 CA-C-N 115.481 -0.781 . . . . 0.0 112.384 179.473 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 30.4 m-80 -61.92 110.2 1.48 Allowed 'General case' 0 C--N 1.354 0.767 0 N-CA-C 109.139 -0.689 . . . . 0.0 109.139 176.491 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 66' ' ' ILE . . . . . 0.407 HG22 ' HB2' ' A' ' 42' ' ' LYS . 75.0 mt -61.02 -38.91 80.56 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.702 0 O-C-N 124.119 0.887 . . . . 0.0 110.769 -176.42 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 61.9 pttt -59.31 -36.89 76.44 Favored 'General case' 0 CA--C 1.553 1.084 0 C-N-CA 123.503 0.721 . . . . 0.0 111.271 176.483 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 68' ' ' ASN . . . . . 0.414 ' O ' ' HG2' ' A' ' 71' ' ' LYS . 48.3 t-20 -72.22 -44.5 62.83 Favored 'General case' 0 N--CA 1.478 0.97 0 C-N-CA 123.459 0.704 . . . . 0.0 109.726 179.594 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 69' ' ' VAL . . . . . 0.419 HG13 ' HB3' ' A' ' 73' ' ' ALA . 98.0 t -60.58 -39.03 80.09 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.733 0 CA-C-N 115.707 -0.679 . . . . 0.0 110.49 178.457 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -63.29 -17.25 62.32 Favored 'General case' 0 N--CA 1.478 0.967 0 C-N-CA 124.416 1.086 . . . . 0.0 113.282 -175.215 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . 0.414 ' HG2' ' O ' ' A' ' 68' ' ' ASN . 16.1 ptpt -75.61 -22.27 57.02 Favored 'General case' 0 N--CA 1.489 1.521 0 CA-C-N 118.49 0.586 . . . . 0.0 110.91 -178.754 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 13.5 t -122.12 -12.31 8.33 Favored 'General case' 0 CA--C 1.543 0.703 0 C-N-CA 124.169 0.987 . . . . 0.0 110.607 -179.135 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . 0.481 ' HB1' HD21 ' A' ' 78' ' ' LEU . . . -77.49 86.19 3.85 Favored 'General case' 0 C--N 1.349 0.552 0 CA-C-O 121.461 0.648 . . . . 0.0 109.67 179.673 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 74' ' ' ASN . . . . . 0.425 ' ND2' ' HB3' ' A' ' 76' ' ' ASP . 7.9 p-10 -73.12 150.36 42.29 Favored 'General case' 0 C--O 1.24 0.58 0 CA-C-N 114.507 -1.224 . . . . 0.0 108.548 174.838 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . 0.521 ' HB2' ' HZ3' ' A' ' 75' ' ' LYS . 2.1 ttmp? -68.96 -26.66 65.16 Favored 'General case' 0 CA--C 1.544 0.72 0 C-N-CA 123.4 0.68 . . . . 0.0 111.482 -167.125 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 76' ' ' ASP . . . . . 0.425 ' HB3' ' ND2' ' A' ' 74' ' ' ASN . 28.4 t70 -62.95 -43.24 99.33 Favored 'General case' 0 N--CA 1.478 0.959 0 C-N-CA 123.555 0.742 . . . . 0.0 110.604 173.868 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 61.0 t60 -61.95 -42.39 99.05 Favored 'General case' 0 N--CA 1.482 1.165 0 C-N-CA 124.404 1.082 . . . . 0.0 110.664 175.857 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . 0.481 HD21 ' HB1' ' A' ' 73' ' ' ALA . 96.3 mt -65.1 -38.64 91.37 Favored 'General case' 0 N--CA 1.481 1.083 0 C-N-CA 123.571 0.748 . . . . 0.0 112.196 -175.392 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 98.2 t -69.24 -40.33 80.21 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.942 0 CA-C-N 115.606 -0.724 . . . . 0.0 110.503 176.085 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 57.2 m -62.21 -41.47 98.41 Favored 'General case' 0 N--CA 1.48 1.048 0 C-N-CA 123.273 0.629 . . . . 0.0 111.118 177.31 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 81' ' ' ALA . . . . . 0.449 ' HB2' HD12 ' A' ' 62' ' ' LEU . . . -68.74 -42.19 77.92 Favored 'General case' 0 CA--C 1.543 0.699 0 C-N-CA 123.436 0.694 . . . . 0.0 110.659 178.492 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 82' ' ' TYR . . . . . . . . . . . . . 7.5 t80 -52.08 -55.55 20.02 Favored 'General case' 0 N--CA 1.475 0.802 0 C-N-CA 124.434 1.094 . . . . 0.0 110.542 175.61 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 83' ' ' ASN . . . . . . . . . . . . . 28.9 m-80 -64.37 -45.71 86.54 Favored 'General case' 0 N--CA 1.482 1.153 0 C-N-CA 123.31 0.644 . . . . 0.0 111.594 -175.855 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 23.9 m-70 -62.01 -25.37 67.6 Favored 'General case' 0 N--CA 1.481 1.084 0 C-N-CA 123.484 0.714 . . . . 0.0 111.827 -179.541 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 85' ' ' LEU . . . . . 0.469 HD11 ' NE2' ' A' ' 51' ' ' HIS . 2.9 mt -60.85 -52.36 65.38 Favored 'General case' 0 N--CA 1.476 0.857 0 CA-C-O 120.766 0.317 . . . . 0.0 111.126 173.139 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 60.8 m-85 -72.97 -30.68 64.02 Favored 'General case' 0 CA--C 1.553 1.083 0 CA-C-N 115.475 -0.784 . . . . 0.0 111.092 -176.837 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 37.4 tt0 -48.36 -48.55 36.43 Favored 'General case' 0 N--CA 1.491 1.597 0 C-N-CA 126.055 1.742 . . . . 0.0 113.83 -173.532 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 27.3 p -120.62 -4.04 9.79 Favored 'General case' 0 CA--C 1.538 0.492 0 C-N-CA 124.342 1.057 . . . . 0.0 109.99 -178.71 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 32.1 mtmm 62.23 69.88 0.6 Allowed 'General case' 0 C--N 1.357 0.922 0 C-N-CA 124.402 1.081 . . . . 0.0 109.783 -173.843 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 44.6 mtt85 -86.01 15.02 5.36 Favored 'General case' 0 N--CA 1.489 1.524 0 C-N-CA 125.244 1.417 . . . . 0.0 111.837 175.816 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 91' ' ' PHE . . . . . . . . . . . . . 1.8 m-30 -56.67 160.11 3.51 Favored 'General case' 0 N--CA 1.477 0.901 0 C-N-CA 124.646 1.178 . . . . 0.0 111.331 171.356 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 92' ' ' LYS . . . . . 0.422 ' HE3' ' HA ' ' A' ' 53' ' ' SER . 40.7 ttmt . . . . . 0 C--O 1.249 1.058 0 N-CA-C 108.106 -1.072 . . . . 0.0 108.106 -179.617 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' MET . . . . . . . . . . . . . 37.2 tpp . . . . . 0 N--CA 1.483 1.204 0 CA-C-O 120.441 0.162 . . . . 0.0 110.855 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -69.04 105.07 2.29 Favored 'General case' 0 C--N 1.353 0.76 0 C-N-CA 123.106 0.562 . . . . 0.0 109.597 175.474 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . 62.31 56.63 2.11 Favored 'General case' 0 CA--C 1.548 0.898 0 C-N-CA 124.841 1.256 . . . . 0.0 110.779 -175.84 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -92.11 116.32 28.84 Favored 'General case' 0 N--CA 1.475 0.792 0 CA-C-N 115.371 -0.831 . . . . 0.0 109.512 177.42 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 26.8 m -64.78 145.2 98.89 Favored Pre-proline 0 N--CA 1.481 1.113 0 C-N-CA 123.789 0.836 . . . . 0.0 111.332 -177.862 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 5.8 Cg_exo -74.78 98.42 1.14 Allowed 'Trans proline' 0 C--N 1.373 1.847 0 C-N-CA 123.057 2.505 . . . . 0.0 112.229 -176.541 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 26.3 mt-30 -78.31 117.08 19.21 Favored 'General case' 0 C--O 1.249 1.077 0 N-CA-C 106.614 -1.624 . . . . 0.0 106.614 165.647 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -55.21 123.16 12.81 Favored 'General case' 0 CA--C 1.541 0.612 0 O-C-N 123.889 0.743 . . . . 0.0 111.056 -176.717 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -76.24 -37.39 57.74 Favored 'General case' 0 N--CA 1.472 0.627 0 CA-C-N 114.53 -1.214 . . . . 0.0 109.919 -176.859 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' TRP . . . . . . . . . . . . . 2.5 m-90 -120.94 148.13 44.5 Favored 'General case' 0 N--CA 1.471 0.6 0 CA-C-N 114.932 -1.031 . . . . 0.0 109.1 -177.279 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 76.3 p -87.18 175.33 8.11 Favored 'General case' 0 CA--C 1.54 0.596 0 C-N-CA 123.073 0.549 . . . . 0.0 110.006 176.167 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . 0.419 HG13 ' HE ' ' A' ' 35' ' ' ARG . 51.8 t -55.87 -46.26 80.07 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.052 0 C-N-CA 123.687 0.795 . . . . 0.0 111.484 -178.732 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 12.7 pt-20 -66.94 -41.51 86.87 Favored 'General case' 0 N--CA 1.475 0.782 0 C-N-CA 123.335 0.654 . . . . 0.0 111.403 -179.245 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 55.3 mt-30 -60.17 -36.52 77.76 Favored 'General case' 0 N--CA 1.479 0.995 0 C-N-CA 123.196 0.598 . . . . 0.0 110.974 178.329 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 85.0 mt -70.19 -51.43 31.1 Favored 'General case' 0 N--CA 1.469 0.497 0 C-N-CA 122.74 0.416 . . . . 0.0 110.427 178.864 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . 0.419 ' HE ' HG13 ' A' ' 31' ' ' VAL . 50.5 mtm180 -57.27 -28.45 62.99 Favored 'General case' 0 N--CA 1.484 1.251 0 C-N-CA 123.913 0.885 . . . . 0.0 111.755 -179.371 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 44.6 t -53.93 122.19 9.56 Favored 'General case' 0 CA--C 1.541 0.619 0 C-N-CA 124.262 1.025 . . . . 0.0 110.941 174.848 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 10.9 pt-20 -71.14 -8.82 56.07 Favored 'General case' 0 CA--C 1.549 0.939 0 C-N-CA 123.973 0.909 . . . . 0.0 111.482 179.038 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 95.7 mt-30 -65.89 -47.92 73.2 Favored 'General case' 0 N--CA 1.472 0.667 0 C-N-CA 123.914 0.886 . . . . 0.0 109.712 168.753 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 3.8 tt -76.89 116.92 61.25 Favored Pre-proline 0 CA--C 1.553 1.085 0 N-CA-C 108.126 -1.065 . . . . 0.0 108.126 179.509 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 32.4 Cg_exo -61.63 165.45 13.58 Favored 'Trans proline' 0 C--N 1.38 2.187 0 C-N-CA 123.479 2.786 . . . . 0.0 114.126 176.763 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 36.6 mtmm -81.54 -25.94 35.48 Favored 'General case' 0 N--CA 1.475 0.82 0 CA-C-N 115.722 -0.672 . . . . 0.0 111.004 179.536 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 18.5 ptpt -64.77 -48.11 75.68 Favored 'General case' 0 CA--C 1.547 0.865 0 C-N-CA 123.524 0.73 . . . . 0.0 112.797 -171.394 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 13.6 p-10 -73.28 -23.65 60.33 Favored 'General case' 0 N--CA 1.478 0.936 0 C-N-CA 122.666 0.386 . . . . 0.0 111.852 -176.794 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 54.2 mt -66.89 -52.69 41.76 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.084 0 C-N-CA 123.071 0.549 . . . . 0.0 110.1 171.496 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 80.3 mt -60.13 -34.73 57.92 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.17 0 C-N-CA 123.132 0.573 . . . . 0.0 110.416 177.545 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 2.7 tmtp? -59.77 -50.29 74.41 Favored 'General case' 0 N--CA 1.474 0.761 0 C-N-CA 123.714 0.806 . . . . 0.0 109.075 175.498 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 24.0 t80 -58.77 -45.16 90.39 Favored 'General case' 0 N--CA 1.485 1.319 0 C-N-CA 124.035 0.934 . . . . 0.0 111.627 179.978 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . 0.482 ' HB3' ' HE2' ' A' ' 56' ' ' PHE . 92.4 mt -72.01 -32.3 67.05 Favored 'General case' 0 CA--C 1.545 0.782 0 CA-C-N 115.277 -0.874 . . . . 0.0 111.816 -175.879 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . 0.508 ' HA ' HD22 ' A' ' 57' ' ' LEU . 3.0 pt20 -85.53 -23.86 27.52 Favored 'General case' 0 N--CA 1.491 1.594 0 C-N-CA 122.724 0.41 . . . . 0.0 112.013 175.051 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . 0.548 ' HG3' ' HD1' ' A' ' 51' ' ' HIS . 8.5 tp10 -58.36 -39.04 78.47 Favored 'General case' 0 N--CA 1.482 1.165 0 C-N-CA 124.458 1.103 . . . . 0.0 111.24 -179.759 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 51' ' ' HIS . . . . . 0.548 ' HD1' ' HG3' ' A' ' 50' ' ' GLU . 2.0 m80 -132.59 -30.23 1.47 Allowed 'General case' 0 N--CA 1.479 0.98 0 CA-C-O 119.034 -0.508 . . . . 0.0 112.169 -175.004 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -59.31 120.16 21.41 Favored Glycine 0 N--CA 1.478 1.434 0 CA-C-O 119.489 -0.617 . . . . 0.0 111.949 175.758 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 22.8 t -70.97 176.44 4.35 Favored 'General case' 0 N--CA 1.484 1.246 0 C-N-CA 123.607 0.763 . . . . 0.0 112.17 -171.251 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 5.6 p-10 -58.57 -36.49 74.02 Favored 'General case' 0 N--CA 1.48 1.056 0 C-N-CA 124.292 1.037 . . . . 0.0 113.429 -168.16 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 27.8 t -69.38 -40.7 77.26 Favored 'General case' 0 N--CA 1.476 0.827 0 C-N-CA 122.839 0.456 . . . . 0.0 110.096 -178.998 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 56' ' ' PHE . . . . . 0.629 ' HB2' ' HB3' ' A' ' 90' ' ' ARG . 65.7 t80 -59.69 -49.29 78.33 Favored 'General case' 0 N--CA 1.477 0.906 0 CA-C-O 121.378 0.609 . . . . 0.0 110.368 175.454 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . 0.508 HD22 ' HA ' ' A' ' 49' ' ' GLN . 68.7 mt -67.71 -31.78 71.96 Favored 'General case' 0 C--O 1.221 -0.424 0 CA-C-N 114.626 -1.17 . . . . 0.0 112.082 -176.128 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -73.68 -49.97 23.2 Favored 'General case' 0 N--CA 1.478 0.943 0 C-N-CA 122.798 0.439 . . . . 0.0 111.647 179.345 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 43.6 mt-10 -67.17 -36.59 82.12 Favored 'General case' 0 N--CA 1.485 1.301 0 C-N-CA 123.58 0.752 . . . . 0.0 111.612 -177.782 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 42.6 m-70 -98.77 -4.96 32.22 Favored 'General case' 0 N--CA 1.478 0.972 0 C-N-CA 123.122 0.569 . . . . 0.0 111.892 -177.85 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 62.9 mttp 58.56 41.35 22.54 Favored 'General case' 0 N--CA 1.496 1.849 0 C-N-CA 124.482 1.113 . . . . 0.0 112.641 175.736 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 85.1 mt -102.73 0.94 33.72 Favored 'General case' 0 N--CA 1.479 1.0 0 C-N-CA 123.592 0.757 . . . . 0.0 111.487 -178.749 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . 0.435 ' HB3' ' HB3' ' A' ' 57' ' ' LEU . 1.1 pp -77.07 160.73 28.85 Favored 'General case' 0 N--CA 1.483 1.206 0 C-N-CA 122.95 0.5 . . . . 0.0 111.369 174.651 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 89.28 -158.67 27.99 Favored Glycine 0 C--N 1.338 0.666 0 CA-C-N 115.167 -0.924 . . . . 0.0 112.942 173.79 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 36.8 m-80 -61.91 118.3 7.05 Favored 'General case' 0 CA--C 1.539 0.541 0 C-N-CA 123.573 0.749 . . . . 0.0 110.423 179.957 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 84.4 mt -50.05 -51.89 15.7 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.117 0 C-N-CA 124.136 0.975 . . . . 0.0 111.398 -177.617 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.76 -38.55 88.44 Favored 'General case' 0 CA--C 1.552 1.047 0 C-N-CA 123.47 0.708 . . . . 0.0 112.148 -178.399 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 23.9 t-20 -61.54 -38.34 87.06 Favored 'General case' 0 N--CA 1.485 1.311 0 C-N-CA 123.411 0.684 . . . . 0.0 110.777 175.841 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 99.2 t -73.5 -39.72 54.75 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.786 0 CA-C-N 115.183 -0.917 . . . . 0.0 110.355 175.141 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -69.35 -26.71 64.82 Favored 'General case' 0 N--CA 1.484 1.232 0 C-N-CA 124.388 1.075 . . . . 0.0 112.589 -171.902 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 22.1 ptmt -76.82 -17.13 59.2 Favored 'General case' 0 N--CA 1.477 0.91 0 C-N-CA 122.425 0.29 . . . . 0.0 111.523 -179.94 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 9.1 t -120.98 2.29 10.46 Favored 'General case' 0 CA--C 1.55 0.966 0 C-N-CA 123.94 0.896 . . . . 0.0 110.452 177.801 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . 0.43 ' HB2' HD23 ' A' ' 78' ' ' LEU . . . -91.95 121.16 33.28 Favored 'General case' 0 N--CA 1.47 0.55 0 C-N-CA 123.148 0.579 . . . . 0.0 109.932 175.063 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 12.5 p-10 -93.42 145.92 24.13 Favored 'General case' 0 N--CA 1.473 0.678 0 N-CA-C 108.493 -0.929 . . . . 0.0 108.493 168.829 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 4.6 tppp? -59.64 -42.3 92.45 Favored 'General case' 0 N--CA 1.477 0.88 0 C-N-CA 123.842 0.857 . . . . 0.0 112.143 -169.839 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 6.2 p-10 -64.5 -32.45 74.08 Favored 'General case' 0 N--CA 1.477 0.893 0 C-N-CA 123.265 0.626 . . . . 0.0 111.833 -177.102 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 47.5 t60 -68.37 -34.91 76.91 Favored 'General case' 0 N--CA 1.487 1.376 0 C-N-CA 123.484 0.713 . . . . 0.0 110.465 174.046 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . 0.43 HD23 ' HB2' ' A' ' 73' ' ' ALA . 84.4 mt -70.23 -35.33 73.79 Favored 'General case' 0 N--CA 1.479 0.977 0 C-N-CA 122.892 0.477 . . . . 0.0 111.465 -179.174 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 53.4 t -71.71 -37.95 64.54 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.788 0 O-C-N 124.084 0.865 . . . . 0.0 110.045 176.748 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 63.6 m -61.49 -47.17 86.87 Favored 'General case' 0 CA--C 1.545 0.756 0 CA-C-N 115.625 -0.716 . . . . 0.0 110.265 173.216 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -63.48 -41.63 98.58 Favored 'General case' 0 N--CA 1.476 0.825 0 C-N-CA 123.606 0.762 . . . . 0.0 110.951 -179.608 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 82' ' ' TYR . . . . . . . . . . . . . 7.8 t80 -55.77 -55.49 31.72 Favored 'General case' 0 CA--C 1.543 0.711 0 C-N-CA 124.954 1.302 . . . . 0.0 111.11 175.964 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 83' ' ' ASN . . . . . . . . . . . . . 70.7 m-20 -65.17 -41.09 94.98 Favored 'General case' 0 N--CA 1.486 1.36 0 C-N-CA 123.302 0.641 . . . . 0.0 111.683 -175.924 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 22.2 m-70 -68.79 -25.58 64.77 Favored 'General case' 0 N--CA 1.479 0.979 0 C-N-CA 123.878 0.871 . . . . 0.0 111.567 178.171 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 85' ' ' LEU . . . . . 0.515 ' HG ' ' HD2' ' A' ' 91' ' ' PHE . 51.2 tp -57.57 -53.95 52.42 Favored 'General case' 0 N--CA 1.487 1.405 0 CA-C-O 121.831 0.824 . . . . 0.0 111.069 178.872 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 43.4 m-85 -73.11 -30.9 63.97 Favored 'General case' 0 CA--C 1.538 0.506 0 CA-C-N 113.787 -1.551 . . . . 0.0 110.889 -177.174 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 44.9 tt0 -66.51 -30.33 70.62 Favored 'General case' 0 CA--C 1.548 0.871 0 C-N-CA 124.141 0.976 . . . . 0.0 111.774 -176.221 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 11.6 p -116.98 2.58 12.74 Favored 'General case' 0 N--CA 1.48 1.071 0 C-N-CA 123.421 0.688 . . . . 0.0 111.618 179.153 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 27.2 mtpp 58.21 30.97 20.2 Favored 'General case' 0 N--CA 1.485 1.285 0 C-N-CA 123.92 0.888 . . . . 0.0 111.815 177.461 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 90' ' ' ARG . . . . . 0.629 ' HB3' ' HB2' ' A' ' 56' ' ' PHE . 53.2 mtt85 -62.8 -12.36 23.88 Favored 'General case' 0 N--CA 1.489 1.513 0 C-N-CA 124.14 0.976 . . . . 0.0 113.095 -175.748 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 91' ' ' PHE . . . . . 0.515 ' HD2' ' HG ' ' A' ' 85' ' ' LEU . 6.9 p90 -77.15 161.66 28.05 Favored 'General case' 0 CA--C 1.542 0.644 0 C-N-CA 123.462 0.705 . . . . 0.0 112.046 174.997 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 19.4 ptmt . . . . . 0 CA--C 1.557 1.218 0 N-CA-C 108.127 -1.064 . . . . 0.0 108.127 169.047 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 20' ' ' MET . . . . . . . . . . . . . 85.6 mtp . . . . . 0 N--CA 1.478 0.951 0 N-CA-C 109.703 -0.48 . . . . 0.0 109.703 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -70.67 93.57 0.94 Allowed 'General case' 0 N--CA 1.473 0.695 0 N-CA-C 108.453 -0.943 . . . . 0.0 108.453 173.877 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -83.75 106.21 15.27 Favored 'General case' 0 C--O 1.239 0.511 0 C-N-CA 123.75 0.82 . . . . 0.0 110.83 -175.544 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -73.3 101.48 3.42 Favored 'General case' 0 N--CA 1.471 0.596 0 C-N-CA 123.092 0.557 . . . . 0.0 109.557 174.85 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 9.2 m -93.25 109.07 37.74 Favored Pre-proline 0 CA--C 1.548 0.899 0 C-N-CA 122.855 0.462 . . . . 0.0 109.835 177.117 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 25' ' ' PRO . . . . . 0.422 ' HB2' ' HE1' ' A' ' 86' ' ' PHE . 11.2 Cg_exo -71.51 101.22 1.12 Allowed 'Trans proline' 0 C--N 1.373 1.852 0 C-N-CA 122.942 2.428 . . . . 0.0 110.606 175.787 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 12.0 pt20 -77.37 125.51 29.44 Favored 'General case' 0 C--O 1.24 0.568 0 N-CA-C 108.118 -1.067 . . . . 0.0 108.118 173.868 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 38.0 ttp180 -65.04 107.55 1.55 Allowed 'General case' 0 CA--C 1.537 0.473 0 N-CA-C 109.279 -0.638 . . . . 0.0 109.279 176.405 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -93.83 -15.95 24.58 Favored 'General case' 0 N--CA 1.47 0.53 0 CA-C-N 114.485 -1.234 . . . . 0.0 110.847 -174.898 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 29' ' ' TRP . . . . . . . . . . . . . 4.1 m0 -130.57 132.31 45.48 Favored 'General case' 0 N--CA 1.466 0.357 0 C-N-CA 123.791 0.836 . . . . 0.0 108.9 -174.062 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 64.7 p -80.4 174.1 11.94 Favored 'General case' 0 C--O 1.245 0.844 0 N-CA-C 108.912 -0.773 . . . . 0.0 108.912 167.927 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . 0.408 ' HA ' HD12 ' A' ' 34' ' ' LEU . 13.5 p -57.35 -35.38 48.97 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.262 0 C-N-CA 122.565 0.346 . . . . 0.0 111.38 -174.724 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 14.8 pt-20 -73.73 -37.75 65.0 Favored 'General case' 0 CA--C 1.551 0.99 0 C-N-CA 123.963 0.905 . . . . 0.0 111.635 178.879 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 15.4 mm100 -67.49 -33.49 75.22 Favored 'General case' 0 N--CA 1.479 1.014 0 C-N-CA 123.311 0.644 . . . . 0.0 110.666 179.998 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . 0.468 ' O ' ' HD3' ' A' ' 75' ' ' LYS . 83.2 mt -59.02 -48.83 80.16 Favored 'General case' 0 N--CA 1.473 0.721 0 N-CA-C 109.256 -0.646 . . . . 0.0 109.256 171.738 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 29.6 mtp180 -68.09 -12.93 61.74 Favored 'General case' 0 N--CA 1.487 1.422 0 CA-C-N 114.638 -1.164 . . . . 0.0 113.221 -176.949 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 46.1 t -56.85 117.64 4.14 Favored 'General case' 0 N--CA 1.48 1.032 0 C-N-CA 123.67 0.788 . . . . 0.0 109.929 176.784 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 12.4 pt-20 -65.58 -33.93 77.06 Favored 'General case' 0 N--CA 1.48 1.044 0 C-N-CA 123.427 0.691 . . . . 0.0 112.06 -172.248 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 18.0 mm-40 -74.07 -22.53 59.49 Favored 'General case' 0 N--CA 1.471 0.597 0 C-N-CA 123.309 0.643 . . . . 0.0 111.19 179.65 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 5.3 tt -76.2 116.97 60.77 Favored Pre-proline 0 CA--C 1.545 0.781 0 N-CA-C 107.281 -1.377 . . . . 0.0 107.281 171.002 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 17.9 Cg_exo -66.62 136.14 41.4 Favored 'Trans proline' 0 C--N 1.375 1.963 0 C-N-CA 122.831 2.354 . . . . 0.0 111.831 -177.895 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . 0.439 ' HZ3' ' HA ' ' A' ' 74' ' ' ASN . 16.7 ptpt -64.72 -33.4 75.87 Favored 'General case' 0 CA--C 1.548 0.899 0 C-N-CA 122.963 0.505 . . . . 0.0 110.036 177.365 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 55.0 pttt -71.19 -27.06 63.24 Favored 'General case' 0 N--CA 1.478 0.956 0 C-N-CA 123.946 0.898 . . . . 0.0 111.356 179.912 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 14.9 t70 -63.34 -36.72 84.65 Favored 'General case' 0 CA--C 1.552 1.022 0 C-N-CA 122.97 0.508 . . . . 0.0 109.702 172.561 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 42.8 mt -73.28 -47.17 47.66 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.923 0 C-N-CA 123.902 0.881 . . . . 0.0 110.183 177.818 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 82.7 mt -56.82 -39.53 65.12 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.707 0 C-N-CA 123.553 0.741 . . . . 0.0 110.953 178.973 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 37.8 ttmt -62.96 -44.52 95.84 Favored 'General case' 0 N--CA 1.476 0.865 0 C-N-CA 123.254 0.622 . . . . 0.0 110.679 178.702 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 22.8 t80 -59.34 -46.39 88.74 Favored 'General case' 0 N--CA 1.478 0.951 0 CA-C-N 115.269 -0.878 . . . . 0.0 110.42 177.274 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . 0.409 ' HB3' ' HE2' ' A' ' 56' ' ' PHE . 96.6 mt -72.47 -30.76 64.84 Favored 'General case' 0 CA--C 1.539 0.555 0 CA-C-N 114.625 -1.171 . . . . 0.0 112.212 -175.187 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . 0.5 ' HA ' HD22 ' A' ' 57' ' ' LEU . 3.0 pt20 -84.08 -34.24 24.21 Favored 'General case' 0 N--CA 1.483 1.176 0 CA-C-N 117.895 0.316 . . . . 0.0 111.42 179.796 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 43.0 tt0 -67.89 -39.67 83.63 Favored 'General case' 0 N--CA 1.48 1.056 0 CA-C-O 121.403 0.621 . . . . 0.0 110.569 -179.913 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 76.7 m80 -96.37 -49.8 5.03 Favored 'General case' 0 N--CA 1.469 0.503 0 CA-C-N 114.865 -1.061 . . . . 0.0 111.297 -175.584 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . 0.55 ' HA2' ' HA ' ' A' ' 91' ' ' PHE . . . -60.77 141.31 48.1 Favored Glycine 0 C--N 1.345 1.063 0 O-C-N 123.396 0.435 . . . . 0.0 113.698 178.505 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 16.8 t -88.54 174.03 8.31 Favored 'General case' 0 N--CA 1.479 1.016 0 C-N-CA 122.737 0.415 . . . . 0.0 111.296 -176.842 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 3.2 m-20 -48.29 -45.43 34.78 Favored 'General case' 0 N--CA 1.489 1.477 0 C-N-CA 125.839 1.656 . . . . 0.0 113.831 -170.187 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 42.0 t -66.35 -43.09 87.03 Favored 'General case' 0 N--CA 1.478 0.975 0 C-N-CA 123.402 0.681 . . . . 0.0 110.855 -178.386 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 56' ' ' PHE . . . . . 0.543 ' HB2' ' HB3' ' A' ' 90' ' ' ARG . 85.1 t80 -62.08 -40.2 95.01 Favored 'General case' 0 N--CA 1.48 1.037 0 C-N-CA 123.324 0.65 . . . . 0.0 110.316 176.499 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . 0.5 HD22 ' HA ' ' A' ' 49' ' ' GLN . 32.0 mt -73.01 -35.68 66.86 Favored 'General case' 0 C--O 1.218 -0.591 0 CA-C-N 115.095 -0.957 . . . . 0.0 111.906 -175.532 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -73.54 -49.32 27.07 Favored 'General case' 0 N--CA 1.473 0.69 0 C-N-CA 122.64 0.376 . . . . 0.0 110.785 179.416 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 27.2 mm-40 -55.15 -36.89 66.29 Favored 'General case' 0 N--CA 1.481 1.114 0 C-N-CA 123.756 0.822 . . . . 0.0 112.253 178.586 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 57.9 m80 -108.11 1.5 22.33 Favored 'General case' 0 CA--C 1.55 0.978 0 C-N-CA 123.022 0.529 . . . . 0.0 112.338 -177.117 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 57.4 mtpt 54.93 35.31 24.19 Favored 'General case' 0 N--CA 1.496 1.857 0 C-N-CA 124.405 1.082 . . . . 0.0 112.796 177.375 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . 0.426 ' HA ' HG11 ' A' ' 69' ' ' VAL . 92.3 mt -90.13 -6.62 55.19 Favored 'General case' 0 N--CA 1.482 1.133 0 C-N-CA 123.483 0.713 . . . . 0.0 111.931 -176.319 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 1.2 pp -73.51 162.65 29.03 Favored 'General case' 0 N--CA 1.481 1.079 0 C-N-CA 123.749 0.82 . . . . 0.0 111.75 179.146 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 81.23 -148.26 28.05 Favored Glycine 0 CA--C 1.528 0.864 0 CA-C-N 115.353 -0.84 . . . . 0.0 113.613 174.614 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -68.0 113.96 6.13 Favored 'General case' 0 N--CA 1.478 0.949 0 C-N-CA 123.269 0.628 . . . . 0.0 109.505 -178.465 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 41.4 mt -55.02 -45.33 76.75 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.874 0 O-C-N 124.822 1.326 . . . . 0.0 110.968 -177.063 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 62.6 pttt -60.71 -37.44 81.69 Favored 'General case' 0 CA--C 1.554 1.114 0 C-N-CA 123.994 0.917 . . . . 0.0 111.93 179.459 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 61.5 t30 -72.75 -36.68 67.75 Favored 'General case' 0 N--CA 1.48 1.056 0 C-N-CA 123.376 0.67 . . . . 0.0 110.456 179.485 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 69' ' ' VAL . . . . . 0.426 HG11 ' HA ' ' A' ' 62' ' ' LEU . 57.8 t -66.25 -36.4 77.31 Favored 'Isoleucine or valine' 0 C--O 1.214 -0.789 0 CA-C-N 115.562 -0.745 . . . . 0.0 109.621 173.017 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -67.52 -15.42 63.65 Favored 'General case' 0 N--CA 1.478 0.962 0 C-N-CA 123.963 0.905 . . . . 0.0 113.349 -174.317 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 21.2 ptmt -94.65 -19.99 19.95 Favored 'General case' 0 N--CA 1.481 1.077 0 O-C-N 121.617 -0.677 . . . . 0.0 111.872 177.691 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 9.0 t -112.84 -15.07 12.99 Favored 'General case' 0 N--CA 1.484 1.23 0 C-N-CA 123.155 0.582 . . . . 0.0 111.716 -176.574 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -110.91 101.56 10.13 Favored 'General case' 0 C--O 1.24 0.56 0 C-N-CA 124.139 0.976 . . . . 0.0 108.41 178.892 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 74' ' ' ASN . . . . . 0.439 ' HA ' ' HZ3' ' A' ' 41' ' ' LYS . 26.1 p-10 -72.06 160.76 31.93 Favored 'General case' 0 CA--C 1.534 0.353 0 CA-C-N 116.242 -0.436 . . . . 0.0 110.277 177.009 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . 0.468 ' HD3' ' O ' ' A' ' 34' ' ' LEU . 36.8 ttmt -63.84 -33.28 75.34 Favored 'General case' 0 CA--C 1.543 0.704 0 C-N-CA 123.549 0.74 . . . . 0.0 111.708 -173.883 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 21.6 t70 -62.81 -33.18 74.69 Favored 'General case' 0 N--CA 1.485 1.321 0 C-N-CA 123.638 0.775 . . . . 0.0 110.857 178.985 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 40.9 t60 -70.63 -36.89 73.7 Favored 'General case' 0 N--CA 1.477 0.912 0 C-N-CA 124.603 1.161 . . . . 0.0 110.468 174.499 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 60.8 mt -71.03 -31.24 67.67 Favored 'General case' 0 N--CA 1.483 1.179 0 C-N-CA 123.137 0.575 . . . . 0.0 111.577 -177.561 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 79' ' ' VAL . . . . . 0.409 HG23 ' O ' ' A' ' 75' ' ' LYS . 99.5 t -64.03 -44.27 97.74 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.759 0 O-C-N 123.959 0.787 . . . . 0.0 109.355 173.641 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 24.6 m -61.62 -42.79 99.38 Favored 'General case' 0 N--CA 1.474 0.746 0 CA-C-N 115.16 -0.927 . . . . 0.0 110.982 176.304 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -67.4 -39.97 85.58 Favored 'General case' 0 N--CA 1.473 0.698 0 C-N-CA 123.085 0.554 . . . . 0.0 111.04 178.271 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 82' ' ' TYR . . . . . 0.467 ' CD2' HD13 ' A' ' 34' ' ' LEU . 64.5 t80 -62.96 -56.97 12.46 Favored 'General case' 0 N--CA 1.472 0.658 0 C-N-CA 124.047 0.939 . . . . 0.0 110.419 -175.363 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 83' ' ' ASN . . . . . . . . . . . . . 27.8 m-80 -62.83 -40.69 98.2 Favored 'General case' 0 N--CA 1.482 1.141 0 C-N-CA 123.293 0.637 . . . . 0.0 111.25 -176.129 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 13.2 m170 -70.08 -25.49 63.55 Favored 'General case' 0 N--CA 1.481 1.114 0 C-N-CA 123.773 0.829 . . . . 0.0 111.954 -179.465 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 85' ' ' LEU . . . . . 0.437 ' HG ' ' HD2' ' A' ' 91' ' ' PHE . 57.7 tp -56.71 -54.22 48.68 Favored 'General case' 0 N--CA 1.486 1.359 0 CA-C-O 121.912 0.863 . . . . 0.0 110.763 178.809 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 86' ' ' PHE . . . . . 0.422 ' HE1' ' HB2' ' A' ' 25' ' ' PRO . 20.1 m-85 -73.88 -32.06 63.43 Favored 'General case' 0 CA--C 1.554 1.114 0 CA-C-N 113.483 -1.689 . . . . 0.0 110.16 -178.605 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 9.7 tp10 -68.85 -23.33 64.23 Favored 'General case' 0 N--CA 1.485 1.292 0 C-N-CA 124.718 1.207 . . . . 0.0 112.285 -174.352 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 19.9 p -128.39 5.24 5.71 Favored 'General case' 0 N--CA 1.487 1.415 0 C-N-CA 123.289 0.636 . . . . 0.0 111.867 179.694 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 14.3 mmmm 60.6 29.71 19.21 Favored 'General case' 0 N--CA 1.487 1.408 0 C-N-CA 124.109 0.964 . . . . 0.0 111.869 175.665 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 90' ' ' ARG . . . . . 0.543 ' HB3' ' HB2' ' A' ' 56' ' ' PHE . 52.2 mtt85 -66.81 -11.19 54.42 Favored 'General case' 0 N--CA 1.496 1.838 0 N-CA-C 114.403 1.26 . . . . 0.0 114.403 -171.079 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 91' ' ' PHE . . . . . 0.55 ' HA ' ' HA2' ' A' ' 52' ' ' GLY . 16.6 p90 -67.74 138.44 56.24 Favored 'General case' 0 CA--C 1.54 0.573 0 N-CA-C 112.484 0.55 . . . . 0.0 112.484 176.852 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 3.8 tmtp? . . . . . 0 CA--C 1.552 1.048 0 C-N-CA 125.153 1.381 . . . . 0.0 109.639 -178.796 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 20' ' ' MET . . . . . . . . . . . . . 23.2 ptt? . . . . . 0 N--CA 1.483 1.203 0 CA-C-O 120.602 0.239 . . . . 0.0 110.746 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -166.64 142.17 4.44 Favored 'General case' 0 N--CA 1.473 0.707 0 C-N-CA 124.355 1.062 . . . . 0.0 108.768 179.279 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . 58.82 37.26 24.92 Favored 'General case' 0 N--CA 1.483 1.179 0 C-N-CA 123.916 0.887 . . . . 0.0 110.771 -175.993 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -86.72 40.76 0.92 Allowed 'General case' 0 N--CA 1.48 1.028 0 C-N-CA 124.123 0.969 . . . . 0.0 110.957 -176.252 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 15.7 m -87.86 153.68 52.38 Favored Pre-proline 0 CA--C 1.547 0.842 0 C-N-CA 124.271 1.028 . . . . 0.0 109.452 179.348 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 96.2 Cg_endo -80.13 112.49 2.82 Favored 'Trans proline' 0 C--N 1.362 1.288 0 C-N-CA 122.366 2.044 . . . . 0.0 111.602 175.209 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 11.0 pt20 -85.57 119.44 25.92 Favored 'General case' 0 C--O 1.242 0.68 0 N-CA-C 105.97 -1.863 . . . . 0.0 105.97 164.769 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -57.85 125.68 24.1 Favored 'General case' 0 C--N 1.353 0.734 0 CA-C-O 122.002 0.906 . . . . 0.0 111.592 -168.892 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -84.36 -21.25 30.96 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 114.28 -1.327 . . . . 0.0 110.118 -178.691 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 29' ' ' TRP . . . . . . . . . . . . . 4.5 m-90 -140.94 147.6 39.06 Favored 'General case' 0 N--CA 1.476 0.833 0 C-N-CA 124.439 1.096 . . . . 0.0 109.614 -176.297 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 36.3 p -83.02 174.29 11.01 Favored 'General case' 0 N--CA 1.476 0.857 0 N-CA-C 109.629 -0.508 . . . . 0.0 109.629 169.098 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . 0.564 HG12 HG13 ' A' ' 79' ' ' VAL . 45.5 t -52.26 -45.52 43.85 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.022 0 C-N-CA 123.821 0.848 . . . . 0.0 111.743 179.781 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -66.31 -42.81 87.75 Favored 'General case' 0 N--CA 1.48 1.059 0 C-N-CA 123.238 0.615 . . . . 0.0 111.395 179.051 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 15.7 mm-40 -64.7 -29.07 70.06 Favored 'General case' 0 N--CA 1.482 1.146 0 C-N-CA 123.253 0.621 . . . . 0.0 110.94 179.883 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . 0.449 ' HA ' HD22 ' A' ' 39' ' ' LEU . 79.0 mt -69.53 -53.67 17.9 Favored 'General case' 0 N--CA 1.469 0.522 0 C-N-CA 123.129 0.572 . . . . 0.0 109.772 172.984 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . 0.408 ' HG3' ' O ' ' A' ' 31' ' ' VAL . 83.0 mtp180 -65.05 -15.15 62.02 Favored 'General case' 0 N--CA 1.485 1.321 0 C-N-CA 123.937 0.895 . . . . 0.0 112.125 -173.706 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 47.8 t -59.72 117.65 5.21 Favored 'General case' 0 CA--C 1.54 0.587 0 N-CA-C 109.29 -0.633 . . . . 0.0 109.29 169.61 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 11.5 pt-20 -65.65 -16.29 63.59 Favored 'General case' 0 N--CA 1.477 0.884 0 C-N-CA 124.3 1.04 . . . . 0.0 111.893 178.954 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 12.7 mm100 -68.64 -25.68 64.95 Favored 'General case' 0 CA--C 1.545 0.753 0 C-N-CA 123.945 0.898 . . . . 0.0 110.639 173.822 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . 0.449 HD22 ' HA ' ' A' ' 34' ' ' LEU . 26.0 tp -88.65 117.77 68.67 Favored Pre-proline 0 CA--C 1.545 0.755 0 N-CA-C 108.252 -1.018 . . . . 0.0 108.252 171.082 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 34.6 Cg_exo -62.08 143.35 94.73 Favored 'Trans proline' 0 C--N 1.374 1.892 0 C-N-CA 122.776 2.318 . . . . 0.0 112.571 177.522 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 54.3 mtmt -60.61 -36.65 79.1 Favored 'General case' 0 N--CA 1.471 0.613 0 CA-C-N 115.538 -0.756 . . . . 0.0 110.693 174.915 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 61.5 pttt -65.51 -33.98 77.19 Favored 'General case' 0 N--CA 1.473 0.698 0 C-N-CA 123.34 0.656 . . . . 0.0 111.152 178.878 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 27.9 t0 -69.1 -31.63 70.48 Favored 'General case' 0 N--CA 1.476 0.868 0 CA-C-O 121.288 0.566 . . . . 0.0 110.696 -178.775 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 53.7 mt -73.59 -47.12 46.09 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.736 0 CA-C-N 115.667 -0.697 . . . . 0.0 110.351 176.125 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 73.5 mt -59.95 -35.24 59.62 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.184 0 C-N-CA 123.507 0.723 . . . . 0.0 110.498 177.225 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 88.0 tttt -60.27 -42.59 95.69 Favored 'General case' 0 CA--C 1.548 0.896 0 C-N-CA 124.308 1.043 . . . . 0.0 110.708 176.822 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 22.3 t80 -67.03 -47.27 71.9 Favored 'General case' 0 CA--C 1.547 0.841 0 CA-C-N 114.1 -1.409 . . . . 0.0 111.231 176.313 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . 0.536 ' HB3' ' HE2' ' A' ' 56' ' ' PHE . 87.4 mt -70.38 -36.95 74.43 Favored 'General case' 0 N--CA 1.473 0.709 0 C-N-CA 124.056 0.942 . . . . 0.0 112.414 -173.921 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 3.1 pt20 -80.56 -32.24 36.69 Favored 'General case' 0 N--CA 1.478 0.959 0 C-N-CA 122.457 0.303 . . . . 0.0 111.059 -175.556 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 44.4 tt0 -59.87 -37.0 78.08 Favored 'General case' 0 N--CA 1.478 0.96 0 C-N-CA 123.278 0.631 . . . . 0.0 111.053 -176.8 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 81.8 m-70 -106.19 -37.13 6.68 Favored 'General case' 0 N--CA 1.476 0.852 0 CA-C-N 115.609 -0.723 . . . . 0.0 111.247 -176.355 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . 0.476 ' HA2' ' HA ' ' A' ' 91' ' ' PHE . . . -60.26 127.31 43.55 Favored Glycine 0 C--N 1.346 1.128 0 O-C-N 123.924 0.765 . . . . 0.0 113.841 -178.349 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 25.7 t -68.28 168.09 13.11 Favored 'General case' 0 CA--C 1.548 0.88 0 C-N-CA 124.274 1.03 . . . . 0.0 110.948 -179.906 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 19.5 m-20 -57.25 -27.79 62.38 Favored 'General case' 0 N--CA 1.486 1.371 0 C-N-CA 124.156 0.983 . . . . 0.0 112.801 -172.877 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 19.6 p -64.57 -50.62 66.52 Favored 'General case' 0 CA--C 1.548 0.878 0 C-N-CA 123.723 0.809 . . . . 0.0 110.925 174.426 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 56' ' ' PHE . . . . . 0.552 ' HB2' ' HB3' ' A' ' 90' ' ' ARG . 58.9 t80 -61.23 -37.22 82.28 Favored 'General case' 0 N--CA 1.482 1.128 0 C-N-CA 123.959 0.904 . . . . 0.0 110.905 178.398 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 84.9 mt -66.41 -41.79 88.74 Favored 'General case' 0 CA--C 1.54 0.578 0 CA-C-N 114.357 -1.292 . . . . 0.0 110.976 176.85 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -71.08 -27.03 63.32 Favored 'General case' 0 N--CA 1.479 1.011 0 C-N-CA 123.894 0.878 . . . . 0.0 112.5 -179.64 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -61.72 -50.24 73.21 Favored 'General case' 0 CA--C 1.547 0.838 0 C-N-CA 123.675 0.79 . . . . 0.0 112.521 -177.467 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 22.4 t-80 -119.07 14.26 13.1 Favored 'General case' 0 N--CA 1.487 1.411 0 N-CA-C 112.568 0.581 . . . . 0.0 112.568 -179.761 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 50.5 mtpt 55.31 49.51 16.9 Favored 'General case' 0 N--CA 1.482 1.175 0 C-N-CA 123.7 0.8 . . . . 0.0 110.962 -172.917 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . 0.436 ' HA ' HG12 ' A' ' 69' ' ' VAL . 86.7 mt -79.69 -6.99 58.3 Favored 'General case' 0 N--CA 1.48 1.05 0 C-N-CA 123.759 0.824 . . . . 0.0 110.76 176.349 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 1.2 pp -76.12 159.86 30.32 Favored 'General case' 0 N--CA 1.475 0.805 0 C-N-CA 123.945 0.898 . . . . 0.0 110.936 173.225 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 86.14 -160.5 33.56 Favored Glycine 0 C--N 1.343 0.947 0 CA-C-N 115.524 -0.762 . . . . 0.0 113.2 179.212 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 16.5 m120 -63.5 123.56 19.09 Favored 'General case' 0 N--CA 1.474 0.73 0 C-N-CA 123.209 0.604 . . . . 0.0 110.4 179.622 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 53.3 mt -56.49 -46.29 82.24 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.657 0 C-N-CA 124.599 1.16 . . . . 0.0 111.73 -175.006 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 62.7 pttt -58.84 -37.43 76.44 Favored 'General case' 0 CA--C 1.556 1.182 0 C-N-CA 123.855 0.862 . . . . 0.0 111.537 178.516 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 5.9 m-20 -70.42 -31.22 68.32 Favored 'General case' 0 N--CA 1.481 1.088 0 C-N-CA 124.201 1.0 . . . . 0.0 110.62 179.695 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 69' ' ' VAL . . . . . 0.436 HG12 ' HA ' ' A' ' 62' ' ' LEU . 30.7 t -74.28 -37.19 45.09 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.937 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.064 172.289 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -68.3 -21.66 64.77 Favored 'General case' 0 N--CA 1.484 1.256 0 C-N-CA 124.059 0.944 . . . . 0.0 112.765 -174.608 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 20.9 ptmt -83.0 -18.14 40.9 Favored 'General case' 0 N--CA 1.482 1.163 0 C-N-CA 122.758 0.423 . . . . 0.0 111.442 179.714 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 8.9 t -114.11 -5.67 13.08 Favored 'General case' 0 N--CA 1.478 0.969 0 C-N-CA 123.762 0.825 . . . . 0.0 110.605 179.471 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -95.35 131.7 41.17 Favored 'General case' 0 N--CA 1.47 0.537 0 C-N-CA 123.504 0.722 . . . . 0.0 110.378 177.555 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 30.7 t30 -97.14 145.04 26.4 Favored 'General case' 0 C--O 1.242 0.677 0 N-CA-C 108.169 -1.048 . . . . 0.0 108.169 170.37 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 4.6 tppp? -55.85 -43.94 77.56 Favored 'General case' 0 N--CA 1.474 0.748 0 C-N-CA 124.044 0.938 . . . . 0.0 111.754 -178.693 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 22.3 t70 -57.97 -44.03 86.84 Favored 'General case' 0 N--CA 1.479 0.98 0 C-N-CA 123.758 0.823 . . . . 0.0 111.633 -177.842 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 26.2 t60 -75.38 -26.37 58.41 Favored 'General case' 0 N--CA 1.473 0.702 0 C-N-CA 122.639 0.375 . . . . 0.0 111.085 179.729 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 67.6 mt -68.16 -31.11 70.44 Favored 'General case' 0 N--CA 1.486 1.332 0 CA-C-N 118.225 0.466 . . . . 0.0 111.931 176.026 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 79' ' ' VAL . . . . . 0.564 HG13 HG12 ' A' ' 31' ' ' VAL . 97.0 t -69.65 -39.73 78.55 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.734 0 CA-C-N 115.565 -0.743 . . . . 0.0 109.66 171.169 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 37.4 m -63.37 -40.25 96.74 Favored 'General case' 0 CA--C 1.547 0.848 0 C-N-CA 123.524 0.73 . . . . 0.0 111.204 176.576 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -71.44 -40.64 70.25 Favored 'General case' 0 N--CA 1.476 0.833 0 C-N-CA 123.895 0.878 . . . . 0.0 109.592 178.988 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 82' ' ' TYR . . . . . . . . . . . . . 11.7 t80 -54.49 -54.75 36.84 Favored 'General case' 0 N--CA 1.474 0.731 0 C-N-CA 124.648 1.179 . . . . 0.0 110.762 175.741 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 83' ' ' ASN . . . . . . . . . . . . . 45.1 m-80 -67.46 -40.67 85.36 Favored 'General case' 0 N--CA 1.478 0.933 0 C-N-CA 122.475 0.31 . . . . 0.0 110.997 -176.712 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 38.6 m170 -66.65 -24.62 66.31 Favored 'General case' 0 N--CA 1.483 1.21 0 C-N-CA 123.535 0.734 . . . . 0.0 111.663 178.608 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 85' ' ' LEU . . . . . 0.454 ' HG ' ' HD2' ' A' ' 91' ' ' PHE . 35.4 tp -58.6 -53.83 53.93 Favored 'General case' 0 N--CA 1.482 1.148 0 C-N-CA 123.793 0.837 . . . . 0.0 110.653 177.042 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 86' ' ' PHE . . . . . 0.406 ' HA ' ' HE2' ' A' ' 91' ' ' PHE . 36.6 m-85 -74.85 -29.78 61.15 Favored 'General case' 0 N--CA 1.474 0.729 0 CA-C-N 114.593 -1.185 . . . . 0.0 111.428 -178.896 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 40.7 tt0 -58.78 -47.69 83.85 Favored 'General case' 0 N--CA 1.477 0.887 0 C-N-CA 125.013 1.325 . . . . 0.0 112.831 -173.367 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 30.2 p -120.18 8.59 10.94 Favored 'General case' 0 N--CA 1.477 0.91 0 C-N-CA 123.634 0.774 . . . . 0.0 111.271 -178.043 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 96.6 mttt 54.78 61.78 2.82 Favored 'General case' 0 N--CA 1.477 0.915 0 C-N-CA 124.277 1.031 . . . . 0.0 111.072 -177.108 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 90' ' ' ARG . . . . . 0.552 ' HB3' ' HB2' ' A' ' 56' ' ' PHE . 44.5 mtt85 -75.63 -8.53 57.02 Favored 'General case' 0 N--CA 1.476 0.831 0 CA-C-N 114.06 -1.427 . . . . 0.0 111.807 178.403 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 91' ' ' PHE . . . . . 0.476 ' HA ' ' HA2' ' A' ' 52' ' ' GLY . 23.2 p90 -81.49 162.02 23.41 Favored 'General case' 0 N--CA 1.469 0.524 0 C-N-CA 124.164 0.986 . . . . 0.0 111.11 172.131 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 6.5 tmtm? . . . . . 0 C--O 1.253 1.265 0 CA-C-N 115.045 -0.98 . . . . 0.0 109.003 175.016 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 20' ' ' MET . . . . . . . . . . . . . 14.3 tpt . . . . . 0 N--CA 1.483 1.202 0 N-CA-C 110.38 -0.23 . . . . 0.0 110.38 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -121.28 89.69 3.17 Favored 'General case' 0 N--CA 1.474 0.771 0 N-CA-C 108.245 -1.021 . . . . 0.0 108.245 171.673 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -64.5 -47.64 78.16 Favored 'General case' 0 N--CA 1.481 1.083 0 C-N-CA 124.025 0.93 . . . . 0.0 110.455 -179.966 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -104.94 105.27 15.24 Favored 'General case' 0 C--O 1.236 0.383 0 N-CA-C 107.647 -1.242 . . . . 0.0 107.647 171.101 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 27.7 m -78.23 148.04 73.78 Favored Pre-proline 0 CA--C 1.548 0.898 0 N-CA-C 109.519 -0.548 . . . . 0.0 109.519 179.083 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 59.7 Cg_endo -73.41 93.1 0.83 Allowed 'Trans proline' 0 C--N 1.365 1.409 0 C-N-CA 122.366 2.044 . . . . 0.0 110.467 174.74 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 19.2 pt20 -76.54 -176.7 3.85 Favored 'General case' 0 C--O 1.244 0.804 0 CA-C-N 113.203 -1.817 . . . . 0.0 110.208 -178.696 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . 0.651 HH21 HG23 ' A' ' 30' ' ' THR . 15.4 ttt180 -60.27 120.89 10.68 Favored 'General case' 0 CA--C 1.549 0.905 0 C-N-CA 123.528 0.731 . . . . 0.0 110.522 175.098 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -90.09 -60.01 2.04 Favored 'General case' 0 CA--C 1.549 0.924 0 CA-C-N 114.589 -1.187 . . . . 0.0 109.456 174.852 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 29' ' ' TRP . . . . . . . . . . . . . 3.8 m-90 -89.67 149.54 22.74 Favored 'General case' 0 N--CA 1.474 0.762 0 C-N-CA 124.121 0.969 . . . . 0.0 111.896 -175.672 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 30' ' ' THR . . . . . 0.651 HG23 HH21 ' A' ' 27' ' ' ARG . 66.8 p -82.07 173.67 11.94 Favored 'General case' 0 N--CA 1.471 0.611 0 C-N-CA 123.328 0.651 . . . . 0.0 109.854 168.494 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . 0.482 ' HA ' HD13 ' A' ' 34' ' ' LEU . 69.3 t -58.99 -38.28 72.81 Favored 'Isoleucine or valine' 0 CA--C 1.554 1.1 0 C-N-CA 123.581 0.753 . . . . 0.0 111.381 -179.013 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 11.6 pt-20 -73.49 -36.25 65.75 Favored 'General case' 0 N--CA 1.482 1.158 0 CA-C-N 116.112 -0.494 . . . . 0.0 111.743 178.402 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 99.5 mt-30 -67.13 -28.17 67.92 Favored 'General case' 0 N--CA 1.482 1.134 0 C-N-CA 123.156 0.582 . . . . 0.0 111.33 175.667 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . 0.522 HD12 ' HA ' ' A' ' 79' ' ' VAL . 89.2 mt -68.04 -52.48 34.93 Favored 'General case' 0 N--CA 1.477 0.918 0 C-N-CA 123.355 0.662 . . . . 0.0 110.963 175.463 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 15.5 ptm180 -74.7 -10.92 59.99 Favored 'General case' 0 N--CA 1.485 1.308 0 C-N-CA 123.154 0.582 . . . . 0.0 111.654 -177.606 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 33.3 t -53.7 121.23 7.43 Favored 'General case' 0 N--CA 1.478 0.965 0 C-N-CA 123.619 0.767 . . . . 0.0 110.719 171.302 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 44.1 mt-10 -67.55 -25.82 66.0 Favored 'General case' 0 N--CA 1.477 0.881 0 C-N-CA 124.234 1.014 . . . . 0.0 111.927 -174.634 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 94.8 mt-30 -65.93 -29.45 69.86 Favored 'General case' 0 N--CA 1.479 0.981 0 C-N-CA 123.812 0.845 . . . . 0.0 110.838 177.004 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 44.0 tp -83.05 117.1 67.54 Favored Pre-proline 0 CA--C 1.549 0.905 0 N-CA-C 107.749 -1.204 . . . . 0.0 107.749 170.88 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 15.9 Cg_exo -70.99 163.73 38.21 Favored 'Trans proline' 0 C--N 1.372 1.791 0 C-N-CA 122.844 2.363 . . . . 0.0 113.272 177.864 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 37.1 mtmm -68.24 -42.48 79.66 Favored 'General case' 0 N--CA 1.475 0.775 0 CA-C-N 115.537 -0.756 . . . . 0.0 110.587 175.984 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 55.2 pttt -61.41 -28.95 69.62 Favored 'General case' 0 N--CA 1.48 1.048 0 C-N-CA 123.947 0.899 . . . . 0.0 111.505 -179.216 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 6.5 t70 -70.81 -43.37 68.76 Favored 'General case' 0 CA--C 1.545 0.779 0 C-N-CA 122.598 0.359 . . . . 0.0 110.469 -179.158 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 27.9 mt -72.3 -45.68 60.08 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.122 0 C-N-CA 122.678 0.391 . . . . 0.0 110.388 179.941 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 45' ' ' ILE . . . . . 0.431 HD11 ' HB3' ' A' ' 70' ' ' ALA . 98.2 mt -58.89 -39.54 77.91 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.556 0 C-N-CA 123.366 0.667 . . . . 0.0 110.915 177.757 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 46' ' ' LYS . . . . . 0.403 ' O ' ' HB2' ' A' ' 50' ' ' GLU . 62.6 tttm -62.28 -46.72 87.54 Favored 'General case' 0 N--CA 1.473 0.723 0 C-N-CA 123.057 0.543 . . . . 0.0 110.347 175.887 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 20.5 t80 -58.56 -51.11 71.26 Favored 'General case' 0 N--CA 1.476 0.866 0 O-C-N 124.362 1.039 . . . . 0.0 110.569 -179.752 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 95.3 mt -70.87 -31.33 67.97 Favored 'General case' 0 N--CA 1.468 0.466 0 CA-C-N 115.536 -0.756 . . . . 0.0 112.084 -173.746 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 1.9 pt20 -81.2 -26.35 36.02 Favored 'General case' 0 N--CA 1.481 1.093 0 N-CA-C 110.079 -0.341 . . . . 0.0 110.079 176.871 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . 0.403 ' HB2' ' O ' ' A' ' 46' ' ' LYS . 7.6 tp10 -59.68 -33.57 71.74 Favored 'General case' 0 N--CA 1.474 0.758 0 C-N-CA 123.694 0.798 . . . . 0.0 110.964 -178.057 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 54.8 p-80 -132.09 -20.18 2.48 Favored 'General case' 0 N--CA 1.479 0.983 0 CA-C-O 117.858 -1.068 . . . . 0.0 113.573 -176.29 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . 0.455 ' HA2' ' HA ' ' A' ' 91' ' ' PHE . . . -67.24 144.97 45.39 Favored Glycine 0 N--CA 1.48 1.575 0 CA-C-N 119.447 1.022 . . . . 0.0 112.362 177.876 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 53.7 m -77.73 163.08 26.47 Favored 'General case' 0 N--CA 1.486 1.344 0 CA-C-N 117.546 0.673 . . . . 0.0 111.92 -177.114 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 9.1 m-20 -54.29 -43.41 71.04 Favored 'General case' 0 N--CA 1.485 1.295 0 C-N-CA 124.533 1.133 . . . . 0.0 113.199 -170.42 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 34.5 t -68.21 -40.71 82.04 Favored 'General case' 0 N--CA 1.479 1.019 0 C-N-CA 123.38 0.672 . . . . 0.0 111.223 -176.224 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 89.8 t80 -63.49 -48.08 79.1 Favored 'General case' 0 N--CA 1.478 0.954 0 C-N-CA 123.257 0.623 . . . . 0.0 109.713 177.386 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 63.6 mt -65.02 -32.45 74.18 Favored 'General case' 0 C--O 1.22 -0.487 0 CA-C-N 115.173 -0.921 . . . . 0.0 111.18 -178.205 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -70.17 -48.43 57.32 Favored 'General case' 0 N--CA 1.475 0.82 0 C-N-CA 123.313 0.645 . . . . 0.0 110.813 179.276 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 55.2 mt-10 -61.66 -36.59 81.26 Favored 'General case' 0 N--CA 1.481 1.078 0 C-N-CA 123.23 0.612 . . . . 0.0 111.947 -179.866 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 94.5 m-70 -99.27 -4.05 32.77 Favored 'General case' 0 N--CA 1.481 1.093 0 C-N-CA 122.517 0.327 . . . . 0.0 111.866 -178.444 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 33.8 mmtp 61.18 30.34 19.26 Favored 'General case' 0 N--CA 1.495 1.807 0 C-N-CA 124.177 0.991 . . . . 0.0 112.108 179.747 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 80.4 mt -80.3 -13.49 59.15 Favored 'General case' 0 N--CA 1.482 1.165 0 C-N-CA 124.177 0.991 . . . . 0.0 111.564 179.653 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -74.33 179.78 4.37 Favored 'General case' 0 N--CA 1.485 1.317 0 C-N-CA 123.484 0.713 . . . . 0.0 111.822 177.644 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 76.43 -160.0 50.51 Favored Glycine 0 C--N 1.342 0.891 0 CA-C-N 115.362 -0.835 . . . . 0.0 113.239 175.734 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 13.3 m120 -67.98 113.51 5.74 Favored 'General case' 0 N--CA 1.479 0.992 0 C-N-CA 123.087 0.555 . . . . 0.0 109.928 -178.88 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 44.2 mt -51.99 -53.06 19.62 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.116 0 C-N-CA 125.313 1.445 . . . . 0.0 112.287 -172.159 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 41.8 mtmt -64.25 -38.41 90.94 Favored 'General case' 0 N--CA 1.482 1.14 0 C-N-CA 124.257 1.023 . . . . 0.0 111.428 -175.674 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 50.6 t30 -66.02 -39.86 90.58 Favored 'General case' 0 N--CA 1.481 1.091 0 C-N-CA 124.113 0.965 . . . . 0.0 110.894 178.49 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 69' ' ' VAL . . . . . 0.408 HG13 HD13 ' A' ' 45' ' ' ILE . 97.5 t -67.39 -39.53 82.86 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.878 0 CA-C-N 115.853 -0.612 . . . . 0.0 109.597 174.129 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 70' ' ' ALA . . . . . 0.431 ' HB3' HD11 ' A' ' 45' ' ' ILE . . . -81.77 12.23 4.15 Favored 'General case' 0 N--CA 1.483 1.209 0 C-N-CA 124.216 1.006 . . . . 0.0 111.743 179.568 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 65.4 tttp -94.43 -31.03 14.15 Favored 'General case' 0 CA--C 1.544 0.731 0 C-N-CA 124.148 0.979 . . . . 0.0 110.123 170.985 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 8.8 t -122.28 -19.86 6.35 Favored 'General case' 0 N--CA 1.482 1.167 0 N-CA-C 112.667 0.618 . . . . 0.0 112.667 -170.759 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -77.89 148.41 34.61 Favored 'General case' 0 N--CA 1.477 0.893 0 C-N-CA 122.794 0.438 . . . . 0.0 109.848 176.771 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 9.4 p30 -98.76 163.87 12.45 Favored 'General case' 0 N--CA 1.483 1.203 0 C-N-CA 122.587 0.355 . . . . 0.0 110.4 176.422 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 19.0 tptm -71.59 -39.39 70.58 Favored 'General case' 0 N--CA 1.478 0.953 0 C-N-CA 123.658 0.783 . . . . 0.0 111.357 -172.75 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 25.2 t70 -63.69 -33.08 74.84 Favored 'General case' 0 N--CA 1.483 1.217 0 C-N-CA 124.412 1.085 . . . . 0.0 111.088 -176.435 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 69.5 t60 -58.43 -43.82 88.88 Favored 'General case' 0 N--CA 1.475 0.786 0 C-N-CA 124.891 1.276 . . . . 0.0 110.26 173.416 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 56.7 mt -68.56 -31.53 70.81 Favored 'General case' 0 N--CA 1.476 0.834 0 CA-C-N 115.389 -0.823 . . . . 0.0 112.076 -174.907 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 79' ' ' VAL . . . . . 0.522 ' HA ' HD12 ' A' ' 34' ' ' LEU . 53.7 t -65.1 -48.45 83.77 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.883 0 O-C-N 124.114 0.884 . . . . 0.0 109.775 177.263 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 56.8 m -62.8 -44.52 95.95 Favored 'General case' 0 N--CA 1.474 0.771 0 CA-C-N 115.193 -0.912 . . . . 0.0 111.58 178.309 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -64.39 -48.24 76.17 Favored 'General case' 0 N--CA 1.476 0.838 0 C-N-CA 123.37 0.668 . . . . 0.0 110.557 -179.137 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 82' ' ' TYR . . . . . 0.625 ' HH ' ' HG3' ' A' ' 27' ' ' ARG . 74.0 t80 -53.59 -57.44 10.74 Favored 'General case' 0 N--CA 1.471 0.59 0 C-N-CA 124.288 1.035 . . . . 0.0 111.136 -178.133 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 83' ' ' ASN . . . . . . . . . . . . . 46.5 m-80 -66.76 -28.25 68.25 Favored 'General case' 0 N--CA 1.478 0.966 0 CA-C-N 115.359 -0.837 . . . . 0.0 111.913 -172.652 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 10.6 m170 -77.47 -28.47 52.31 Favored 'General case' 0 N--CA 1.482 1.129 0 C-N-CA 123.155 0.582 . . . . 0.0 111.927 177.6 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 34.2 tp -59.89 -53.03 62.69 Favored 'General case' 0 N--CA 1.492 1.657 0 CA-C-O 121.571 0.701 . . . . 0.0 111.21 -177.518 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 86' ' ' PHE . . . . . 0.402 ' HA ' ' HE2' ' A' ' 91' ' ' PHE . 34.5 m-85 -73.9 -29.82 62.26 Favored 'General case' 0 N--CA 1.47 0.556 0 CA-C-N 113.993 -1.458 . . . . 0.0 110.743 -176.074 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 13.9 tp10 -69.19 -36.99 77.9 Favored 'General case' 0 N--CA 1.471 0.616 0 C-N-CA 123.532 0.733 . . . . 0.0 110.957 -176.7 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 60.5 p -106.92 0.49 23.87 Favored 'General case' 0 N--CA 1.478 0.935 0 C-N-CA 123.967 0.907 . . . . 0.0 111.683 -177.561 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 74.4 mmtt 61.88 27.15 16.51 Favored 'General case' 0 N--CA 1.489 1.475 0 C-N-CA 124.49 1.116 . . . . 0.0 112.24 174.919 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 54.2 mtt180 -73.46 4.58 4.62 Favored 'General case' 0 N--CA 1.492 1.628 0 N-CA-C 114.056 1.132 . . . . 0.0 114.056 -172.967 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 91' ' ' PHE . . . . . 0.455 ' HA ' ' HA2' ' A' ' 52' ' ' GLY . 5.8 p90 -70.43 141.92 52.05 Favored 'General case' 0 CA--C 1.551 0.995 0 CA-C-O 121.343 0.592 . . . . 0.0 111.783 169.955 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 13.6 tptp . . . . . 0 C--O 1.25 1.097 0 C-N-CA 127.753 2.421 . . . . 0.0 112.688 -176.856 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 20' ' ' MET . . . . . . . . . . . . . 60.5 mtt . . . . . 0 N--CA 1.478 0.972 0 N-CA-C 109.126 -0.694 . . . . 0.0 109.126 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -104.56 14.39 30.01 Favored 'General case' 0 N--CA 1.481 1.09 0 C-N-CA 123.253 0.621 . . . . 0.0 112.424 -173.462 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . 74.69 -56.45 0.63 Allowed 'General case' 0 N--CA 1.496 1.843 0 C-N-CA 125.715 1.606 . . . . 0.0 113.501 176.799 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -82.7 167.52 18.13 Favored 'General case' 0 N--CA 1.474 0.745 0 C-N-CA 124.118 0.967 . . . . 0.0 112.207 -175.304 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 47.5 t -83.69 120.64 75.55 Favored Pre-proline 0 CA--C 1.552 1.024 0 CA-C-N 115.017 -0.992 . . . . 0.0 109.125 172.892 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 74.2 Cg_exo -52.99 121.17 8.87 Favored 'Trans proline' 0 C--N 1.372 1.807 0 C-N-CA 123.333 2.689 . . . . 0.0 112.823 172.222 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 5.1 pm0 -69.81 115.06 8.6 Favored 'General case' 0 N--CA 1.471 0.615 0 N-CA-C 109.202 -0.666 . . . . 0.0 109.202 175.94 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . 0.443 ' HD3' ' H ' ' A' ' 27' ' ' ARG . 0.0 OUTLIER -62.8 123.0 17.32 Favored 'General case' 0 CA--C 1.537 0.462 0 CA-C-O 121.54 0.686 . . . . 0.0 109.941 174.444 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -79.05 -35.08 43.14 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 114.605 -1.18 . . . . 0.0 110.613 -174.14 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 29' ' ' TRP . . . . . 0.495 ' HB3' ' HB2' ' A' ' 33' ' ' GLN . 3.2 m-90 -115.0 145.89 41.8 Favored 'General case' 0 N--CA 1.472 0.666 0 CA-C-N 115.16 -0.927 . . . . 0.0 110.57 -172.618 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 49.2 p -93.07 174.58 7.16 Favored 'General case' 0 CA--C 1.544 0.729 0 C-N-CA 123.68 0.792 . . . . 0.0 108.865 168.438 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . 0.513 ' HA ' HD11 ' A' ' 34' ' ' LEU . 7.1 p -58.89 -35.66 57.53 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.277 0 C-N-CA 122.907 0.483 . . . . 0.0 112.19 -174.471 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 9.0 pt-20 -66.07 -42.16 89.77 Favored 'General case' 0 N--CA 1.48 1.051 0 C-N-CA 123.657 0.783 . . . . 0.0 111.262 176.695 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 33' ' ' GLN . . . . . 0.495 ' HB2' ' HB3' ' A' ' 29' ' ' TRP . 12.4 mm100 -63.9 -42.34 97.46 Favored 'General case' 0 N--CA 1.477 0.918 0 C-N-CA 123.021 0.528 . . . . 0.0 110.085 178.209 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . 0.513 HD11 ' HA ' ' A' ' 31' ' ' VAL . 70.2 mt -63.23 -49.57 73.65 Favored 'General case' 0 N--CA 1.472 0.649 0 O-C-N 124.485 1.116 . . . . 0.0 111.17 -176.943 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 11.5 ptp180 -73.07 -16.84 61.47 Favored 'General case' 0 N--CA 1.48 1.052 0 O-C-N 124.046 0.841 . . . . 0.0 111.636 -175.166 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 13.4 t -69.46 122.46 19.04 Favored 'General case' 0 CA--C 1.55 0.965 0 N-CA-C 109.514 -0.55 . . . . 0.0 109.514 -178.825 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . 0.4 ' HA ' ' HE2' ' A' ' 75' ' ' LYS . 60.1 mm-40 -63.65 -22.16 66.76 Favored 'General case' 0 N--CA 1.481 1.094 0 C-N-CA 123.903 0.881 . . . . 0.0 113.017 -174.833 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 29.3 pt20 -68.15 -21.69 64.9 Favored 'General case' 0 N--CA 1.482 1.125 0 C-N-CA 123.292 0.637 . . . . 0.0 111.636 179.541 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 2.4 tt -81.26 121.56 80.44 Favored Pre-proline 0 CA--C 1.553 1.091 0 N-CA-C 107.005 -1.48 . . . . 0.0 107.005 174.103 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_exo -56.78 126.1 21.17 Favored 'Trans proline' 0 C--N 1.381 2.254 0 C-N-CA 122.804 2.336 . . . . 0.0 111.972 173.399 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . 0.457 ' HB2' HD13 ' A' ' 78' ' ' LEU . 9.6 ptpp? -58.74 -34.24 71.16 Favored 'General case' 0 N--CA 1.48 1.029 0 C-N-CA 123.261 0.624 . . . . 0.0 111.194 179.925 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 21.3 ptmt -66.49 -33.17 75.08 Favored 'General case' 0 N--CA 1.472 0.669 0 C-N-CA 124.183 0.993 . . . . 0.0 111.849 179.538 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 32.5 t70 -68.1 -33.12 73.92 Favored 'General case' 0 N--CA 1.476 0.871 0 C-N-CA 123.599 0.76 . . . . 0.0 110.33 -178.007 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 53.8 mt -70.17 -46.86 70.65 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.079 0 CA-C-N 115.657 -0.701 . . . . 0.0 109.916 175.266 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 74.6 mt -57.86 -35.77 52.88 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.492 0 C-N-CA 123.199 0.599 . . . . 0.0 110.872 176.882 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 88.6 tttt -65.79 -41.85 91.44 Favored 'General case' 0 CA--C 1.546 0.79 0 C-N-CA 123.306 0.642 . . . . 0.0 110.983 178.756 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 27.2 t80 -57.21 -48.43 78.81 Favored 'General case' 0 N--CA 1.489 1.52 0 C-N-CA 123.278 0.631 . . . . 0.0 110.085 172.892 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . 0.443 ' HB3' ' HE2' ' A' ' 56' ' ' PHE . 96.4 mt -66.77 -35.4 80.0 Favored 'General case' 0 CA--C 1.539 0.553 0 CA-C-N 114.259 -1.337 . . . . 0.0 112.144 -174.111 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . 0.435 ' HA ' ' CD2' ' A' ' 57' ' ' LEU . 3.5 pt20 -82.75 -34.77 27.05 Favored 'General case' 0 N--CA 1.482 1.133 0 CA-C-N 117.903 0.32 . . . . 0.0 111.234 179.25 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 44.5 tt0 -67.47 -37.51 83.01 Favored 'General case' 0 N--CA 1.477 0.895 0 C-N-CA 123.108 0.563 . . . . 0.0 111.247 -177.642 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 97.1 m-70 -108.16 -40.43 5.2 Favored 'General case' 0 N--CA 1.48 1.032 0 CA-C-N 115.679 -0.691 . . . . 0.0 111.822 -171.75 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . 0.526 ' HA2' ' HA ' ' A' ' 91' ' ' PHE . . . -63.88 136.54 41.05 Favored Glycine 0 C--N 1.345 1.031 0 O-C-N 123.596 0.56 . . . . 0.0 113.016 175.178 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 53' ' ' SER . . . . . 0.416 ' O ' ' HG ' ' A' ' 57' ' ' LEU . 9.1 t -73.09 172.64 10.67 Favored 'General case' 0 N--CA 1.476 0.851 0 C-N-CA 123.553 0.741 . . . . 0.0 110.309 -177.988 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 4.3 m-20 -55.0 -39.46 69.07 Favored 'General case' 0 N--CA 1.488 1.467 0 C-N-CA 123.845 0.858 . . . . 0.0 111.356 -177.625 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 22.7 t -63.85 -30.72 71.78 Favored 'General case' 0 N--CA 1.479 1.002 0 CA-C-N 114.932 -1.031 . . . . 0.0 111.71 -179.269 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 56' ' ' PHE . . . . . 0.586 ' HB2' ' HB3' ' A' ' 90' ' ' ARG . 46.3 t80 -75.48 -41.9 54.33 Favored 'General case' 0 N--CA 1.473 0.677 0 C-N-CA 123.102 0.561 . . . . 0.0 110.947 176.449 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . 0.435 ' CD2' ' HA ' ' A' ' 49' ' ' GLN . 20.8 mt -74.24 -49.09 24.73 Favored 'General case' 0 N--CA 1.472 0.629 0 CA-C-N 115.094 -0.957 . . . . 0.0 112.077 -168.541 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -61.4 -48.15 82.56 Favored 'General case' 0 N--CA 1.478 0.95 0 C-N-CA 123.383 0.673 . . . . 0.0 111.319 -177.346 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 14.1 mm-40 -60.37 -30.15 69.39 Favored 'General case' 0 N--CA 1.484 1.26 0 C-N-CA 123.521 0.728 . . . . 0.0 112.768 -178.997 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 35.3 m80 -113.18 0.9 15.06 Favored 'General case' 0 N--CA 1.488 1.426 0 N-CA-C 112.331 0.493 . . . . 0.0 112.331 -175.802 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 75.4 mmtt 55.71 44.68 25.93 Favored 'General case' 0 N--CA 1.486 1.34 0 C-N-CA 124.591 1.156 . . . . 0.0 111.729 178.761 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 85.2 mt -95.33 -11.23 28.15 Favored 'General case' 0 N--CA 1.481 1.094 0 C-N-CA 123.994 0.918 . . . . 0.0 111.455 179.605 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -79.96 171.97 14.39 Favored 'General case' 0 N--CA 1.482 1.14 0 C-N-CA 123.176 0.59 . . . . 0.0 111.42 176.657 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 85.62 -153.42 27.29 Favored Glycine 0 C--N 1.34 0.796 0 CA-C-N 114.751 -1.113 . . . . 0.0 112.53 178.418 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 12.5 m120 -69.79 118.52 12.75 Favored 'General case' 0 N--CA 1.469 0.483 0 N-CA-C 108.948 -0.76 . . . . 0.0 108.948 175.364 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 59.0 mt -55.43 -39.19 51.92 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.066 0 C-N-CA 123.94 0.896 . . . . 0.0 110.813 -177.883 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 58.2 pttt -53.74 -42.88 68.62 Favored 'General case' 0 N--CA 1.485 1.311 0 C-N-CA 124.145 0.978 . . . . 0.0 112.48 178.175 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 3.8 m-20 -59.64 -41.62 90.91 Favored 'General case' 0 N--CA 1.489 1.477 0 C-N-CA 123.997 0.919 . . . . 0.0 110.404 179.257 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 21.5 t -71.22 -44.86 73.13 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.073 0 CA-C-N 113.893 -1.503 . . . . 0.0 109.996 179.307 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -82.1 7.12 14.27 Favored 'General case' 0 N--CA 1.485 1.317 0 C-N-CA 124.726 1.211 . . . . 0.0 113.441 -168.242 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 21.1 ptmt -95.26 -18.69 20.64 Favored 'General case' 0 N--CA 1.482 1.137 0 O-C-N 121.907 -0.496 . . . . 0.0 111.079 172.109 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 13.0 t -133.05 -14.09 2.71 Favored 'General case' 0 CA--C 1.553 1.077 0 C-N-CA 123.257 0.623 . . . . 0.0 112.53 -173.668 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -84.17 99.85 10.78 Favored 'General case' 0 C--O 1.244 0.796 0 N-CA-C 108.692 -0.855 . . . . 0.0 108.692 176.827 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 32.4 p30 -68.65 163.45 23.76 Favored 'General case' 0 CA--C 1.539 0.53 0 CA-C-N 115.826 -0.624 . . . . 0.0 110.132 178.819 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . 0.713 ' HB2' ' HZ3' ' A' ' 75' ' ' LYS . 3.5 ttmp? -67.61 -26.75 66.41 Favored 'General case' 0 CA--C 1.548 0.883 0 C-N-CA 123.053 0.541 . . . . 0.0 110.985 -173.686 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 20.8 t70 -61.9 -41.37 97.82 Favored 'General case' 0 CA--C 1.552 1.037 0 C-N-CA 124.463 1.105 . . . . 0.0 110.966 173.741 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 17.4 t60 -62.84 -36.76 84.28 Favored 'General case' 0 N--CA 1.484 1.249 0 C-N-CA 125.292 1.437 . . . . 0.0 109.653 -179.075 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . 0.457 HD13 ' HB2' ' A' ' 41' ' ' LYS . 48.3 mt -75.06 -36.64 61.8 Favored 'General case' 0 N--CA 1.47 0.537 0 CA-C-N 114.584 -1.189 . . . . 0.0 111.922 -172.863 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 61.9 t -67.39 -41.97 86.86 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.899 0 O-C-N 123.82 0.7 . . . . 0.0 109.699 173.182 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 22.9 m -60.22 -43.56 95.92 Favored 'General case' 0 N--CA 1.482 1.132 0 C-N-CA 123.237 0.615 . . . . 0.0 110.936 177.171 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -69.73 -43.94 71.32 Favored 'General case' 0 N--CA 1.473 0.705 0 C-N-CA 123.523 0.729 . . . . 0.0 111.019 179.077 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 82' ' ' TYR . . . . . . . . . . . . . 18.0 t80 -53.62 -55.93 21.54 Favored 'General case' 0 N--CA 1.479 1.017 0 C-N-CA 124.202 1.001 . . . . 0.0 110.598 178.765 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 83' ' ' ASN . . . . . . . . . . . . . 34.2 m-80 -66.28 -41.54 89.71 Favored 'General case' 0 N--CA 1.476 0.849 0 C-N-CA 122.627 0.371 . . . . 0.0 110.822 -175.948 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 84' ' ' HIS . . . . . 0.48 ' HA ' ' HB3' ' A' ' 87' ' ' GLU . 46.1 m170 -64.5 -26.72 68.55 Favored 'General case' 0 N--CA 1.479 0.993 0 C-N-CA 123.169 0.588 . . . . 0.0 111.837 178.779 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 85' ' ' LEU . . . . . 0.402 ' HG ' ' HD2' ' A' ' 91' ' ' PHE . 56.4 tp -58.33 -54.45 46.84 Favored 'General case' 0 N--CA 1.48 1.056 0 CA-C-O 121.711 0.767 . . . . 0.0 110.179 177.796 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 86' ' ' PHE . . . . . 0.437 ' CZ ' ' HB3' ' A' ' 27' ' ' ARG . 27.1 m-85 -75.63 -26.5 57.83 Favored 'General case' 0 CA--C 1.546 0.821 0 CA-C-N 114.273 -1.33 . . . . 0.0 111.308 179.876 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . 0.48 ' HB3' ' HA ' ' A' ' 84' ' ' HIS . 14.9 tp10 -69.55 -25.67 64.12 Favored 'General case' 0 N--CA 1.484 1.262 0 C-N-CA 124.204 1.002 . . . . 0.0 111.745 -176.523 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 39.0 p -123.89 0.86 8.65 Favored 'General case' 0 N--CA 1.474 0.75 0 C-N-CA 123.385 0.674 . . . . 0.0 110.837 179.215 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 34.5 mmtp 54.57 40.05 31.58 Favored 'General case' 0 N--CA 1.483 1.213 0 C-N-CA 124.083 0.953 . . . . 0.0 110.606 -177.109 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 90' ' ' ARG . . . . . 0.586 ' HB3' ' HB2' ' A' ' 56' ' ' PHE . 28.5 mtt180 -73.08 -7.69 52.42 Favored 'General case' 0 N--CA 1.487 1.381 0 C-N-CA 125.323 1.449 . . . . 0.0 113.352 -174.544 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 91' ' ' PHE . . . . . 0.526 ' HA ' ' HA2' ' A' ' 52' ' ' GLY . 3.2 p90 -68.75 164.72 21.13 Favored 'General case' 0 N--CA 1.476 0.86 0 C-N-CA 123.398 0.679 . . . . 0.0 111.347 168.377 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 24.2 ttpp . . . . . 0 CA--C 1.556 1.19 0 O-C-N 124.567 1.167 . . . . 0.0 110.451 171.896 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 20' ' ' MET . . . . . . . . . . . . . 3.1 ppp? . . . . . 0 N--CA 1.478 0.943 0 CA-C-O 120.471 0.177 . . . . 0.0 110.534 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -173.37 101.25 0.12 Allowed 'General case' 0 N--CA 1.473 0.708 0 C-N-CA 125.168 1.387 . . . . 0.0 107.945 178.219 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -67.52 95.15 0.45 Allowed 'General case' 0 N--CA 1.473 0.704 0 N-CA-C 109.426 -0.583 . . . . 0.0 109.426 178.006 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -83.15 57.78 4.12 Favored 'General case' 0 N--CA 1.474 0.733 0 C-N-CA 123.995 0.918 . . . . 0.0 110.294 -175.816 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 35.4 m -77.38 127.05 83.97 Favored Pre-proline 0 CA--C 1.549 0.912 0 CA-C-N 115.061 -0.972 . . . . 0.0 109.058 -178.372 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 22.8 Cg_exo -61.28 98.53 0.15 Allowed 'Trans proline' 0 C--N 1.381 2.275 0 C-N-CA 122.881 2.387 . . . . 0.0 112.681 -172.809 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 28.1 pt20 -82.69 -168.28 1.96 Allowed 'General case' 0 N--CA 1.474 0.729 0 CA-C-N 114.715 -1.13 . . . . 0.0 110.199 179.899 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 40.4 ttp180 -58.88 118.21 5.5 Favored 'General case' 0 CA--C 1.549 0.935 0 CA-C-O 121.351 0.596 . . . . 0.0 110.779 174.481 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -94.99 -19.6 20.07 Favored 'General case' 0 CA--C 1.549 0.925 0 CA-C-N 114.664 -1.153 . . . . 0.0 111.604 178.621 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 29' ' ' TRP . . . . . . . . . . . . . 2.9 m-90 -135.98 135.0 39.18 Favored 'General case' 0 N--CA 1.483 1.182 0 C-N-CA 124.187 0.995 . . . . 0.0 108.949 -172.705 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 82.1 p -75.63 170.34 16.36 Favored 'General case' 0 CA--C 1.545 0.783 0 N-CA-C 109.804 -0.443 . . . . 0.0 109.804 178.161 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . 0.43 HG23 HD22 ' A' ' 83' ' ' ASN . 91.2 t -59.17 -37.52 68.96 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.273 0 C-N-CA 122.391 0.276 . . . . 0.0 111.186 -177.042 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 10.7 pt-20 -69.09 -34.24 74.79 Favored 'General case' 0 N--CA 1.48 1.072 0 C-N-CA 123.49 0.716 . . . . 0.0 110.918 178.15 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 79.4 mt-30 -70.16 -33.81 72.23 Favored 'General case' 0 N--CA 1.477 0.892 0 C-N-CA 123.005 0.522 . . . . 0.0 110.397 176.233 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . 0.434 HD11 ' CD2' ' A' ' 82' ' ' TYR . 76.2 mt -64.36 -53.7 44.57 Favored 'General case' 0 N--CA 1.477 0.901 0 N-CA-C 109.305 -0.628 . . . . 0.0 109.305 175.651 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 75.9 mtp180 -71.01 -12.02 61.3 Favored 'General case' 0 N--CA 1.477 0.889 0 CA-C-N 114.468 -1.242 . . . . 0.0 111.466 -177.469 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 44.0 t -57.83 143.2 43.2 Favored 'General case' 0 C--N 1.354 0.777 0 C-N-CA 123.482 0.713 . . . . 0.0 111.468 175.496 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 35.7 mt-10 -80.02 -8.31 59.3 Favored 'General case' 0 CA--C 1.55 0.97 0 CA-C-N 114.765 -1.107 . . . . 0.0 111.205 -178.707 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 28.1 mm-40 -86.36 -38.06 17.82 Favored 'General case' 0 N--CA 1.474 0.746 0 C-N-CA 124.038 0.935 . . . . 0.0 110.676 179.509 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 1.3 tt -82.61 112.93 41.07 Favored Pre-proline 0 N--CA 1.476 0.84 0 N-CA-C 108.328 -0.99 . . . . 0.0 108.328 179.096 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 40' ' ' PRO . . . . . 0.508 ' HB2' ' HG2' ' A' ' 42' ' ' LYS . 79.0 Cg_endo -73.81 148.7 41.52 Favored 'Trans proline' 0 C--N 1.372 1.809 0 C-N-CA 121.933 1.755 . . . . 0.0 111.406 -179.638 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 18.8 ptpt -64.52 -28.27 69.54 Favored 'General case' 0 N--CA 1.472 0.669 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.871 -178.429 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . 0.508 ' HG2' ' HB2' ' A' ' 40' ' ' PRO . 19.8 ptpt -65.08 -33.89 77.11 Favored 'General case' 0 N--CA 1.472 0.653 0 C-N-CA 123.453 0.701 . . . . 0.0 111.387 179.571 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 25.1 t70 -75.37 -31.53 60.52 Favored 'General case' 0 N--CA 1.476 0.845 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.642 -177.515 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 49.4 mt -69.06 -50.18 55.69 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.779 0 N-CA-C 109.657 -0.497 . . . . 0.0 109.657 176.068 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 72.9 mt -57.62 -41.89 80.17 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.335 0 C-N-CA 123.497 0.719 . . . . 0.0 110.468 176.521 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 23.1 tptm -53.46 -46.92 70.09 Favored 'General case' 0 N--CA 1.485 1.307 0 C-N-CA 124.555 1.142 . . . . 0.0 110.85 176.53 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 11.9 t80 -66.49 -47.58 72.56 Favored 'General case' 0 N--CA 1.473 0.686 0 CA-C-N 114.916 -1.038 . . . . 0.0 110.897 -179.478 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 93.2 mt -68.12 -33.44 74.5 Favored 'General case' 0 CA--C 1.541 0.627 0 C-N-CA 122.922 0.489 . . . . 0.0 111.842 -173.225 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 3.6 pt20 -83.5 -25.5 31.04 Favored 'General case' 0 N--CA 1.484 1.271 0 C-N-CA 122.464 0.306 . . . . 0.0 111.592 177.623 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 4.2 tm-20 -54.21 -42.5 69.83 Favored 'General case' 0 N--CA 1.49 1.526 0 C-N-CA 124.327 1.051 . . . . 0.0 111.846 -178.919 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 4.0 p80 -138.74 -20.73 1.01 Allowed 'General case' 0 N--CA 1.481 1.123 0 CA-C-N 116.28 -0.418 . . . . 0.0 112.09 -172.755 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -60.26 135.2 50.18 Favored Glycine 0 C--N 1.352 1.43 0 CA-C-O 119.714 -0.492 . . . . 0.0 112.006 172.032 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 53' ' ' SER . . . . . 0.407 ' O ' ' HG ' ' A' ' 57' ' ' LEU . 32.4 t -62.98 148.09 48.66 Favored 'General case' 0 N--CA 1.471 0.622 0 C-N-CA 123.349 0.66 . . . . 0.0 111.868 -175.495 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 25.5 t70 -59.12 -36.95 76.08 Favored 'General case' 0 N--CA 1.481 1.125 0 C-N-CA 124.005 0.922 . . . . 0.0 112.197 -176.038 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 38.4 m -64.0 -37.53 87.74 Favored 'General case' 0 CA--C 1.549 0.931 0 C-N-CA 123.516 0.726 . . . . 0.0 111.367 177.591 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 52.4 t80 -66.5 -47.26 73.53 Favored 'General case' 0 N--CA 1.481 1.085 0 C-N-CA 123.498 0.719 . . . . 0.0 109.593 173.253 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . 0.407 ' HG ' ' O ' ' A' ' 53' ' ' SER . 76.3 mt -60.16 -33.47 72.22 Favored 'General case' 0 N--CA 1.476 0.874 0 CA-C-N 115.203 -0.908 . . . . 0.0 111.377 -175.427 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -65.03 -48.4 73.98 Favored 'General case' 0 N--CA 1.476 0.839 0 C-N-CA 123.626 0.771 . . . . 0.0 111.538 178.646 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 40.2 mt-10 -62.34 -26.47 68.46 Favored 'General case' 0 N--CA 1.482 1.128 0 CA-C-N 115.222 -0.899 . . . . 0.0 112.039 -178.262 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 72.8 m80 -114.37 1.76 14.51 Favored 'General case' 0 N--CA 1.483 1.197 0 C-N-CA 123.3 0.64 . . . . 0.0 112.241 -176.754 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 49.1 mtmt 62.37 22.82 13.48 Favored 'General case' 0 N--CA 1.497 1.881 0 C-N-CA 125.268 1.427 . . . . 0.0 112.6 178.073 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 89.6 mt -80.1 -10.97 59.8 Favored 'General case' 0 N--CA 1.478 0.926 0 C-N-CA 124.186 0.994 . . . . 0.0 112.312 -177.033 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 1.4 pp -74.4 162.48 28.81 Favored 'General case' 0 N--CA 1.48 1.035 0 CA-C-O 121.322 0.582 . . . . 0.0 111.207 175.298 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 89.23 -159.96 29.09 Favored Glycine 0 C--O 1.242 0.649 0 CA-C-N 115.02 -0.991 . . . . 0.0 112.267 178.683 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 65' ' ' ASN . . . . . 0.456 ' OD1' ' HG2' ' A' ' 67' ' ' LYS . 14.0 t-20 -75.63 139.34 41.96 Favored 'General case' 0 N--CA 1.469 0.481 0 N-CA-C 109.441 -0.578 . . . . 0.0 109.441 -179.447 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 59.7 mt -61.0 -46.41 96.71 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.797 0 O-C-N 123.69 0.619 . . . . 0.0 112.568 -171.261 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 67' ' ' LYS . . . . . 0.456 ' HG2' ' OD1' ' A' ' 65' ' ' ASN . 8.9 ptpp? -60.48 -36.29 77.95 Favored 'General case' 0 N--CA 1.491 1.617 0 CA-C-N 118.334 0.515 . . . . 0.0 110.83 -178.344 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 7.0 t30 -61.42 -40.5 94.63 Favored 'General case' 0 N--CA 1.48 1.028 0 C-N-CA 124.543 1.137 . . . . 0.0 110.975 176.692 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 32.8 t -73.13 -40.22 57.9 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.808 0 CA-C-N 115.223 -0.899 . . . . 0.0 110.441 175.984 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -72.82 -5.89 41.21 Favored 'General case' 0 N--CA 1.484 1.229 0 C-N-CA 124.614 1.166 . . . . 0.0 113.221 -170.332 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . 0.604 ' HB2' ' HZ3' ' A' ' 71' ' ' LYS . 0.0 OUTLIER -90.34 -18.94 24.65 Favored 'General case' 0 CA--C 1.548 0.867 0 C-N-CA 122.209 0.203 . . . . 0.0 110.765 176.278 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 10.1 t -120.08 -15.16 8.78 Favored 'General case' 0 N--CA 1.477 0.876 0 C-N-CA 123.927 0.891 . . . . 0.0 111.354 -178.022 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -90.32 97.37 11.14 Favored 'General case' 0 N--CA 1.475 0.777 0 C-N-CA 123.243 0.617 . . . . 0.0 110.317 179.407 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 74' ' ' ASN . . . . . 0.4 ' ND2' ' HB3' ' A' ' 76' ' ' ASP . 54.4 t30 -66.3 156.7 33.64 Favored 'General case' 0 N--CA 1.477 0.876 0 CA-C-N 115.431 -0.804 . . . . 0.0 109.125 173.077 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . 0.431 ' O ' HG21 ' A' ' 79' ' ' VAL . 2.9 tppp? -64.32 -38.76 92.18 Favored 'General case' 0 CA--C 1.548 0.892 0 N-CA-C 110.186 -0.302 . . . . 0.0 110.186 179.734 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 76' ' ' ASP . . . . . 0.4 ' HB3' ' ND2' ' A' ' 74' ' ' ASN . 31.0 t70 -64.53 -34.82 79.12 Favored 'General case' 0 N--CA 1.484 1.253 0 C-N-CA 124.156 0.982 . . . . 0.0 111.28 175.783 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 17.3 t60 -66.45 -38.63 87.77 Favored 'General case' 0 N--CA 1.487 1.386 0 C-N-CA 123.967 0.907 . . . . 0.0 109.376 174.232 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 71.8 mt -74.42 -26.62 60.18 Favored 'General case' 0 N--CA 1.475 0.793 0 C-N-CA 123.401 0.68 . . . . 0.0 112.326 -178.536 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 79' ' ' VAL . . . . . 0.431 HG21 ' O ' ' A' ' 75' ' ' LYS . 88.1 t -68.79 -44.02 82.34 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.018 0 N-CA-C 109.271 -0.64 . . . . 0.0 109.271 172.79 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 59.9 m -58.11 -51.77 68.33 Favored 'General case' 0 CA--C 1.546 0.79 0 CA-C-N 115.041 -0.981 . . . . 0.0 110.783 175.847 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -65.49 -45.88 81.87 Favored 'General case' 0 N--CA 1.475 0.786 0 C-N-CA 123.483 0.713 . . . . 0.0 111.779 -176.864 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 82' ' ' TYR . . . . . 0.434 ' CD2' HD11 ' A' ' 34' ' ' LEU . 79.8 t80 -58.82 -57.34 13.45 Favored 'General case' 0 N--CA 1.474 0.75 0 C-N-CA 124.289 1.036 . . . . 0.0 110.307 -177.712 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 83' ' ' ASN . . . . . 0.43 HD22 HG23 ' A' ' 31' ' ' VAL . 18.2 m-80 -60.56 -42.1 95.91 Favored 'General case' 0 CA--C 1.549 0.913 0 CA-C-N 115.677 -0.692 . . . . 0.0 111.65 -176.037 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 63.5 m-70 -68.22 -25.24 65.11 Favored 'General case' 0 N--CA 1.481 1.097 0 CA-C-O 118.733 -0.651 . . . . 0.0 112.66 178.78 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 57.1 tp -62.08 -53.5 54.55 Favored 'General case' 0 N--CA 1.49 1.553 0 CA-C-N 118.76 0.709 . . . . 0.0 110.876 178.643 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 24.4 m-85 -75.33 -20.64 58.93 Favored 'General case' 0 N--CA 1.477 0.898 0 CA-C-N 114.613 -1.176 . . . . 0.0 110.868 -177.54 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 34.4 tt0 -69.36 -26.6 64.75 Favored 'General case' 0 N--CA 1.479 1.004 0 C-N-CA 123.316 0.647 . . . . 0.0 111.062 175.988 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 26.3 p -112.26 -21.93 11.18 Favored 'General case' 0 N--CA 1.477 0.92 0 C-N-CA 123.897 0.879 . . . . 0.0 110.914 179.385 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 97.3 mttt 55.1 46.87 23.16 Favored 'General case' 0 N--CA 1.481 1.09 0 C-N-CA 124.985 1.314 . . . . 0.0 112.292 -176.131 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 99.2 mtt180 -71.5 -16.05 62.33 Favored 'General case' 0 N--CA 1.493 1.697 0 C-N-CA 124.144 0.978 . . . . 0.0 112.095 177.973 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 91' ' ' PHE . . . . . . . . . . . . . 54.3 p90 -72.57 161.14 31.17 Favored 'General case' 0 CA--C 1.543 0.681 0 C-N-CA 123.631 0.773 . . . . 0.0 111.904 178.435 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 49.2 pttt . . . . . 0 C--O 1.254 1.294 0 N-CA-C 108.313 -0.995 . . . . 0.0 108.313 165.959 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 20' ' ' MET . . . . . . . . . . . . . 96.4 mmm . . . . . 0 N--CA 1.481 1.077 0 N-CA-C 110.093 -0.336 . . . . 0.0 110.093 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -143.03 135.88 27.84 Favored 'General case' 0 N--CA 1.472 0.667 0 C-N-CA 124.032 0.933 . . . . 0.0 108.823 179.886 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -82.27 85.09 6.9 Favored 'General case' 0 N--CA 1.47 0.532 0 C-N-CA 123.351 0.661 . . . . 0.0 110.227 -177.619 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -83.23 163.68 20.6 Favored 'General case' 0 N--CA 1.472 0.636 0 CA-C-N 115.877 -0.601 . . . . 0.0 110.861 178.776 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 24.3 m -114.52 136.15 22.36 Favored Pre-proline 0 CA--C 1.548 0.887 0 C-N-CA 124.144 0.978 . . . . 0.0 109.734 178.855 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 87.4 Cg_exo -50.3 118.71 4.22 Favored 'Trans proline' 0 C--N 1.382 2.301 0 C-N-CA 123.91 3.074 . . . . 0.0 114.462 179.776 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 45.6 mt-30 -76.83 171.02 15.41 Favored 'General case' 0 C--O 1.245 0.847 0 CA-C-N 115.785 -0.643 . . . . 0.0 109.364 165.973 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -63.66 134.19 54.97 Favored 'General case' 0 CA--C 1.544 0.736 0 CA-C-O 120.837 0.351 . . . . 0.0 110.209 175.384 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -77.56 -41.76 37.77 Favored 'General case' 0 N--CA 1.47 0.574 0 N-CA-C 109.101 -0.703 . . . . 0.0 109.101 178.192 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 29' ' ' TRP . . . . . . . . . . . . . 10.7 m-90 -138.32 159.68 41.44 Favored 'General case' 0 N--CA 1.477 0.9 0 C-N-CA 124.717 1.207 . . . . 0.0 108.236 175.462 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 67.9 p -85.42 168.55 14.5 Favored 'General case' 0 N--CA 1.483 1.218 0 N-CA-C 108.662 -0.866 . . . . 0.0 108.662 176.525 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 7.2 p -61.0 -39.34 81.86 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.197 0 CA-C-N 118.052 0.387 . . . . 0.0 111.425 -174.859 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -64.26 -35.74 81.83 Favored 'General case' 0 N--CA 1.479 1.015 0 C-N-CA 123.836 0.855 . . . . 0.0 111.42 177.775 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 51.0 mt-30 -69.66 -42.37 74.31 Favored 'General case' 0 C--N 1.353 0.746 0 C-N-CA 123.28 0.632 . . . . 0.0 110.757 175.045 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . 0.424 ' HA ' HD11 ' A' ' 39' ' ' LEU . 89.2 mt -63.51 -53.61 49.23 Favored 'General case' 0 N--CA 1.478 0.974 0 C-N-CA 123.237 0.615 . . . . 0.0 111.094 -175.697 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 8.0 ptm180 -65.01 -22.45 67.0 Favored 'General case' 0 N--CA 1.473 0.719 0 O-C-N 124.176 0.923 . . . . 0.0 112.003 -172.718 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 23.3 t -60.2 132.3 53.49 Favored 'General case' 0 CA--C 1.545 0.756 0 C-N-CA 123.552 0.741 . . . . 0.0 110.457 177.917 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 3.1 mp0 -66.72 -21.15 66.08 Favored 'General case' 0 CA--C 1.546 0.819 0 C-N-CA 123.658 0.783 . . . . 0.0 111.718 -173.395 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 13.8 pt20 -69.47 -29.18 66.79 Favored 'General case' 0 N--CA 1.479 1.011 0 C-N-CA 122.823 0.449 . . . . 0.0 111.211 177.456 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . 0.424 HD11 ' HA ' ' A' ' 34' ' ' LEU . 4.0 tt -86.33 113.09 50.54 Favored Pre-proline 0 N--CA 1.475 0.775 0 N-CA-C 107.967 -1.123 . . . . 0.0 107.967 177.728 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 40' ' ' PRO . . . . . 0.448 ' HB2' ' HG2' ' A' ' 42' ' ' LYS . 98.6 Cg_endo -73.03 149.26 46.41 Favored 'Trans proline' 0 C--N 1.375 1.963 0 C-N-CA 122.509 2.14 . . . . 0.0 112.015 -178.92 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 46.2 mtmt -68.27 -21.12 64.82 Favored 'General case' 0 N--CA 1.472 0.65 0 CA-C-N 114.868 -1.06 . . . . 0.0 112.043 -175.572 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . 0.448 ' HG2' ' HB2' ' A' ' 40' ' ' PRO . 17.3 ptpt -65.08 -34.16 77.76 Favored 'General case' 0 CA--C 1.544 0.747 0 C-N-CA 123.97 0.908 . . . . 0.0 111.149 178.462 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -69.79 -38.79 76.8 Favored 'General case' 0 C--O 1.241 0.616 0 C-N-CA 123.617 0.767 . . . . 0.0 111.161 179.015 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 43.1 mt -68.74 -50.88 51.05 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.596 0 CA-C-N 115.49 -0.777 . . . . 0.0 110.164 -178.457 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 75.7 mt -59.81 -36.09 64.17 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.163 0 C-N-CA 123.277 0.631 . . . . 0.0 110.872 177.471 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 13.4 ttmm -59.48 -48.45 81.62 Favored 'General case' 0 N--CA 1.479 0.996 0 C-N-CA 122.788 0.435 . . . . 0.0 111.023 174.384 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 20.9 t80 -54.88 -45.96 74.71 Favored 'General case' 0 N--CA 1.484 1.254 0 CA-C-O 121.259 0.552 . . . . 0.0 110.73 176.115 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . 0.425 ' HB3' ' HE2' ' A' ' 56' ' ' PHE . 90.8 mt -70.58 -37.93 74.01 Favored 'General case' 0 CA--C 1.544 0.73 0 CA-C-N 115.045 -0.98 . . . . 0.0 112.163 -175.152 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 3.3 pt20 -85.6 -36.43 20.39 Favored 'General case' 0 N--CA 1.489 1.503 0 N-CA-C 113.121 0.786 . . . . 0.0 113.121 -175.935 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 32.5 tt0 -69.1 -37.42 78.41 Favored 'General case' 0 N--CA 1.479 0.991 0 C-N-CA 123.802 0.841 . . . . 0.0 111.599 -170.303 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -141.04 14.0 2.25 Favored 'General case' 0 N--CA 1.48 1.064 0 N-CA-C 113.107 0.78 . . . . 0.0 113.107 -178.93 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -103.9 150.38 17.45 Favored Glycine 0 N--CA 1.478 1.472 0 N-CA-C 110.639 -0.984 . . . . 0.0 110.639 162.564 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 53' ' ' SER . . . . . 0.479 ' O ' ' HG ' ' A' ' 57' ' ' LEU . 80.1 p -68.09 159.25 31.28 Favored 'General case' 0 N--CA 1.485 1.308 0 N-CA-C 113.353 0.871 . . . . 0.0 113.353 -170.137 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 22.1 t70 -66.21 -38.85 88.96 Favored 'General case' 0 N--CA 1.48 1.062 0 C-N-CA 124.514 1.126 . . . . 0.0 111.409 -177.331 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 13.3 t -67.49 -31.06 70.93 Favored 'General case' 0 N--CA 1.478 0.965 0 C-N-CA 123.544 0.738 . . . . 0.0 110.992 -179.364 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 56' ' ' PHE . . . . . 0.435 ' HD1' HH11 ' A' ' 90' ' ' ARG . 27.2 t80 -65.56 -48.81 71.14 Favored 'General case' 0 CA--C 1.548 0.874 0 CA-C-N 115.435 -0.802 . . . . 0.0 110.246 170.753 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . 0.479 ' HG ' ' O ' ' A' ' 53' ' ' SER . 72.1 mt -60.97 -45.4 94.9 Favored 'General case' 0 N--CA 1.481 1.122 0 C-N-CA 122.884 0.473 . . . . 0.0 111.347 -177.674 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -52.74 -26.24 13.53 Favored 'General case' 0 CA--C 1.545 0.752 0 C-N-CA 125.918 1.687 . . . . 0.0 113.734 -175.033 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 57.0 mt-10 -57.08 -49.09 76.93 Favored 'General case' 0 N--CA 1.481 1.118 0 C-N-CA 123.812 0.845 . . . . 0.0 111.789 179.81 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 58.7 t-80 -109.93 -5.2 15.55 Favored 'General case' 0 N--CA 1.485 1.276 0 C-N-CA 123.379 0.672 . . . . 0.0 111.013 177.563 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 24.9 mtpp 64.84 59.43 0.9 Allowed 'General case' 0 CA--C 1.545 0.763 0 C-N-CA 124.578 1.151 . . . . 0.0 109.908 -170.692 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . 0.489 ' HA ' HG11 ' A' ' 69' ' ' VAL . 84.6 mt -83.49 -0.34 49.78 Favored 'General case' 0 N--CA 1.489 1.518 0 C-N-CA 124.11 0.964 . . . . 0.0 110.848 175.771 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -82.47 158.83 23.07 Favored 'General case' 0 C--O 1.242 0.672 0 C-N-CA 124.631 1.172 . . . . 0.0 110.751 176.093 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 85.67 -146.92 21.76 Favored Glycine 0 C--N 1.337 0.6 0 CA-C-N 115.038 -0.983 . . . . 0.0 113.466 175.91 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 78.1 m-20 -65.36 111.21 2.93 Favored 'General case' 0 N--CA 1.473 0.698 0 C-N-CA 124.182 0.993 . . . . 0.0 109.83 -175.691 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 55.1 mt -56.1 -51.45 61.95 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.107 0 O-C-N 124.31 1.006 . . . . 0.0 112.678 -169.015 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 67' ' ' LYS . . . . . 0.472 ' H ' ' HD2' ' A' ' 67' ' ' LYS . 0.0 OUTLIER -71.69 -32.07 67.44 Favored 'General case' 0 N--CA 1.485 1.293 0 C-N-CA 123.183 0.593 . . . . 0.0 110.28 -174.634 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 49.0 t30 -62.82 -35.67 80.66 Favored 'General case' 0 N--CA 1.482 1.127 0 CA-C-N 115.277 -0.874 . . . . 0.0 110.846 175.326 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 69' ' ' VAL . . . . . 0.489 HG11 ' HA ' ' A' ' 62' ' ' LEU . 64.6 t -73.85 -41.28 53.76 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.859 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.145 172.058 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 70' ' ' ALA . . . . . 0.481 ' HA ' ' HB2' ' A' ' 73' ' ' ALA . . . -69.94 -1.94 11.04 Favored 'General case' 0 N--CA 1.487 1.393 0 C-N-CA 124.377 1.071 . . . . 0.0 113.417 -174.172 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 64.0 pttt -75.91 -33.71 59.91 Favored 'General case' 0 N--CA 1.478 0.966 0 CA-C-N 118.06 0.391 . . . . 0.0 110.131 174.081 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 10.0 t -115.16 -13.92 11.77 Favored 'General case' 0 N--CA 1.472 0.641 0 C-N-CA 123.988 0.915 . . . . 0.0 110.626 -176.906 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . 0.481 ' HB2' ' HA ' ' A' ' 70' ' ' ALA . . . -78.25 94.19 4.75 Favored 'General case' 0 C--N 1.343 0.317 0 N-CA-C 108.976 -0.75 . . . . 0.0 108.976 174.16 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 27.8 p-10 -74.25 155.54 38.17 Favored 'General case' 0 C--O 1.244 0.79 0 N-CA-C 109.372 -0.603 . . . . 0.0 109.372 176.33 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 4.6 tppp? -56.54 -39.05 72.76 Favored 'General case' 0 CA--C 1.549 0.916 0 C-N-CA 123.82 0.848 . . . . 0.0 111.846 -174.476 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 25.9 t70 -59.42 -49.5 77.54 Favored 'General case' 0 N--CA 1.476 0.869 0 C-N-CA 124.055 0.942 . . . . 0.0 112.333 -177.215 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 8.7 t60 -70.76 -28.12 64.45 Favored 'General case' 0 N--CA 1.476 0.869 0 C-N-CA 123.327 0.651 . . . . 0.0 110.696 -176.717 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . 0.452 HD21 ' HB1' ' A' ' 73' ' ' ALA . 82.4 mt -68.72 -33.61 74.23 Favored 'General case' 0 N--CA 1.478 0.925 0 C-N-CA 122.824 0.449 . . . . 0.0 111.972 176.266 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 57.1 t -66.03 -45.48 90.63 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.702 0 O-C-N 124.031 0.832 . . . . 0.0 109.653 171.227 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 33.8 m -58.63 -40.1 82.41 Favored 'General case' 0 N--CA 1.479 1.004 0 C-N-CA 123.855 0.862 . . . . 0.0 111.209 177.571 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -69.55 -46.66 65.93 Favored 'General case' 0 N--CA 1.469 0.514 0 C-N-CA 123.858 0.863 . . . . 0.0 110.527 178.142 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 82' ' ' TYR . . . . . . . . . . . . . 10.6 t80 -52.05 -54.8 25.75 Favored 'General case' 0 N--CA 1.475 0.816 0 C-N-CA 124.857 1.263 . . . . 0.0 110.997 179.349 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 83' ' ' ASN . . . . . . . . . . . . . 62.3 m-80 -65.0 -38.16 90.05 Favored 'General case' 0 N--CA 1.478 0.953 0 C-N-CA 122.825 0.45 . . . . 0.0 111.511 -177.609 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 32.1 m170 -66.64 -26.14 66.92 Favored 'General case' 0 N--CA 1.484 1.269 0 C-N-CA 123.729 0.811 . . . . 0.0 112.054 177.993 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 37.9 tp -58.52 -52.67 64.66 Favored 'General case' 0 N--CA 1.478 0.959 0 CA-C-O 121.386 0.613 . . . . 0.0 110.538 176.948 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 28.6 m-85 -75.44 -32.56 60.72 Favored 'General case' 0 N--CA 1.47 0.562 0 CA-C-N 114.261 -1.336 . . . . 0.0 111.771 -179.11 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 35.9 tt0 -55.99 -45.58 78.95 Favored 'General case' 0 N--CA 1.484 1.229 0 C-N-CA 123.941 0.896 . . . . 0.0 112.306 -172.664 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 16.5 p -112.77 3.41 16.46 Favored 'General case' 0 N--CA 1.477 0.908 0 C-N-CA 123.91 0.884 . . . . 0.0 111.393 178.194 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 47.9 mtpt 52.75 64.66 1.77 Allowed 'General case' 0 N--CA 1.479 0.977 0 C-N-CA 124.664 1.186 . . . . 0.0 110.612 179.182 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 90' ' ' ARG . . . . . 0.435 HH11 ' HD1' ' A' ' 56' ' ' PHE . 99.3 mtt180 -78.5 -33.19 48.27 Favored 'General case' 0 N--CA 1.473 0.701 0 CA-C-N 114.561 -1.199 . . . . 0.0 112.099 -172.374 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 91' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -51.41 160.73 0.54 Allowed 'General case' 0 N--CA 1.483 1.188 0 C-N-CA 124.116 0.966 . . . . 0.0 113.436 178.353 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 92' ' ' LYS . . . . . 0.6 ' HA ' ' HE2' ' A' ' 92' ' ' LYS . 11.0 mmpt? . . . . . 0 C--O 1.254 1.305 0 C-N-CA 124.33 1.052 . . . . 0.0 111.825 178.421 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 20' ' ' MET . . . . . 0.415 ' SD ' ' N ' ' A' ' 20' ' ' MET . 1.1 pmm? . . . . . 0 N--CA 1.476 0.829 0 N-CA-C 109.548 -0.538 . . . . 0.0 109.548 . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -98.92 133.66 42.88 Favored 'General case' 0 N--CA 1.476 0.831 0 C-N-CA 123.582 0.753 . . . . 0.0 109.872 -178.884 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -69.27 91.73 0.54 Allowed 'General case' 0 N--CA 1.472 0.652 0 CA-C-O 121.272 0.558 . . . . 0.0 110.021 178.298 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -128.08 35.51 4.43 Favored 'General case' 0 N--CA 1.472 0.662 0 C-N-CA 124.331 1.052 . . . . 0.0 108.738 178.612 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 21.9 m -73.39 147.66 87.66 Favored Pre-proline 0 CA--C 1.55 0.962 0 CA-C-N 114.748 -1.115 . . . . 0.0 110.492 -175.546 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 36.8 Cg_endo -65.1 109.13 1.26 Allowed 'Trans proline' 0 C--N 1.371 1.754 0 C-N-CA 122.127 1.884 . . . . 0.0 111.282 175.139 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 68.0 mt-30 -90.71 170.71 9.91 Favored 'General case' 0 N--CA 1.475 0.82 0 CA-C-N 114.668 -1.151 . . . . 0.0 108.063 174.704 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . 0.525 ' HB2' ' OH ' ' A' ' 82' ' ' TYR . 0.0 OUTLIER -62.06 139.34 58.44 Favored 'General case' 0 N--CA 1.477 0.895 0 CA-C-O 120.889 0.376 . . . . 0.0 111.521 179.577 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -101.51 -43.3 5.95 Favored 'General case' 0 N--CA 1.475 0.818 0 C-N-CA 123.591 0.756 . . . . 0.0 110.878 -174.489 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 29' ' ' TRP . . . . . . . . . . . . . 3.7 m-90 -101.76 152.64 20.63 Favored 'General case' 0 N--CA 1.474 0.731 0 C-N-CA 124.554 1.142 . . . . 0.0 111.605 -169.43 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 64.9 p -92.09 174.16 7.46 Favored 'General case' 0 CA--C 1.542 0.657 0 C-N-CA 123.511 0.724 . . . . 0.0 109.505 170.963 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 12.4 p -56.11 -37.97 51.58 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.36 0 C-N-CA 123.379 0.672 . . . . 0.0 111.973 -177.674 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 10.0 pt-20 -73.61 -35.92 65.41 Favored 'General case' 0 N--CA 1.474 0.727 0 C-N-CA 123.666 0.787 . . . . 0.0 111.843 -178.994 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 2.7 mp0 -66.64 -33.42 75.61 Favored 'General case' 0 N--CA 1.482 1.149 0 C-N-CA 122.839 0.455 . . . . 0.0 110.652 176.144 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . 0.512 HD13 ' HA ' ' A' ' 79' ' ' VAL . 79.4 mt -65.48 -50.72 64.28 Favored 'General case' 0 N--CA 1.48 1.041 0 CA-C-O 121.302 0.572 . . . . 0.0 111.127 177.131 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 13.8 ptm180 -74.34 -11.51 60.28 Favored 'General case' 0 CA--C 1.548 0.892 0 CA-C-N 114.727 -1.124 . . . . 0.0 112.073 -175.786 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 48.3 t -64.73 143.98 57.55 Favored 'General case' 0 CA--C 1.553 1.079 0 C-N-CA 123.497 0.719 . . . . 0.0 111.113 173.65 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 13.9 pt-20 -73.71 -27.99 61.49 Favored 'General case' 0 N--CA 1.481 1.078 0 C-N-CA 123.307 0.643 . . . . 0.0 110.489 175.816 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 92.9 mt-30 -63.16 -31.16 72.24 Favored 'General case' 0 N--CA 1.474 0.773 0 C-N-CA 124.982 1.313 . . . . 0.0 110.868 -177.18 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . 0.418 HD22 ' HA ' ' A' ' 34' ' ' LEU . 48.7 tp -92.04 109.16 35.54 Favored Pre-proline 0 CA--C 1.549 0.92 0 N-CA-C 108.362 -0.977 . . . . 0.0 108.362 170.713 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 40' ' ' PRO . . . . . 0.468 ' HG2' ' HB2' ' A' ' 43' ' ' ASP . 47.3 Cg_endo -68.61 151.11 75.23 Favored 'Trans proline' 0 C--N 1.378 2.081 0 C-N-CA 122.821 2.347 . . . . 0.0 112.466 -178.587 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 49.7 mtmt -58.21 -42.72 86.84 Favored 'General case' 0 N--CA 1.477 0.883 0 C-N-CA 123.983 0.913 . . . . 0.0 111.325 -179.806 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 17.8 ptpt -63.52 -34.34 77.57 Favored 'General case' 0 CA--C 1.542 0.669 0 CA-C-N 114.442 -1.254 . . . . 0.0 111.763 -176.274 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 43' ' ' ASP . . . . . 0.468 ' HB2' ' HG2' ' A' ' 40' ' ' PRO . 14.0 t70 -73.99 -30.83 62.69 Favored 'General case' 0 N--CA 1.48 1.048 0 O-C-N 123.109 0.256 . . . . 0.0 110.847 -176.941 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 44' ' ' ILE . . . . . 0.507 HD12 HD11 ' A' ' 78' ' ' LEU . 42.8 mt -70.22 -52.16 32.54 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.973 0 C-N-CA 122.827 0.451 . . . . 0.0 110.033 177.036 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 69.5 mt -55.64 -41.84 66.43 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.537 0 C-N-CA 123.612 0.765 . . . . 0.0 110.581 177.008 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 35.1 ttmt -56.25 -48.38 76.64 Favored 'General case' 0 N--CA 1.474 0.763 0 C-N-CA 124.737 1.215 . . . . 0.0 111.241 178.036 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 15.9 t80 -61.37 -46.48 90.02 Favored 'General case' 0 N--CA 1.474 0.74 0 CA-C-N 115.045 -0.979 . . . . 0.0 110.903 178.021 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 88.5 mt -69.42 -32.56 71.61 Favored 'General case' 0 N--CA 1.473 0.705 0 C-N-CA 123.544 0.738 . . . . 0.0 112.14 -174.704 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 3.1 pt20 -82.29 -26.33 33.19 Favored 'General case' 0 N--CA 1.479 0.979 0 CA-C-O 120.779 0.323 . . . . 0.0 110.716 178.788 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 11.3 tp10 -63.43 -26.27 68.66 Favored 'General case' 0 N--CA 1.48 1.046 0 C-N-CA 124.068 0.947 . . . . 0.0 112.07 -176.933 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 51' ' ' HIS . . . . . 0.461 ' O ' ' HG2' ' A' ' 92' ' ' LYS . 0.4 OUTLIER -136.22 -24.94 1.22 Allowed 'General case' 0 N--CA 1.487 1.404 0 N-CA-C 113.428 0.899 . . . . 0.0 113.428 178.764 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -58.04 131.68 52.17 Favored Glycine 0 C--N 1.346 1.089 0 CA-C-N 118.426 0.557 . . . . 0.0 112.761 174.118 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 48.2 t -64.36 160.14 19.63 Favored 'General case' 0 N--CA 1.477 0.914 0 C-N-CA 123.014 0.525 . . . . 0.0 111.34 -177.51 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 4.8 m-20 -56.95 -38.19 72.6 Favored 'General case' 0 N--CA 1.482 1.167 0 C-N-CA 124.111 0.964 . . . . 0.0 111.003 -178.587 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 28.2 t -65.98 -36.45 83.34 Favored 'General case' 0 CA--C 1.548 0.891 0 CA-C-N 114.175 -1.375 . . . . 0.0 110.847 -179.468 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 88.5 t80 -70.75 -51.12 29.23 Favored 'General case' 0 N--CA 1.476 0.862 0 C-N-CA 123.102 0.561 . . . . 0.0 110.099 175.791 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 73.1 mt -62.78 -31.8 72.84 Favored 'General case' 0 N--CA 1.474 0.771 0 CA-C-N 115.19 -0.913 . . . . 0.0 111.561 -173.633 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -62.09 -49.5 75.68 Favored 'General case' 0 N--CA 1.476 0.862 0 C-N-CA 123.587 0.755 . . . . 0.0 111.443 177.286 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 36.1 mt-10 -57.4 -48.74 78.29 Favored 'General case' 0 N--CA 1.483 1.224 0 C-N-CA 123.81 0.844 . . . . 0.0 110.555 179.357 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 64.2 m80 -95.67 1.95 53.79 Favored 'General case' 0 N--CA 1.477 0.876 0 CA-C-N 114.86 -1.064 . . . . 0.0 111.974 -170.532 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 39.4 mtmm 57.34 27.46 13.8 Favored 'General case' 0 N--CA 1.492 1.666 0 C-N-CA 124.496 1.118 . . . . 0.0 112.797 176.951 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . 0.453 HD11 ' HB2' ' A' ' 81' ' ' ALA . 85.1 mt -82.32 -11.61 58.5 Favored 'General case' 0 N--CA 1.483 1.183 0 C-N-CA 123.298 0.639 . . . . 0.0 111.671 -176.012 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 2.9 pp -79.54 158.45 27.17 Favored 'General case' 0 N--CA 1.475 0.806 0 CA-C-O 121.103 0.478 . . . . 0.0 110.724 175.347 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 93.42 -168.52 29.58 Favored Glycine 0 C--N 1.339 0.74 0 CA-C-N 115.313 -0.858 . . . . 0.0 112.774 179.76 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 65' ' ' ASN . . . . . 0.403 ' O ' HG22 ' A' ' 69' ' ' VAL . 51.5 t-20 -59.7 111.87 1.6 Allowed 'General case' 0 N--CA 1.478 0.974 0 C-N-CA 124.08 0.952 . . . . 0.0 109.593 -177.521 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 39.8 mt -55.36 -42.69 68.18 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.58 0 C-N-CA 123.873 0.869 . . . . 0.0 111.307 -171.652 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 17.5 mtpp -55.96 -45.73 78.8 Favored 'General case' 0 CA--C 1.545 0.781 0 C-N-CA 124.466 1.106 . . . . 0.0 111.156 178.277 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 2.1 m-20 -74.13 -33.09 63.43 Favored 'General case' 0 N--CA 1.481 1.083 0 C-N-CA 123.31 0.644 . . . . 0.0 111.121 -178.909 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 69' ' ' VAL . . . . . 0.403 HG22 ' O ' ' A' ' 65' ' ' ASN . 89.8 t -63.03 -44.06 99.4 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.061 0 C-N-CA 123.367 0.667 . . . . 0.0 109.936 174.393 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -67.04 -5.18 12.01 Favored 'General case' 0 N--CA 1.484 1.268 0 C-N-CA 124.742 1.217 . . . . 0.0 112.709 -176.101 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 85.6 tttt -72.27 -50.68 25.34 Favored 'General case' 0 CA--C 1.545 0.754 0 C-N-CA 122.738 0.415 . . . . 0.0 109.912 173.908 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 14.5 t -91.53 -21.33 20.93 Favored 'General case' 0 N--CA 1.473 0.716 0 C-N-CA 123.374 0.67 . . . . 0.0 110.889 179.56 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -85.44 85.31 7.44 Favored 'General case' 0 C--O 1.241 0.653 0 CA-C-O 121.681 0.753 . . . . 0.0 109.407 178.428 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 74' ' ' ASN . . . . . 0.451 ' O ' ' HG ' ' A' ' 78' ' ' LEU . 28.0 p-10 -74.92 172.83 11.55 Favored 'General case' 0 N--CA 1.474 0.763 0 CA-C-N 114.494 -1.23 . . . . 0.0 109.885 176.854 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . 0.405 ' HA ' HD12 ' A' ' 78' ' ' LEU . 1.9 tpmt? -54.27 -40.73 68.1 Favored 'General case' 0 CA--C 1.552 1.05 0 C-N-CA 123.867 0.867 . . . . 0.0 111.519 -176.056 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 34.8 t70 -64.68 -40.38 95.3 Favored 'General case' 0 N--CA 1.478 0.943 0 C-N-CA 124.293 1.037 . . . . 0.0 112.122 179.457 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 34.5 t60 -59.35 -42.89 92.58 Favored 'General case' 0 N--CA 1.485 1.32 0 C-N-CA 124.076 0.951 . . . . 0.0 110.363 178.974 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . 0.507 HD11 HD12 ' A' ' 44' ' ' ILE . 34.0 mt -60.32 -46.26 90.51 Favored 'General case' 0 C--O 1.218 -0.578 0 CA-C-N 114.296 -1.32 . . . . 0.0 111.377 -176.174 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 79' ' ' VAL . . . . . 0.512 ' HA ' HD13 ' A' ' 34' ' ' LEU . 60.2 t -63.68 -46.84 93.59 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.631 0 O-C-N 124.367 1.042 . . . . 0.0 110.743 -178.728 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 34.5 m -60.05 -50.51 73.44 Favored 'General case' 0 N--CA 1.478 0.94 0 CA-C-N 115.61 -0.723 . . . . 0.0 111.259 179.392 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 81' ' ' ALA . . . . . 0.453 ' HB2' HD11 ' A' ' 62' ' ' LEU . . . -66.4 -43.55 85.51 Favored 'General case' 0 N--CA 1.474 0.747 0 C-N-CA 123.767 0.827 . . . . 0.0 111.31 -177.286 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 82' ' ' TYR . . . . . 0.525 ' OH ' ' HB2' ' A' ' 27' ' ' ARG . 78.6 t80 -58.22 -58.93 6.3 Favored 'General case' 0 N--CA 1.473 0.721 0 C-N-CA 124.024 0.93 . . . . 0.0 110.379 -178.262 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 83' ' ' ASN . . . . . . . . . . . . . 16.6 m-80 -59.47 -39.69 84.51 Favored 'General case' 0 N--CA 1.48 1.063 0 C-N-CA 123.546 0.738 . . . . 0.0 111.011 -175.042 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 3.7 m-70 -65.07 -33.89 77.11 Favored 'General case' 0 N--CA 1.478 0.943 0 C-N-CA 123.765 0.826 . . . . 0.0 112.605 179.969 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 40.6 tp -59.18 -52.1 67.16 Favored 'General case' 0 N--CA 1.479 1.021 0 CA-C-O 121.519 0.676 . . . . 0.0 110.847 -176.811 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 86' ' ' PHE . . . . . 0.427 ' HA ' ' HE2' ' A' ' 91' ' ' PHE . 21.6 m-85 -76.27 -29.47 57.44 Favored 'General case' 0 N--CA 1.473 0.702 0 CA-C-N 114.106 -1.406 . . . . 0.0 111.165 -177.933 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 11.2 tp10 -61.01 -27.65 68.47 Favored 'General case' 0 N--CA 1.48 1.045 0 C-N-CA 124.734 1.214 . . . . 0.0 111.981 -179.905 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 31.5 p -128.46 -4.37 5.4 Favored 'General case' 0 N--CA 1.484 1.231 0 C-N-CA 123.74 0.816 . . . . 0.0 111.613 -177.761 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 44.7 mtmt 58.05 50.15 10.54 Favored 'General case' 0 N--CA 1.485 1.317 0 C-N-CA 124.614 1.166 . . . . 0.0 112.168 178.687 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 99.5 mtt180 -80.93 -5.43 57.45 Favored 'General case' 0 N--CA 1.481 1.077 0 CA-C-N 115.698 -0.683 . . . . 0.0 111.627 178.208 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 91' ' ' PHE . . . . . 0.427 ' HE2' ' HA ' ' A' ' 86' ' ' PHE . 48.9 p90 -71.98 163.61 27.56 Favored 'General case' 0 N--CA 1.474 0.763 0 C-N-CA 123.53 0.732 . . . . 0.0 110.674 167.416 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 92' ' ' LYS . . . . . 0.461 ' HG2' ' O ' ' A' ' 51' ' ' HIS . 32.2 mmmt . . . . . 0 C--O 1.252 1.194 0 C-N-CA 123.466 0.707 . . . . 0.0 110.674 -176.226 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 20' ' ' MET . . . . . . . . . . . . . 77.8 mtp . . . . . 0 N--CA 1.483 1.207 0 N-CA-C 110.168 -0.308 . . . . 0.0 110.168 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -88.18 155.97 19.48 Favored 'General case' 0 C--O 1.244 0.794 0 N-CA-C 109.303 -0.628 . . . . 0.0 109.303 169.481 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -71.5 114.66 9.81 Favored 'General case' 0 N--CA 1.47 0.574 0 C-N-CA 123.42 0.688 . . . . 0.0 109.904 178.851 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -75.7 78.36 2.67 Favored 'General case' 0 N--CA 1.471 0.621 0 C-N-CA 123.215 0.606 . . . . 0.0 109.513 174.426 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 6.1 m -117.58 79.85 12.85 Favored Pre-proline 0 CA--C 1.551 0.993 0 C-N-CA 124.239 1.015 . . . . 0.0 109.404 -176.811 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 61.3 Cg_endo -68.92 117.09 4.81 Favored 'Trans proline' 0 C--N 1.375 1.924 0 C-N-CA 122.993 2.462 . . . . 0.0 112.521 -173.602 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 88.0 mt-30 -78.73 154.09 30.33 Favored 'General case' 0 C--O 1.248 0.986 0 N-CA-C 108.144 -1.058 . . . . 0.0 108.144 170.352 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -59.47 141.08 55.52 Favored 'General case' 0 CA--C 1.542 0.664 0 O-C-N 123.508 0.505 . . . . 0.0 111.177 178.604 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -85.1 -42.4 14.83 Favored 'General case' 0 N--CA 1.474 0.753 0 C-N-CA 123.5 0.72 . . . . 0.0 109.423 178.197 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 29' ' ' TRP . . . . . . . . . . . . . 6.6 m-90 -123.48 153.7 40.14 Favored 'General case' 0 N--CA 1.476 0.835 0 C-N-CA 124.571 1.148 . . . . 0.0 108.935 177.966 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 30' ' ' THR . . . . . 0.425 ' O ' ' HG ' ' A' ' 34' ' ' LEU . 55.9 p -87.49 170.59 11.21 Favored 'General case' 0 N--CA 1.475 0.812 0 C-N-CA 123.007 0.523 . . . . 0.0 110.095 -178.92 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 8.1 p -56.13 -46.23 80.98 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.312 0 C-N-CA 123.909 0.884 . . . . 0.0 113.206 -168.435 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 1.2 pm0 -75.77 -29.85 58.93 Favored 'General case' 0 N--CA 1.48 1.035 0 C-N-CA 123.615 0.766 . . . . 0.0 111.416 178.553 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 43.1 mt-30 -62.63 -29.04 70.33 Favored 'General case' 0 N--CA 1.491 1.605 0 CA-C-N 118.227 0.467 . . . . 0.0 110.705 172.538 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . 0.425 ' HG ' ' O ' ' A' ' 30' ' ' THR . 42.1 mt -72.85 -39.61 66.38 Favored 'General case' 0 N--CA 1.472 0.662 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.49 174.798 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 47.5 mtm105 -71.68 -20.23 61.96 Favored 'General case' 0 N--CA 1.478 0.945 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.967 176.444 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 46.9 t -64.23 123.25 18.63 Favored 'General case' 0 C--O 1.238 0.494 0 C-N-CA 123.455 0.702 . . . . 0.0 110.334 179.819 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 33.4 mt-10 -62.58 -19.22 63.48 Favored 'General case' 0 CA--C 1.547 0.836 0 C-N-CA 124.484 1.114 . . . . 0.0 111.512 178.909 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 82.9 mt-30 -61.8 -50.29 72.91 Favored 'General case' 0 N--CA 1.472 0.633 0 C-N-CA 124.37 1.068 . . . . 0.0 110.341 176.487 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . 0.417 HD21 ' HA ' ' A' ' 34' ' ' LEU . 62.1 tp -72.62 123.67 89.83 Favored Pre-proline 0 CA--C 1.55 0.948 0 CA-C-N 115.396 -0.82 . . . . 0.0 109.783 -178.917 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 39.9 Cg_exo -61.7 149.43 89.97 Favored 'Trans proline' 0 C--N 1.378 2.095 0 C-N-CA 123.157 2.571 . . . . 0.0 113.532 175.105 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . 0.608 ' HG2' ' HD3' ' A' ' 75' ' ' LYS . 42.4 mtpt -67.01 -43.51 82.68 Favored 'General case' 0 N--CA 1.477 0.897 0 C-N-CA 124.321 1.048 . . . . 0.0 110.211 179.05 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 11.9 ptmm? -56.18 -36.63 68.57 Favored 'General case' 0 N--CA 1.476 0.859 0 C-N-CA 125.193 1.397 . . . . 0.0 112.864 179.458 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -64.87 -41.08 95.94 Favored 'General case' 0 N--CA 1.476 0.871 0 O-C-N 123.753 0.658 . . . . 0.0 111.281 179.888 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 43.8 mt -67.35 -48.23 78.46 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.961 0 C-N-CA 122.927 0.491 . . . . 0.0 110.085 179.206 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 82.1 mt -59.5 -43.96 91.86 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.05 0 CA-C-N 115.529 -0.76 . . . . 0.0 110.795 -179.875 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 88.3 tttt -63.81 -37.61 88.03 Favored 'General case' 0 N--CA 1.476 0.864 0 O-C-N 123.972 0.795 . . . . 0.0 111.159 -179.859 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 37.8 t80 -63.51 -54.03 42.76 Favored 'General case' 0 N--CA 1.477 0.901 0 CA-C-N 115.266 -0.879 . . . . 0.0 110.638 176.185 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 86.6 mt -68.65 -30.74 69.5 Favored 'General case' 0 N--CA 1.478 0.94 0 C-N-CA 123.642 0.777 . . . . 0.0 111.892 -173.108 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . 0.503 ' HA ' HD21 ' A' ' 57' ' ' LEU . 3.5 pt20 -81.62 -26.6 34.72 Favored 'General case' 0 N--CA 1.483 1.185 0 N-CA-C 111.62 0.23 . . . . 0.0 111.62 -179.085 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 12.1 tp10 -62.07 -38.7 89.8 Favored 'General case' 0 N--CA 1.479 1.014 0 C-N-CA 123.7 0.8 . . . . 0.0 111.815 -179.118 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 16.5 p80 -122.09 -25.67 4.88 Favored 'General case' 0 N--CA 1.493 1.71 0 N-CA-C 112.814 0.672 . . . . 0.0 112.814 -175.832 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . 0.477 ' HA2' ' HA ' ' A' ' 91' ' ' PHE . . . -61.54 139.58 47.12 Favored Glycine 0 C--N 1.347 1.145 0 CA-C-O 119.628 -0.54 . . . . 0.0 112.374 173.761 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 53' ' ' SER . . . . . 0.468 ' O ' ' HG ' ' A' ' 57' ' ' LEU . 28.7 t -63.57 151.88 40.26 Favored 'General case' 0 N--CA 1.481 1.084 0 C-N-CA 123.523 0.729 . . . . 0.0 111.476 -179.008 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 26.9 t70 -55.45 -37.04 67.2 Favored 'General case' 0 N--CA 1.483 1.189 0 O-C-N 124.309 1.006 . . . . 0.0 111.727 178.046 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 46.0 m -66.13 -42.19 89.45 Favored 'General case' 0 CA--C 1.543 0.71 0 O-C-N 123.84 0.712 . . . . 0.0 111.142 177.312 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 56' ' ' PHE . . . . . 0.439 ' HB2' ' HB3' ' A' ' 90' ' ' ARG . 27.6 t80 -60.57 -41.86 95.48 Favored 'General case' 0 N--CA 1.482 1.174 0 C-N-CA 123.714 0.805 . . . . 0.0 110.365 174.497 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . 0.503 HD21 ' HA ' ' A' ' 49' ' ' GLN . 65.0 mt -69.95 -37.73 75.92 Favored 'General case' 0 N--CA 1.47 0.539 0 CA-C-N 115.514 -0.767 . . . . 0.0 111.079 -176.815 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -67.38 -49.2 64.91 Favored 'General case' 0 N--CA 1.482 1.142 0 C-N-CA 123.332 0.653 . . . . 0.0 110.865 -179.74 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 47.1 mt-10 -59.87 -32.04 70.34 Favored 'General case' 0 N--CA 1.477 0.885 0 CA-C-N 115.318 -0.855 . . . . 0.0 111.96 178.183 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 41.1 m80 -116.13 14.39 15.95 Favored 'General case' 0 N--CA 1.485 1.278 0 N-CA-C 112.881 0.697 . . . . 0.0 112.881 -174.805 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 57.6 mttp 57.07 20.6 5.62 Favored 'General case' 0 N--CA 1.498 1.962 0 N-CA-C 114.167 1.173 . . . . 0.0 114.167 172.995 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 94.9 mt -83.64 -10.7 58.04 Favored 'General case' 0 N--CA 1.482 1.172 0 C-N-CA 122.822 0.449 . . . . 0.0 111.951 -174.847 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 2.5 pp -81.96 176.33 9.64 Favored 'General case' 0 N--CA 1.481 1.112 0 CA-C-O 121.31 0.576 . . . . 0.0 111.144 175.481 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 90.17 -148.9 19.97 Favored Glycine 0 C--N 1.336 0.583 0 CA-C-N 114.686 -1.143 . . . . 0.0 111.823 177.973 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 9.8 m120 -77.03 119.77 21.22 Favored 'General case' 0 N--CA 1.468 0.441 0 N-CA-C 108.68 -0.859 . . . . 0.0 108.68 176.283 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 64.1 mt -54.08 -48.06 65.49 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.051 0 C-N-CA 123.709 0.804 . . . . 0.0 110.157 178.698 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 61.3 pttt -54.12 -38.75 65.75 Favored 'General case' 0 N--CA 1.485 1.293 0 C-N-CA 124.022 0.929 . . . . 0.0 112.461 178.563 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 8.1 t30 -68.32 -45.64 72.41 Favored 'General case' 0 N--CA 1.478 0.941 0 C-N-CA 123.319 0.647 . . . . 0.0 110.692 179.524 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 69' ' ' VAL . . . . . 0.441 ' HA ' HG23 ' A' ' 72' ' ' THR . 44.9 t -71.94 -31.88 42.22 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.974 0 CA-C-N 115.58 -0.737 . . . . 0.0 110.714 -178.075 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -73.09 -14.94 61.49 Favored 'General case' 0 N--CA 1.479 1.007 0 C-N-CA 123.697 0.799 . . . . 0.0 112.212 -177.413 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 16.8 ptpt -99.3 -48.78 4.69 Favored 'General case' 0 CA--C 1.547 0.851 0 CA-C-N 118.11 0.414 . . . . 0.0 111.41 170.605 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 72' ' ' THR . . . . . 0.441 HG23 ' HA ' ' A' ' 69' ' ' VAL . 7.6 t -73.39 -35.34 65.89 Favored 'General case' 0 N--CA 1.487 1.419 0 C-N-CA 122.937 0.495 . . . . 0.0 112.027 -171.157 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -100.92 130.55 46.94 Favored 'General case' 0 N--CA 1.472 0.669 0 C-N-CA 123.699 0.799 . . . . 0.0 109.425 177.485 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 29.1 p-10 -82.98 173.81 11.46 Favored 'General case' 0 N--CA 1.484 1.27 0 C-N-CA 123.491 0.716 . . . . 0.0 111.216 -174.45 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . 0.608 ' HD3' ' HG2' ' A' ' 41' ' ' LYS . 15.7 tptm -64.25 -39.8 94.7 Favored 'General case' 0 N--CA 1.477 0.898 0 C-N-CA 123.676 0.79 . . . . 0.0 111.176 -174.403 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 22.3 t70 -64.41 -38.41 90.93 Favored 'General case' 0 N--CA 1.482 1.142 0 C-N-CA 124.009 0.924 . . . . 0.0 111.053 -177.212 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 77' ' ' HIS . . . . . 0.431 ' HD2' HD22 ' A' ' 78' ' ' LEU . 33.0 t60 -55.39 -43.58 75.31 Favored 'General case' 0 N--CA 1.481 1.076 0 C-N-CA 124.696 1.198 . . . . 0.0 110.56 173.902 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . 0.431 HD22 ' HD2' ' A' ' 77' ' ' HIS . 25.5 mt -67.74 -40.26 84.15 Favored 'General case' 0 N--CA 1.477 0.894 0 C-N-CA 123.882 0.873 . . . . 0.0 111.103 -175.663 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 79' ' ' VAL . . . . . 0.405 HG21 ' O ' ' A' ' 75' ' ' LYS . 45.2 t -66.55 -45.01 89.79 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.821 0 C-N-CA 123.801 0.841 . . . . 0.0 110.118 179.276 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 33.1 m -60.72 -42.91 98.23 Favored 'General case' 0 N--CA 1.482 1.171 0 C-N-CA 123.599 0.76 . . . . 0.0 111.117 179.08 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -66.87 -39.9 87.69 Favored 'General case' 0 N--CA 1.476 0.868 0 C-N-CA 123.705 0.802 . . . . 0.0 110.992 178.87 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 82' ' ' TYR . . . . . 0.427 ' O ' ' HB3' ' A' ' 85' ' ' LEU . 5.5 t80 -56.67 -55.64 31.47 Favored 'General case' 0 C--O 1.218 -0.557 0 C-N-CA 124.663 1.185 . . . . 0.0 110.908 177.035 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 83' ' ' ASN . . . . . . . . . . . . . 59.7 m-80 -67.33 -40.51 85.91 Favored 'General case' 0 N--CA 1.486 1.352 0 C-N-CA 122.52 0.328 . . . . 0.0 111.143 -174.58 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 55.4 m170 -66.51 -24.3 66.37 Favored 'General case' 0 N--CA 1.483 1.222 0 C-N-CA 123.771 0.829 . . . . 0.0 111.612 177.415 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 85' ' ' LEU . . . . . 0.427 ' HB3' ' O ' ' A' ' 82' ' ' TYR . 53.9 tp -59.3 -54.73 43.44 Favored 'General case' 0 N--CA 1.479 0.982 0 CA-C-O 121.327 0.584 . . . . 0.0 110.822 175.16 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 45.0 m-85 -73.77 -30.4 62.75 Favored 'General case' 0 N--CA 1.475 0.777 0 CA-C-N 114.515 -1.22 . . . . 0.0 110.798 -176.627 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 44.3 tt0 -65.29 -24.6 67.34 Favored 'General case' 0 N--CA 1.482 1.137 0 C-N-CA 124.076 0.95 . . . . 0.0 112.48 -175.95 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 10.1 p -125.16 -4.2 7.44 Favored 'General case' 0 N--CA 1.478 0.949 0 C-N-CA 123.731 0.812 . . . . 0.0 110.921 177.765 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 94.3 mttt 56.23 49.75 14.73 Favored 'General case' 0 N--CA 1.485 1.293 0 C-N-CA 124.364 1.066 . . . . 0.0 111.48 -175.806 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 90' ' ' ARG . . . . . 0.439 ' HB3' ' HB2' ' A' ' 56' ' ' PHE . 54.4 mtt85 -68.95 -13.27 62.34 Favored 'General case' 0 N--CA 1.488 1.44 0 C-N-CA 124.791 1.237 . . . . 0.0 112.891 178.018 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 91' ' ' PHE . . . . . 0.477 ' HA ' ' HA2' ' A' ' 52' ' ' GLY . 4.2 p90 -68.14 139.96 56.16 Favored 'General case' 0 N--CA 1.475 0.816 0 C-N-CA 122.442 0.297 . . . . 0.0 110.787 175.295 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 C--O 1.256 1.406 0 C-N-CA 124.441 1.097 . . . . 0.0 108.286 172.357 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 20' ' ' MET . . . . . . . . . . . . . 25.6 ttt . . . . . 0 N--CA 1.476 0.865 0 N-CA-C 109.263 -0.643 . . . . 0.0 109.263 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -127.64 156.49 42.23 Favored 'General case' 0 N--CA 1.47 0.542 0 C-N-CA 123.549 0.74 . . . . 0.0 110.308 -178.643 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -136.94 178.0 7.42 Favored 'General case' 0 C--O 1.241 0.615 0 C-N-CA 124.052 0.941 . . . . 0.0 109.31 178.976 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -158.97 135.67 9.44 Favored 'General case' 0 C--O 1.24 0.605 0 C-N-CA 123.855 0.862 . . . . 0.0 109.325 -179.656 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . 0.416 ' HA ' ' HD3' ' A' ' 25' ' ' PRO . 30.8 m -76.29 131.78 74.43 Favored Pre-proline 0 CA--C 1.55 0.955 0 N-CA-C 109.245 -0.65 . . . . 0.0 109.245 172.424 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 25' ' ' PRO . . . . . 0.416 ' HD3' ' HA ' ' A' ' 24' ' ' VAL . 18.7 Cg_exo -65.09 113.71 2.51 Favored 'Trans proline' 0 C--N 1.376 2.022 0 C-N-CA 123.0 2.467 . . . . 0.0 109.946 178.355 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 76.2 mm-40 -62.21 96.48 0.07 Allowed 'General case' 0 C--O 1.241 0.654 0 N-CA-C 108.061 -1.088 . . . . 0.0 108.061 178.094 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 27.7 ptt180 -61.91 130.51 45.97 Favored 'General case' 0 CA--C 1.543 0.683 0 CA-C-N 114.149 -1.387 . . . . 0.0 110.457 -164.14 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -74.84 -22.38 58.72 Favored 'General case' 0 CA--C 1.54 0.575 0 CA-C-N 114.912 -1.04 . . . . 0.0 112.668 -167.047 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 29' ' ' TRP . . . . . . . . . . . . . 3.9 m-90 -138.89 150.71 46.27 Favored 'General case' 0 N--CA 1.478 0.945 0 C-N-CA 123.829 0.852 . . . . 0.0 110.902 -168.529 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 37.7 p -90.4 173.78 7.92 Favored 'General case' 0 N--CA 1.471 0.593 0 CA-C-N 115.37 -0.832 . . . . 0.0 109.05 170.404 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . 0.522 ' HA ' HD13 ' A' ' 34' ' ' LEU . 10.5 p -59.29 -34.3 53.57 Favored 'Isoleucine or valine' 0 CA--C 1.557 1.248 0 C-N-CA 123.741 0.816 . . . . 0.0 112.362 -174.689 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 12.5 pt-20 -70.48 -35.67 73.41 Favored 'General case' 0 N--CA 1.481 1.098 0 C-N-CA 123.589 0.756 . . . . 0.0 111.028 176.816 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 22.5 mm-40 -72.64 -30.4 64.27 Favored 'General case' 0 CA--C 1.546 0.803 0 C-N-CA 123.103 0.561 . . . . 0.0 110.798 176.184 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . 0.522 HD13 ' HA ' ' A' ' 31' ' ' VAL . 93.1 mt -72.27 -37.78 68.98 Favored 'General case' 0 N--CA 1.476 0.839 0 C-N-CA 123.674 0.79 . . . . 0.0 112.287 -179.0 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 12.0 ptt180 -76.43 -22.56 54.5 Favored 'General case' 0 N--CA 1.479 1.019 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.275 176.508 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 41.5 t -58.39 109.91 0.87 Allowed 'General case' 0 C--N 1.356 0.859 0 O-C-N 124.017 0.823 . . . . 0.0 111.829 -173.593 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 9.9 pt-20 -62.27 -21.08 64.93 Favored 'General case' 0 N--CA 1.484 1.261 0 C-N-CA 124.771 1.228 . . . . 0.0 112.541 179.453 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 12.0 mm100 -67.85 -32.82 73.61 Favored 'General case' 0 N--CA 1.473 0.715 0 C-N-CA 123.941 0.896 . . . . 0.0 110.356 176.437 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 3.5 tt -73.38 127.59 88.71 Favored Pre-proline 0 CA--C 1.547 0.861 0 N-CA-C 108.024 -1.102 . . . . 0.0 108.024 175.866 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 53.0 Cg_exo -55.41 126.35 22.21 Favored 'Trans proline' 0 C--N 1.378 2.088 0 C-N-CA 122.546 2.164 . . . . 0.0 112.365 174.015 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . 0.751 ' HG2' ' HD3' ' A' ' 75' ' ' LYS . 35.9 mtmm -58.08 -37.78 75.13 Favored 'General case' 0 N--CA 1.48 1.069 0 C-N-CA 124.348 1.059 . . . . 0.0 110.483 177.58 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 18.8 ptpt -62.19 -35.9 80.25 Favored 'General case' 0 N--CA 1.472 0.626 0 CA-C-N 114.777 -1.101 . . . . 0.0 111.9 175.498 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 43' ' ' ASP . . . . . 0.402 ' HA ' ' HE3' ' A' ' 46' ' ' LYS . 30.2 t70 -69.82 -32.72 71.3 Favored 'General case' 0 CA--C 1.545 0.757 0 C-N-CA 122.444 0.298 . . . . 0.0 110.82 -174.338 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 56.2 mt -66.57 -52.4 46.45 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.148 0 N-CA-C 109.575 -0.528 . . . . 0.0 109.575 174.217 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 45' ' ' ILE . . . . . 0.445 HD13 HG12 ' A' ' 69' ' ' VAL . 76.4 mt -58.49 -33.38 48.0 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.333 0 C-N-CA 124.451 1.1 . . . . 0.0 111.654 178.95 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 46' ' ' LYS . . . . . 0.402 ' HE3' ' HA ' ' A' ' 43' ' ' ASP . 33.0 ttmt -61.68 -41.94 98.24 Favored 'General case' 0 N--CA 1.48 1.028 0 C-N-CA 124.394 1.078 . . . . 0.0 110.796 179.233 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 2.0 t80 -70.89 -37.66 73.01 Favored 'General case' 0 CA--C 1.548 0.884 0 CA-C-N 114.488 -1.233 . . . . 0.0 109.858 177.698 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . 0.461 HD23 ' HA ' ' A' ' 82' ' ' TYR . 93.1 mt -68.89 -31.84 71.05 Favored 'General case' 0 N--CA 1.476 0.862 0 C-N-CA 123.481 0.712 . . . . 0.0 112.488 -178.73 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . 0.53 ' HA ' HD22 ' A' ' 57' ' ' LEU . 3.8 pt20 -85.07 -28.03 25.91 Favored 'General case' 0 N--CA 1.479 1.012 0 C-N-CA 122.103 0.161 . . . . 0.0 111.393 176.081 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 42.7 tt0 -61.22 -35.17 76.48 Favored 'General case' 0 N--CA 1.479 1.007 0 O-C-N 123.767 0.667 . . . . 0.0 111.26 -178.176 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 59.7 m-70 -112.86 -44.68 3.27 Favored 'General case' 0 N--CA 1.469 0.524 0 CA-C-N 115.798 -0.637 . . . . 0.0 110.022 -179.066 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . 0.427 ' HA2' ' HA ' ' A' ' 91' ' ' PHE . . . -57.07 131.28 51.97 Favored Glycine 0 C--N 1.354 1.564 0 O-C-N 123.912 0.757 . . . . 0.0 114.318 -175.328 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 44.1 m -72.58 166.12 23.34 Favored 'General case' 0 CA--C 1.54 0.57 0 C-N-CA 124.07 0.948 . . . . 0.0 111.736 -177.159 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 23.3 t70 -54.17 -38.77 65.93 Favored 'General case' 0 N--CA 1.481 1.083 0 CA-C-N 115.001 -0.999 . . . . 0.0 112.574 -175.233 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 20.2 t -67.05 -37.98 85.04 Favored 'General case' 0 CA--C 1.55 0.966 0 O-C-N 123.55 0.531 . . . . 0.0 111.098 -179.532 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 56' ' ' PHE . . . . . 0.483 ' HD1' HH11 ' A' ' 90' ' ' ARG . 53.4 t80 -67.02 -41.04 87.3 Favored 'General case' 0 N--CA 1.486 1.332 0 C-N-CA 123.632 0.773 . . . . 0.0 110.109 176.049 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . 0.53 HD22 ' HA ' ' A' ' 49' ' ' GLN . 39.0 mt -69.56 -55.25 10.68 Favored 'General case' 0 N--CA 1.471 0.595 0 CA-C-N 115.829 -0.623 . . . . 0.0 110.666 -175.802 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -61.55 -29.1 69.79 Favored 'General case' 0 N--CA 1.487 1.386 0 C-N-CA 124.394 1.078 . . . . 0.0 112.742 -174.109 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 50.6 mt-10 -54.39 -45.64 72.94 Favored 'General case' 0 N--CA 1.484 1.246 0 C-N-CA 122.798 0.439 . . . . 0.0 111.497 174.508 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 37.5 t-80 -114.07 4.14 15.54 Favored 'General case' 0 N--CA 1.48 1.042 0 C-N-CA 122.845 0.458 . . . . 0.0 111.345 -176.104 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 32.5 mmtp 49.29 60.5 3.72 Favored 'General case' 0 N--CA 1.476 0.831 0 C-N-CA 124.672 1.189 . . . . 0.0 111.301 -171.867 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . 0.484 ' HA ' HG13 ' A' ' 69' ' ' VAL . 95.2 mt -85.17 -14.77 45.89 Favored 'General case' 0 N--CA 1.481 1.11 0 CA-C-N 115.013 -0.994 . . . . 0.0 110.214 174.417 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 1.1 pp -76.66 171.11 15.22 Favored 'General case' 0 CA--C 1.545 0.769 0 C-N-CA 124.098 0.959 . . . . 0.0 110.739 173.556 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 88.4 -146.62 19.62 Favored Glycine 0 C--N 1.341 0.821 0 CA-C-N 115.61 -0.723 . . . . 0.0 111.921 -179.922 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 38.8 m-80 -72.73 113.12 9.41 Favored 'General case' 0 N--CA 1.478 0.947 0 N-CA-C 108.578 -0.897 . . . . 0.0 108.578 175.228 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 17.9 mt -55.9 -39.63 57.98 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.208 0 O-C-N 124.266 0.979 . . . . 0.0 110.335 -177.5 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 60.9 pttt -60.9 -39.76 90.54 Favored 'General case' 0 N--CA 1.478 0.961 0 C-N-CA 124.928 1.291 . . . . 0.0 112.246 178.302 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 28.3 t-20 -73.86 -36.47 64.86 Favored 'General case' 0 N--CA 1.477 0.899 0 C-N-CA 123.704 0.802 . . . . 0.0 109.984 -177.061 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 69' ' ' VAL . . . . . 0.484 HG13 ' HA ' ' A' ' 62' ' ' LEU . 58.7 t -63.53 -45.55 97.46 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.622 0 CA-C-N 114.984 -1.007 . . . . 0.0 109.522 172.17 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -67.59 -17.95 64.81 Favored 'General case' 0 N--CA 1.477 0.925 0 C-N-CA 124.582 1.153 . . . . 0.0 112.363 -177.068 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 25.3 ttpp -76.43 -43.66 39.19 Favored 'General case' 0 CA--C 1.539 0.55 0 C-N-CA 123.122 0.569 . . . . 0.0 110.469 175.524 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 15.1 t -99.94 -9.6 22.61 Favored 'General case' 0 CA--C 1.558 1.286 0 C-N-CA 123.848 0.859 . . . . 0.0 113.092 -171.304 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -87.79 160.02 18.2 Favored 'General case' 0 N--CA 1.484 1.25 0 C-N-CA 123.257 0.623 . . . . 0.0 110.553 179.544 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 50.4 t30 -110.16 129.99 55.62 Favored 'General case' 0 N--CA 1.48 1.066 0 C-N-CA 124.3 1.04 . . . . 0.0 109.321 -175.822 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . 0.751 ' HD3' ' HG2' ' A' ' 41' ' ' LYS . 22.7 tptp -59.48 -40.23 86.29 Favored 'General case' 0 N--CA 1.492 1.652 0 C-N-CA 123.977 0.911 . . . . 0.0 112.165 -169.932 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 3.5 p30 -74.74 -29.02 61.02 Favored 'General case' 0 N--CA 1.484 1.257 0 O-C-N 123.227 0.329 . . . . 0.0 111.05 -177.347 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 27.7 t60 -73.47 -28.74 62.11 Favored 'General case' 0 CA--C 1.549 0.935 0 C-N-CA 123.005 0.522 . . . . 0.0 110.062 173.341 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 83.1 mt -65.47 -32.84 74.67 Favored 'General case' 0 N--CA 1.49 1.547 0 C-N-CA 122.918 0.487 . . . . 0.0 110.596 175.147 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 79' ' ' VAL . . . . . 0.518 HG21 ' HB3' ' A' ' 34' ' ' LEU . 40.8 t -62.18 -47.94 90.75 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.139 0 C-N-CA 124.193 0.997 . . . . 0.0 109.658 172.718 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 16.0 m -64.53 -48.13 76.22 Favored 'General case' 0 N--CA 1.47 0.548 0 CA-C-N 114.176 -1.374 . . . . 0.0 111.841 -175.785 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -67.55 -34.02 76.22 Favored 'General case' 0 N--CA 1.477 0.923 0 C-N-CA 123.766 0.826 . . . . 0.0 111.176 -177.601 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 82' ' ' TYR . . . . . 0.461 ' HA ' HD23 ' A' ' 48' ' ' LEU . 81.4 t80 -60.19 -54.95 39.72 Favored 'General case' 0 N--CA 1.469 0.519 0 C-N-CA 124.487 1.115 . . . . 0.0 110.669 177.788 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 83' ' ' ASN . . . . . . . . . . . . . 90.6 m-20 -69.77 -31.11 68.88 Favored 'General case' 0 CA--C 1.54 0.565 0 CA-C-N 114.847 -1.069 . . . . 0.0 110.574 -178.021 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 2.8 m-70 -70.32 -28.44 65.16 Favored 'General case' 0 N--CA 1.485 1.282 0 C-N-CA 123.576 0.75 . . . . 0.0 111.607 174.734 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 44.9 tp -60.29 -53.26 59.72 Favored 'General case' 0 N--CA 1.478 0.968 0 CA-C-O 121.739 0.781 . . . . 0.0 109.911 -178.724 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 86' ' ' PHE . . . . . 0.448 ' HA ' ' HE2' ' A' ' 91' ' ' PHE . 6.3 m-85 -75.48 -31.4 60.22 Favored 'General case' 0 CA--C 1.549 0.935 0 CA-C-N 113.771 -1.559 . . . . 0.0 111.079 -175.42 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 10.4 tp10 -69.16 -40.49 78.15 Favored 'General case' 0 N--CA 1.482 1.158 0 C-N-CA 124.103 0.961 . . . . 0.0 111.719 -173.436 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 37.0 p -109.56 2.8 20.61 Favored 'General case' 0 N--CA 1.484 1.256 0 C-N-CA 123.28 0.632 . . . . 0.0 111.689 -178.622 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 89' ' ' LYS . . . . . 0.44 ' HA ' ' CE2' ' A' ' 91' ' ' PHE . 48.7 mtpt 59.34 44.7 14.94 Favored 'General case' 0 N--CA 1.478 0.949 0 C-N-CA 124.391 1.076 . . . . 0.0 112.225 179.843 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 90' ' ' ARG . . . . . 0.483 HH11 ' HD1' ' A' ' 56' ' ' PHE . 20.5 mtt180 -67.94 -7.39 28.16 Favored 'General case' 0 N--CA 1.486 1.355 0 C-N-CA 124.426 1.09 . . . . 0.0 113.266 178.547 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 91' ' ' PHE . . . . . 0.448 ' HE2' ' HA ' ' A' ' 86' ' ' PHE . 36.7 p90 -77.67 161.91 27.41 Favored 'General case' 0 CA--C 1.541 0.603 0 C-N-CA 124.118 0.967 . . . . 0.0 111.651 171.622 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 61.7 tttm . . . . . 0 C--O 1.25 1.112 0 C-N-CA 124.177 0.991 . . . . 0.0 109.581 178.178 . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 20' ' ' MET . . . . . . . . . . . . . 26.6 ptt? . . . . . 0 N--CA 1.486 1.367 0 CA-C-O 120.969 0.414 . . . . 0.0 110.958 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -128.35 141.92 51.28 Favored 'General case' 0 N--CA 1.476 0.851 0 N-CA-C 108.463 -0.94 . . . . 0.0 108.463 172.3 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -76.39 80.15 3.12 Favored 'General case' 0 C--O 1.243 0.719 0 CA-C-O 121.168 0.509 . . . . 0.0 109.664 177.721 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -80.05 76.05 6.79 Favored 'General case' 0 C--O 1.24 0.563 0 CA-C-N 115.446 -0.797 . . . . 0.0 109.098 179.987 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 29.3 m -73.49 149.59 88.75 Favored Pre-proline 0 CA--C 1.543 0.698 0 CA-C-N 114.924 -1.035 . . . . 0.0 109.866 -175.771 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 25' ' ' PRO . . . . . 0.566 ' HG3' ' HB3' ' A' ' 51' ' ' HIS . 9.2 Cg_exo -67.01 102.84 0.68 Allowed 'Trans proline' 0 C--N 1.377 2.034 0 C-N-CA 122.794 2.33 . . . . 0.0 112.024 -171.313 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 15.2 mm-40 -71.92 104.44 3.5 Favored 'General case' 0 C--O 1.241 0.621 0 N-CA-C 106.642 -1.614 . . . . 0.0 106.642 172.621 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 9.8 ptp85 -55.16 141.35 35.27 Favored 'General case' 0 CA--C 1.544 0.75 0 O-C-N 123.79 0.682 . . . . 0.0 111.132 -174.855 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -95.78 -15.85 22.29 Favored 'General case' 0 N--CA 1.476 0.871 0 C-N-CA 123.185 0.594 . . . . 0.0 110.936 -176.237 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 29' ' ' TRP . . . . . . . . . . . . . 8.5 m-90 -142.94 157.78 44.24 Favored 'General case' 0 N--CA 1.482 1.155 0 C-N-CA 123.983 0.913 . . . . 0.0 109.879 -174.623 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 11.9 m -82.49 161.71 22.29 Favored 'General case' 0 CA--C 1.549 0.928 0 N-CA-C 108.065 -1.087 . . . . 0.0 108.065 168.495 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . 0.534 ' HA ' HD11 ' A' ' 34' ' ' LEU . 4.6 p -52.92 -39.64 32.91 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.399 0 C-N-CA 123.924 0.89 . . . . 0.0 111.796 -179.757 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 11.4 pt-20 -66.39 -43.21 86.49 Favored 'General case' 0 N--CA 1.479 1.022 0 C-N-CA 124.716 1.206 . . . . 0.0 111.263 177.483 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 48.1 mt-30 -64.7 -32.68 74.46 Favored 'General case' 0 N--CA 1.477 0.923 0 C-N-CA 123.525 0.73 . . . . 0.0 110.935 -179.038 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . 0.534 HD11 ' HA ' ' A' ' 31' ' ' VAL . 51.6 mt -66.36 -50.35 63.83 Favored 'General case' 0 N--CA 1.47 0.548 0 O-C-N 124.112 0.883 . . . . 0.0 110.965 176.012 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 29.8 mtp180 -68.72 -18.99 64.34 Favored 'General case' 0 N--CA 1.475 0.795 0 C-N-CA 124.38 1.072 . . . . 0.0 111.665 -178.139 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 46.6 t -60.34 123.85 18.52 Favored 'General case' 0 CA--C 1.544 0.742 0 O-C-N 123.657 0.598 . . . . 0.0 110.251 176.162 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -55.53 -28.94 57.76 Favored 'General case' 0 CA--C 1.549 0.935 0 C-N-CA 125.057 1.343 . . . . 0.0 112.981 -177.056 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 91.3 mt-30 -65.17 -34.97 79.66 Favored 'General case' 0 N--CA 1.48 1.041 0 C-N-CA 123.927 0.891 . . . . 0.0 112.362 -177.774 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . 0.443 HD21 ' HD2' ' A' ' 40' ' ' PRO . 1.2 tt -69.2 123.09 87.53 Favored Pre-proline 0 N--CA 1.488 1.433 0 N-CA-C 109.154 -0.684 . . . . 0.0 109.154 -178.904 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 40' ' ' PRO . . . . . 0.455 ' HB2' ' HG2' ' A' ' 42' ' ' LYS . 35.1 Cg_endo -62.82 128.95 24.57 Favored 'Trans proline' 0 C--N 1.37 1.709 0 C-N-CA 122.149 1.899 . . . . 0.0 112.02 173.278 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 35.9 mtmm -56.71 -36.7 69.98 Favored 'General case' 0 N--CA 1.483 1.186 0 C-N-CA 123.922 0.889 . . . . 0.0 111.671 178.603 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . 0.455 ' HG2' ' HB2' ' A' ' 40' ' ' PRO . 19.2 ptpt -58.9 -34.39 71.62 Favored 'General case' 0 N--CA 1.474 0.772 0 C-N-CA 124.015 0.926 . . . . 0.0 111.6 -177.856 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 3.4 t70 -73.47 -36.22 65.81 Favored 'General case' 0 CA--C 1.54 0.594 0 CA-C-N 115.457 -0.792 . . . . 0.0 109.707 -176.415 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 44' ' ' ILE . . . . . 0.4 ' HB ' HD12 ' A' ' 78' ' ' LEU . 38.1 mt -68.61 -46.79 79.4 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.927 0 CA-C-N 115.742 -0.663 . . . . 0.0 110.023 177.702 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 74.7 mt -55.52 -42.82 69.92 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.593 0 C-N-CA 123.754 0.821 . . . . 0.0 110.495 174.88 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 38.2 ttpt -59.24 -36.43 75.44 Favored 'General case' 0 CA--C 1.55 0.945 0 C-N-CA 124.516 1.126 . . . . 0.0 111.178 179.154 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 18.7 t80 -69.69 -47.72 62.2 Favored 'General case' 0 N--CA 1.48 1.057 0 CA-C-N 115.634 -0.712 . . . . 0.0 111.027 176.272 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 90.5 mt -71.82 -32.79 67.92 Favored 'General case' 0 N--CA 1.476 0.851 0 C-N-CA 123.935 0.894 . . . . 0.0 112.885 -171.588 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . 0.41 ' HA ' HD21 ' A' ' 57' ' ' LEU . 3.5 pt20 -82.44 -27.95 31.61 Favored 'General case' 0 N--CA 1.484 1.264 0 CA-C-N 117.747 0.249 . . . . 0.0 111.231 -179.989 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 9.9 tp10 -69.69 -33.66 72.86 Favored 'General case' 0 N--CA 1.475 0.79 0 C-N-CA 123.353 0.661 . . . . 0.0 110.797 -179.402 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 51' ' ' HIS . . . . . 0.566 ' HB3' ' HG3' ' A' ' 25' ' ' PRO . 66.2 m80 -112.06 -43.15 3.61 Favored 'General case' 0 N--CA 1.474 0.756 0 CA-C-N 115.309 -0.86 . . . . 0.0 112.381 -171.182 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . 0.416 ' HA2' ' HA ' ' A' ' 91' ' ' PHE . . . -65.41 132.74 35.64 Favored Glycine 0 N--CA 1.47 0.923 0 CA-C-O 119.346 -0.696 . . . . 0.0 111.899 171.976 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 20.1 t -80.28 168.52 18.95 Favored 'General case' 0 N--CA 1.48 1.073 0 CA-C-N 117.342 0.571 . . . . 0.0 110.165 -178.074 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 6.2 p-10 -58.87 -34.61 71.8 Favored 'General case' 0 N--CA 1.488 1.463 0 C-N-CA 124.345 1.058 . . . . 0.0 113.661 -169.313 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 23.1 m -72.93 -24.99 60.88 Favored 'General case' 0 N--CA 1.484 1.249 0 C-N-CA 122.748 0.419 . . . . 0.0 111.733 -179.421 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 56' ' ' PHE . . . . . 0.462 ' HB2' ' HB3' ' A' ' 90' ' ' ARG . 63.9 t80 -75.68 -49.93 16.89 Favored 'General case' 0 C--O 1.241 0.641 0 C-N-CA 123.445 0.698 . . . . 0.0 109.264 169.002 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . 0.41 HD21 ' HA ' ' A' ' 49' ' ' GLN . 62.0 mt -59.72 -50.64 73.04 Favored 'General case' 0 C--O 1.211 -0.938 0 CA-C-N 114.879 -1.055 . . . . 0.0 112.068 -168.892 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -60.42 -38.64 84.7 Favored 'General case' 0 N--CA 1.482 1.169 0 C-N-CA 123.497 0.719 . . . . 0.0 112.215 -175.403 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 12.3 mm-40 -67.27 -23.25 65.66 Favored 'General case' 0 N--CA 1.478 0.939 0 C-N-CA 123.176 0.59 . . . . 0.0 112.114 179.297 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 88.1 m-70 -115.99 7.28 14.31 Favored 'General case' 0 N--CA 1.484 1.274 0 C-N-CA 123.554 0.742 . . . . 0.0 111.332 176.275 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 48.3 mtpt 47.33 44.81 16.49 Favored 'General case' 0 N--CA 1.488 1.472 0 C-N-CA 125.119 1.368 . . . . 0.0 112.948 -178.934 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 66.8 mt -94.04 -11.42 30.76 Favored 'General case' 0 N--CA 1.478 0.951 0 C-N-CA 124.04 0.936 . . . . 0.0 111.931 -179.07 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 1.4 pp -79.44 -178.06 6.09 Favored 'General case' 0 N--CA 1.484 1.254 0 CA-C-O 121.357 0.598 . . . . 0.0 111.793 178.762 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 77.35 -142.44 27.14 Favored Glycine 0 C--N 1.341 0.828 0 CA-C-N 114.827 -1.078 . . . . 0.0 112.17 177.557 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 79.3 m-20 -82.04 131.06 35.24 Favored 'General case' 0 N--CA 1.469 0.481 0 N-CA-C 109.173 -0.677 . . . . 0.0 109.173 177.866 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 69.8 mt -57.49 -40.47 74.85 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.055 0 C-N-CA 123.478 0.711 . . . . 0.0 110.568 179.519 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 38.8 mtmm -55.19 -48.22 74.14 Favored 'General case' 0 N--CA 1.485 1.285 0 C-N-CA 123.332 0.653 . . . . 0.0 111.69 177.01 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 3.3 m-20 -54.46 -41.71 69.79 Favored 'General case' 0 N--CA 1.49 1.558 0 C-N-CA 123.742 0.817 . . . . 0.0 111.606 177.905 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 22.3 t -73.07 -38.77 56.16 Favored 'Isoleucine or valine' 0 CA--C 1.551 0.996 0 CA-C-N 115.648 -0.705 . . . . 0.0 110.454 179.396 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -73.78 -26.46 60.65 Favored 'General case' 0 N--CA 1.488 1.432 0 C-N-CA 123.485 0.714 . . . . 0.0 112.592 -173.254 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 22.4 ptmt -81.88 -18.66 43.0 Favored 'General case' 0 N--CA 1.485 1.293 0 C-N-CA 122.704 0.402 . . . . 0.0 111.817 -176.232 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 9.5 t -118.42 -34.8 3.94 Favored 'General case' 0 N--CA 1.484 1.234 0 C-N-CA 123.146 0.578 . . . . 0.0 111.754 -174.56 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . 0.441 ' HB1' ' ND1' ' A' ' 77' ' ' HIS . . . -98.35 141.25 31.47 Favored 'General case' 0 N--CA 1.471 0.586 0 C-N-CA 123.455 0.702 . . . . 0.0 110.219 -174.332 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 74' ' ' ASN . . . . . 0.435 ' ND2' ' HB3' ' A' ' 76' ' ' ASP . 26.9 p-10 -97.25 175.5 6.25 Favored 'General case' 0 N--CA 1.474 0.761 0 C-N-CA 123.603 0.761 . . . . 0.0 111.014 -176.043 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . 0.44 ' O ' HG23 ' A' ' 79' ' ' VAL . 32.0 ttmt -70.06 -38.82 75.88 Favored 'General case' 0 CA--C 1.541 0.602 0 C-N-CA 123.958 0.903 . . . . 0.0 111.269 -177.357 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 76' ' ' ASP . . . . . 0.435 ' HB3' ' ND2' ' A' ' 74' ' ' ASN . 24.0 t70 -58.77 -37.14 75.63 Favored 'General case' 0 N--CA 1.488 1.467 0 C-N-CA 123.577 0.751 . . . . 0.0 110.929 179.022 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 77' ' ' HIS . . . . . 0.441 ' ND1' ' HB1' ' A' ' 73' ' ' ALA . 4.1 t-80 -59.09 -47.56 84.81 Favored 'General case' 0 N--CA 1.476 0.86 0 C-N-CA 124.543 1.137 . . . . 0.0 110.818 173.262 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . 0.4 HD12 ' HB ' ' A' ' 44' ' ' ILE . 70.7 mt -65.68 -41.33 92.56 Favored 'General case' 0 N--CA 1.477 0.898 0 C-N-CA 123.372 0.669 . . . . 0.0 111.58 -172.268 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 79' ' ' VAL . . . . . 0.532 HG21 ' HB3' ' A' ' 34' ' ' LEU . 45.7 t -67.14 -44.71 87.75 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.697 0 C-N-CA 123.985 0.914 . . . . 0.0 110.552 -179.243 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 99.6 m -59.33 -50.01 75.62 Favored 'General case' 0 N--CA 1.477 0.876 0 C-N-CA 123.535 0.734 . . . . 0.0 110.924 176.185 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -62.35 -38.02 87.91 Favored 'General case' 0 N--CA 1.477 0.895 0 C-N-CA 123.545 0.738 . . . . 0.0 111.028 179.618 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 82' ' ' TYR . . . . . 0.412 ' O ' ' HB3' ' A' ' 85' ' ' LEU . 7.6 t80 -56.31 -54.16 48.75 Favored 'General case' 0 N--CA 1.476 0.854 0 C-N-CA 124.867 1.267 . . . . 0.0 111.614 177.67 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 83' ' ' ASN . . . . . . . . . . . . . 64.7 m-80 -66.14 -45.71 80.07 Favored 'General case' 0 N--CA 1.483 1.182 0 C-N-CA 122.849 0.46 . . . . 0.0 110.524 -176.953 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 15.2 m-70 -64.58 -26.16 68.29 Favored 'General case' 0 N--CA 1.481 1.097 0 C-N-CA 124.096 0.958 . . . . 0.0 111.295 -179.35 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 85' ' ' LEU . . . . . 0.413 HD11 ' HB3' ' A' ' 91' ' ' PHE . 25.2 tp -58.18 -54.28 48.72 Favored 'General case' 0 N--CA 1.481 1.109 0 C-N-CA 123.679 0.792 . . . . 0.0 110.724 176.59 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 86' ' ' PHE . . . . . 0.401 ' HA ' ' HE2' ' A' ' 91' ' ' PHE . 8.8 m-85 -74.87 -30.59 61.37 Favored 'General case' 0 CA--C 1.544 0.713 0 CA-C-N 113.539 -1.664 . . . . 0.0 111.0 -176.873 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 10.9 tp10 -67.69 -32.5 73.2 Favored 'General case' 0 N--CA 1.475 0.811 0 C-N-CA 124.144 0.978 . . . . 0.0 111.476 -174.436 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 43.3 p -113.94 -9.07 13.07 Favored 'General case' 0 N--CA 1.477 0.923 0 C-N-CA 123.972 0.909 . . . . 0.0 110.982 179.806 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 52.6 mtpt 62.93 41.1 8.82 Favored 'General case' 0 N--CA 1.481 1.081 0 C-N-CA 124.492 1.117 . . . . 0.0 112.415 174.338 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 90' ' ' ARG . . . . . 0.462 ' HB3' ' HB2' ' A' ' 56' ' ' PHE . 54.2 mtt180 -76.82 -5.81 49.79 Favored 'General case' 0 N--CA 1.487 1.423 0 C-N-CA 124.189 0.996 . . . . 0.0 112.735 -178.893 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 91' ' ' PHE . . . . . 0.416 ' HA ' ' HA2' ' A' ' 52' ' ' GLY . 5.5 p90 -61.9 150.8 36.52 Favored 'General case' 0 N--CA 1.472 0.664 0 C-N-CA 123.041 0.536 . . . . 0.0 112.309 175.475 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 86.2 tttt . . . . . 0 CA--C 1.549 0.914 0 CA-C-N 114.819 -1.082 . . . . 0.0 109.631 -179.155 . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 20' ' ' MET . . . . . . . . . . . . . 26.2 ptt? . . . . . 0 N--CA 1.478 0.964 0 N-CA-C 110.017 -0.364 . . . . 0.0 110.017 . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -77.51 77.96 4.03 Favored 'General case' 0 C--O 1.245 0.82 0 C-N-CA 123.13 0.572 . . . . 0.0 109.681 177.869 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -170.88 76.73 0.07 Allowed 'General case' 0 N--CA 1.469 0.523 0 C-N-CA 124.52 1.128 . . . . 0.0 108.624 -175.975 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -70.7 94.07 0.99 Allowed 'General case' 0 N--CA 1.473 0.719 0 C-N-CA 123.663 0.785 . . . . 0.0 109.695 179.664 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 34.6 m -66.96 128.31 93.83 Favored Pre-proline 0 CA--C 1.553 1.077 0 C-N-CA 123.036 0.534 . . . . 0.0 110.53 -175.879 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 31.5 Cg_endo -68.71 99.91 0.67 Allowed 'Trans proline' 0 C--N 1.369 1.648 0 C-N-CA 121.834 1.689 . . . . 0.0 110.688 170.108 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 25.8 pt20 -73.08 -179.89 3.48 Favored 'General case' 0 C--O 1.239 0.536 0 CA-C-N 114.216 -1.356 . . . . 0.0 109.144 170.209 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -51.34 137.11 23.91 Favored 'General case' 0 N--CA 1.475 0.785 0 C-N-CA 123.304 0.642 . . . . 0.0 112.566 -177.808 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -89.68 -29.51 18.73 Favored 'General case' 0 CA--C 1.544 0.748 0 CA-C-N 115.888 -0.597 . . . . 0.0 109.423 174.125 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 29' ' ' TRP . . . . . . . . . . . . . 6.8 m-90 -141.12 160.59 39.76 Favored 'General case' 0 N--CA 1.487 1.418 0 C-N-CA 124.301 1.041 . . . . 0.0 110.018 -177.925 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 74.5 p -88.44 170.23 11.09 Favored 'General case' 0 N--CA 1.472 0.643 0 C-N-CA 123.172 0.589 . . . . 0.0 109.463 175.261 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . 0.488 ' HA ' HD11 ' A' ' 34' ' ' LEU . 14.5 p -62.22 -37.15 77.84 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.416 0 C-N-CA 123.154 0.582 . . . . 0.0 111.817 -173.143 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 9.9 pt-20 -70.32 -34.04 72.22 Favored 'General case' 0 N--CA 1.479 0.98 0 C-N-CA 124.167 0.987 . . . . 0.0 111.304 177.682 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 16.0 mm100 -70.82 -36.17 72.82 Favored 'General case' 0 N--CA 1.475 0.785 0 C-N-CA 122.809 0.444 . . . . 0.0 110.701 173.385 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . 0.542 ' HA ' HD21 ' A' ' 39' ' ' LEU . 92.1 mt -66.07 -53.58 36.53 Favored 'General case' 0 N--CA 1.475 0.792 0 C-N-CA 123.195 0.598 . . . . 0.0 110.614 -177.383 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 9.7 ptp180 -66.35 -21.19 66.24 Favored 'General case' 0 N--CA 1.477 0.879 0 CA-C-N 115.071 -0.968 . . . . 0.0 111.742 -174.323 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 42.0 t -57.11 126.78 28.76 Favored 'General case' 0 C--N 1.354 0.766 0 C-N-CA 123.941 0.897 . . . . 0.0 110.84 176.372 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 16.4 mp0 -63.91 -32.92 74.61 Favored 'General case' 0 CA--C 1.544 0.741 0 C-N-CA 123.339 0.655 . . . . 0.0 110.864 -179.616 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 1.8 mp0 -78.2 0.65 24.26 Favored 'General case' 0 N--CA 1.478 0.959 0 C-N-CA 123.597 0.759 . . . . 0.0 112.318 179.237 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . 0.542 HD21 ' HA ' ' A' ' 34' ' ' LEU . 62.4 tp -97.96 111.22 58.64 Favored Pre-proline 0 C--O 1.248 0.996 0 N-CA-C 106.5 -1.667 . . . . 0.0 106.5 158.58 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 32.5 Cg_exo -58.02 135.48 68.92 Favored 'Trans proline' 0 C--N 1.382 2.303 0 C-N-CA 122.662 2.241 . . . . 0.0 112.459 -178.981 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . 0.542 ' HG2' ' HE3' ' A' ' 75' ' ' LYS . 53.7 mtpt -56.71 -37.57 71.12 Favored 'General case' 0 N--CA 1.476 0.861 0 C-N-CA 124.885 1.274 . . . . 0.0 111.372 179.675 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 18.1 ptpt -63.31 -32.16 73.5 Favored 'General case' 0 C--O 1.217 -0.622 0 O-C-N 124.117 0.886 . . . . 0.0 112.08 -178.2 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 2.5 m-20 -65.32 -41.17 94.26 Favored 'General case' 0 N--CA 1.487 1.376 0 CA-C-O 120.782 0.325 . . . . 0.0 110.868 176.187 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 57.7 mt -69.16 -50.48 52.5 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.887 0 C-N-CA 123.468 0.707 . . . . 0.0 110.34 -178.835 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 75.8 mt -62.02 -38.5 80.93 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.062 0 C-N-CA 123.513 0.725 . . . . 0.0 110.867 179.495 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -58.09 -50.34 73.8 Favored 'General case' 0 N--CA 1.482 1.141 0 N-CA-C 108.86 -0.793 . . . . 0.0 108.86 175.63 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 27.7 t80 -58.65 -51.92 67.86 Favored 'General case' 0 CA--C 1.548 0.866 0 O-C-N 124.515 1.135 . . . . 0.0 111.069 -178.813 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 92.6 mt -69.62 -30.55 68.3 Favored 'General case' 0 N--CA 1.475 0.803 0 C-N-CA 123.822 0.849 . . . . 0.0 112.203 -173.826 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 2.9 pt20 -82.07 -26.11 33.96 Favored 'General case' 0 N--CA 1.484 1.258 0 C-N-CA 122.384 0.273 . . . . 0.0 110.629 177.174 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 43.1 tt0 -68.71 -22.47 64.34 Favored 'General case' 0 N--CA 1.484 1.243 0 C-N-CA 124.07 0.948 . . . . 0.0 111.811 -177.69 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 56.5 p-80 -127.79 -26.53 2.93 Favored 'General case' 0 N--CA 1.487 1.406 0 N-CA-C 112.635 0.606 . . . . 0.0 112.635 178.013 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -66.57 138.82 36.26 Favored Glycine 0 C--N 1.344 1.007 0 CA-C-O 119.506 -0.608 . . . . 0.0 112.715 178.924 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 53' ' ' SER . . . . . 0.438 ' O ' ' HG ' ' A' ' 57' ' ' LEU . 47.4 t -65.77 147.25 53.68 Favored 'General case' 0 N--CA 1.478 0.933 0 N-CA-C 109.677 -0.49 . . . . 0.0 109.677 178.515 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 8.8 p-10 -61.58 -28.18 69.16 Favored 'General case' 0 N--CA 1.485 1.303 0 C-N-CA 123.529 0.732 . . . . 0.0 111.937 -174.872 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 42.0 p -62.85 -44.13 96.96 Favored 'General case' 0 CA--C 1.552 1.05 0 C-N-CA 124.371 1.068 . . . . 0.0 111.141 174.836 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 67.2 t80 -64.27 -45.78 86.58 Favored 'General case' 0 N--CA 1.482 1.146 0 C-N-CA 124.277 1.031 . . . . 0.0 109.733 174.185 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . 0.438 ' HG ' ' O ' ' A' ' 53' ' ' SER . 75.7 mt -63.6 -29.7 70.91 Favored 'General case' 0 C--O 1.214 -0.775 0 CA-C-N 114.415 -1.266 . . . . 0.0 111.161 -176.073 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -71.34 -47.96 53.27 Favored 'General case' 0 N--CA 1.475 0.788 0 C-N-CA 123.237 0.615 . . . . 0.0 110.884 176.189 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 41.0 mt-10 -58.35 -36.12 72.97 Favored 'General case' 0 N--CA 1.491 1.583 0 C-N-CA 123.907 0.883 . . . . 0.0 111.661 178.082 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 41.2 m-70 -107.42 -2.05 20.9 Favored 'General case' 0 N--CA 1.486 1.339 0 C-N-CA 123.465 0.706 . . . . 0.0 112.062 -174.454 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 95.8 mttt 54.33 38.61 29.77 Favored 'General case' 0 N--CA 1.492 1.648 0 C-N-CA 124.678 1.191 . . . . 0.0 112.775 -179.935 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 85.9 mt -88.26 -8.89 54.53 Favored 'General case' 0 N--CA 1.479 0.986 0 C-N-CA 123.15 0.58 . . . . 0.0 111.164 176.653 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -80.17 166.78 21.12 Favored 'General case' 0 N--CA 1.485 1.318 0 CA-C-O 120.917 0.389 . . . . 0.0 111.168 174.632 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 92.63 -168.76 30.8 Favored Glycine 0 C--N 1.34 0.799 0 CA-C-N 115.22 -0.9 . . . . 0.0 112.155 -179.477 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 16.0 m120 -60.79 120.43 10.11 Favored 'General case' 0 N--CA 1.472 0.626 0 C-N-CA 123.232 0.613 . . . . 0.0 109.668 179.306 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 26.9 mt -61.33 -47.9 91.36 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.766 0 C-N-CA 124.039 0.936 . . . . 0.0 111.65 -167.069 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.66 -31.85 72.8 Favored 'General case' 0 N--CA 1.487 1.4 0 C-N-CA 123.748 0.819 . . . . 0.0 111.369 177.615 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 6.0 t30 -69.89 -36.43 75.43 Favored 'General case' 0 N--CA 1.483 1.22 0 C-N-CA 124.429 1.092 . . . . 0.0 110.609 178.396 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 47.7 t -73.06 -34.98 46.97 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.925 0 CA-C-N 115.83 -0.623 . . . . 0.0 109.502 172.274 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -73.44 -6.7 47.99 Favored 'General case' 0 N--CA 1.477 0.922 0 C-N-CA 124.207 1.003 . . . . 0.0 113.062 -174.538 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 22.3 ptmt -97.5 -26.66 14.75 Favored 'General case' 0 N--CA 1.48 1.052 0 CA-C-N 118.507 0.594 . . . . 0.0 112.271 173.454 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 8.8 t -112.08 -36.72 5.27 Favored 'General case' 0 N--CA 1.484 1.236 0 N-CA-C 112.787 0.662 . . . . 0.0 112.787 -166.734 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -91.2 102.46 15.18 Favored 'General case' 0 N--CA 1.472 0.661 0 N-CA-C 107.927 -1.138 . . . . 0.0 107.927 177.558 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 74' ' ' ASN . . . . . 0.437 ' O ' ' HG ' ' A' ' 78' ' ' LEU . 9.4 p30 -65.96 167.67 9.35 Favored 'General case' 0 N--CA 1.486 1.35 0 C-N-CA 123.863 0.865 . . . . 0.0 112.093 -169.687 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . 0.542 ' HE3' ' HG2' ' A' ' 41' ' ' LYS . 4.7 tppp? -63.08 -41.32 99.39 Favored 'General case' 0 CA--C 1.55 0.965 0 C-N-CA 122.9 0.48 . . . . 0.0 112.257 -174.014 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 19.1 t70 -60.38 -36.92 79.18 Favored 'General case' 0 N--CA 1.492 1.674 0 C-N-CA 123.52 0.728 . . . . 0.0 110.817 178.561 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 77' ' ' HIS . . . . . 0.403 ' HB3' ' O ' ' A' ' 74' ' ' ASN . 29.9 t60 -63.78 -39.73 94.95 Favored 'General case' 0 N--CA 1.479 0.983 0 C-N-CA 125.257 1.423 . . . . 0.0 110.466 175.206 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . 0.437 ' HG ' ' O ' ' A' ' 74' ' ' ASN . 40.9 mt -70.42 -38.89 74.66 Favored 'General case' 0 N--CA 1.487 1.417 0 C-N-CA 123.427 0.691 . . . . 0.0 111.91 -177.742 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 69.1 t -64.52 -46.09 93.7 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.904 0 C-N-CA 123.994 0.918 . . . . 0.0 110.27 179.526 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 51.1 m -62.14 -42.63 99.43 Favored 'General case' 0 N--CA 1.479 0.986 0 C-N-CA 123.418 0.687 . . . . 0.0 111.259 177.497 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -62.74 -43.4 98.9 Favored 'General case' 0 N--CA 1.477 0.882 0 C-N-CA 123.585 0.754 . . . . 0.0 110.837 177.676 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 82' ' ' TYR . . . . . . . . . . . . . 17.4 t80 -52.92 -57.9 8.74 Favored 'General case' 0 N--CA 1.473 0.691 0 C-N-CA 124.754 1.221 . . . . 0.0 110.519 178.751 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 83' ' ' ASN . . . . . . . . . . . . . 52.9 m-80 -64.9 -43.9 91.33 Favored 'General case' 0 N--CA 1.481 1.092 0 N-CA-C 112.429 0.529 . . . . 0.0 112.429 -171.067 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 88.6 m-70 -70.88 -24.42 62.49 Favored 'General case' 0 N--CA 1.48 1.062 0 C-N-CA 123.687 0.795 . . . . 0.0 112.083 -178.397 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 17.3 tp -58.76 -53.45 58.19 Favored 'General case' 0 N--CA 1.485 1.279 0 CA-C-O 121.903 0.858 . . . . 0.0 110.888 175.859 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 86' ' ' PHE . . . . . 0.415 ' HA ' ' HE2' ' A' ' 91' ' ' PHE . 56.7 m-85 -72.81 -36.35 67.52 Favored 'General case' 0 C--O 1.234 0.261 0 CA-C-N 113.937 -1.483 . . . . 0.0 110.87 -178.419 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 40.2 tt0 -59.33 -48.85 80.09 Favored 'General case' 0 N--CA 1.473 0.692 0 O-C-N 124.008 0.817 . . . . 0.0 112.202 -171.835 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 19.0 p -109.99 16.32 21.98 Favored 'General case' 0 N--CA 1.475 0.808 0 C-N-CA 123.241 0.616 . . . . 0.0 111.542 -178.897 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 47.3 mmtm 57.61 37.66 27.55 Favored 'General case' 0 N--CA 1.488 1.447 0 C-N-CA 123.95 0.9 . . . . 0.0 111.98 170.743 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 52.6 mtt-85 -70.79 -8.32 51.54 Favored 'General case' 0 N--CA 1.482 1.136 0 C-N-CA 124.126 0.97 . . . . 0.0 112.78 -176.621 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 91' ' ' PHE . . . . . 0.415 ' HE2' ' HA ' ' A' ' 86' ' ' PHE . 13.9 p90 -76.98 157.19 31.39 Favored 'General case' 0 N--CA 1.469 0.491 0 C-N-CA 123.139 0.576 . . . . 0.0 111.499 173.747 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 11.7 tmtt? . . . . . 0 CA--C 1.544 0.733 0 N-CA-C 107.062 -1.458 . . . . 0.0 107.062 -179.502 . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 20' ' ' MET . . . . . . . . . . . . . 28.2 ttt . . . . . 0 N--CA 1.482 1.155 0 N-CA-C 108.283 -1.006 . . . . 0.0 108.283 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -58.57 122.31 13.11 Favored 'General case' 0 N--CA 1.481 1.091 0 C-N-CA 124.173 0.989 . . . . 0.0 111.485 -172.79 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . 73.18 -59.02 0.58 Allowed 'General case' 0 N--CA 1.475 0.778 0 C-N-CA 125.944 1.698 . . . . 0.0 112.112 -176.259 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -75.08 80.02 2.24 Favored 'General case' 0 CA--C 1.543 0.7 0 C-N-CA 123.812 0.845 . . . . 0.0 111.955 -175.926 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 28.5 m -119.9 153.62 54.99 Favored Pre-proline 0 CA--C 1.543 0.686 0 N-CA-C 107.806 -1.183 . . . . 0.0 107.806 169.767 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 51.2 Cg_exo -55.51 129.95 37.88 Favored 'Trans proline' 0 C--N 1.372 1.8 0 C-N-CA 121.961 1.774 . . . . 0.0 111.869 169.325 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 11.3 pt20 -89.68 -158.82 0.54 Allowed 'General case' 0 N--CA 1.475 0.783 0 N-CA-C 108.051 -1.092 . . . . 0.0 108.051 168.782 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -59.02 153.05 18.51 Favored 'General case' 0 N--CA 1.475 0.804 0 C-N-CA 122.841 0.456 . . . . 0.0 111.572 173.708 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -108.98 -39.47 5.29 Favored 'General case' 0 N--CA 1.476 0.839 0 C-N-CA 123.23 0.612 . . . . 0.0 110.551 179.941 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 29' ' ' TRP . . . . . . . . . . . . . 3.6 m-90 -128.92 144.98 51.34 Favored 'General case' 0 N--CA 1.481 1.079 0 C-N-CA 123.972 0.909 . . . . 0.0 109.023 -176.495 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 20.2 p -83.53 169.6 15.27 Favored 'General case' 0 N--CA 1.474 0.77 0 C-N-CA 122.947 0.499 . . . . 0.0 109.789 -178.519 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . 0.549 ' HA ' HD12 ' A' ' 34' ' ' LEU . 7.4 p -56.98 -34.9 45.76 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.378 0 C-N-CA 122.887 0.475 . . . . 0.0 111.737 -173.844 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 12.9 pt-20 -67.19 -41.18 86.3 Favored 'General case' 0 N--CA 1.474 0.742 0 C-N-CA 123.814 0.846 . . . . 0.0 111.457 177.251 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 12.9 mm-40 -68.9 -35.24 76.62 Favored 'General case' 0 N--CA 1.477 0.902 0 C-N-CA 123.328 0.651 . . . . 0.0 111.266 178.792 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . 0.549 HD12 ' HA ' ' A' ' 31' ' ' VAL . 66.3 mt -65.73 -45.64 81.88 Favored 'General case' 0 N--CA 1.472 0.643 0 O-C-N 123.618 0.573 . . . . 0.0 111.0 -179.693 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 93.0 mtt-85 -79.01 -15.86 57.67 Favored 'General case' 0 CA--C 1.546 0.815 0 CA-C-N 115.419 -0.81 . . . . 0.0 111.352 179.637 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 40.0 t -63.83 138.65 58.57 Favored 'General case' 0 N--CA 1.48 1.057 0 C-N-CA 123.235 0.614 . . . . 0.0 111.414 -179.597 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 12.4 pt-20 -65.65 -18.86 65.63 Favored 'General case' 0 CA--C 1.551 1.014 0 C-N-CA 124.563 1.145 . . . . 0.0 111.97 179.989 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 76.3 mt-30 -73.42 -51.36 17.53 Favored 'General case' 0 CA--C 1.54 0.568 0 C-N-CA 124.116 0.966 . . . . 0.0 111.072 -177.984 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 46.7 tp -70.62 120.43 78.8 Favored Pre-proline 0 N--CA 1.478 0.941 0 CA-C-O 118.702 -0.666 . . . . 0.0 110.399 -176.189 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 24.6 Cg_exo -63.61 138.83 66.65 Favored 'Trans proline' 0 C--N 1.385 2.451 0 C-N-CA 122.747 2.298 . . . . 0.0 112.059 -179.19 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 21.5 ptmt -69.84 -32.36 70.72 Favored 'General case' 0 CA--C 1.537 0.444 0 C-N-CA 123.585 0.754 . . . . 0.0 110.825 -177.335 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 21.6 pttp -70.61 -28.83 65.15 Favored 'General case' 0 N--CA 1.474 0.753 0 C-N-CA 123.527 0.731 . . . . 0.0 110.915 175.994 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 28.0 t70 -69.24 -36.5 77.25 Favored 'General case' 0 N--CA 1.477 0.896 0 C-N-CA 122.543 0.337 . . . . 0.0 110.298 176.194 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 47.8 mt -66.34 -53.57 35.02 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.988 0 C-N-CA 122.878 0.471 . . . . 0.0 109.979 176.551 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 86.7 mt -55.91 -39.98 59.97 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.388 0 C-N-CA 123.959 0.903 . . . . 0.0 111.162 179.746 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 40.1 ttmt -57.49 -45.53 84.78 Favored 'General case' 0 N--CA 1.473 0.694 0 C-N-CA 123.703 0.801 . . . . 0.0 110.891 178.591 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 11.8 t80 -63.73 -48.29 77.63 Favored 'General case' 0 N--CA 1.471 0.606 0 O-C-N 123.897 0.748 . . . . 0.0 110.357 177.843 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 85.3 mt -68.86 -31.19 69.96 Favored 'General case' 0 CA--C 1.544 0.746 0 C-N-CA 123.201 0.6 . . . . 0.0 112.314 -172.742 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 3.2 pt20 -84.61 -36.36 22.07 Favored 'General case' 0 N--CA 1.484 1.25 0 N-CA-C 111.674 0.25 . . . . 0.0 111.674 179.79 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 12.6 tp10 -69.14 -39.17 78.99 Favored 'General case' 0 N--CA 1.481 1.125 0 CA-C-O 121.587 0.708 . . . . 0.0 110.252 179.781 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 3.0 t60 -93.43 -49.85 5.72 Favored 'General case' 0 N--CA 1.47 0.548 0 CA-C-N 114.63 -1.168 . . . . 0.0 110.467 -173.349 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . 0.464 ' HA2' ' HA ' ' A' ' 91' ' ' PHE . . . -65.0 144.9 48.76 Favored Glycine 0 C--N 1.349 1.262 0 O-C-N 123.527 0.517 . . . . 0.0 113.185 173.253 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 34.5 t -89.67 166.45 13.59 Favored 'General case' 0 CA--C 1.55 0.971 0 C-N-CA 123.744 0.817 . . . . 0.0 110.669 -178.494 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 48.7 m-20 -58.0 -36.16 72.26 Favored 'General case' 0 N--CA 1.494 1.757 0 C-N-CA 123.912 0.885 . . . . 0.0 112.978 -169.175 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 40.2 t -64.0 -31.59 72.83 Favored 'General case' 0 N--CA 1.476 0.847 0 C-N-CA 123.605 0.762 . . . . 0.0 111.493 -178.299 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 85.4 t80 -76.21 -45.7 31.85 Favored 'General case' 0 CA--C 1.546 0.825 0 C-N-CA 123.497 0.719 . . . . 0.0 110.282 171.285 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 45.7 mt -65.03 -33.44 76.04 Favored 'General case' 0 N--CA 1.478 0.935 0 CA-C-N 115.175 -0.921 . . . . 0.0 112.845 -169.701 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -68.4 -48.53 64.46 Favored 'General case' 0 N--CA 1.475 0.784 0 C-N-CA 122.62 0.368 . . . . 0.0 110.475 178.739 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 10.0 mm-40 -62.31 -33.5 74.8 Favored 'General case' 0 N--CA 1.476 0.87 0 CA-C-N 115.771 -0.649 . . . . 0.0 111.045 -178.484 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 34.5 m-70 -105.99 4.33 29.29 Favored 'General case' 0 N--CA 1.479 0.99 0 C-N-CA 123.223 0.609 . . . . 0.0 112.297 -178.214 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 46.0 mmtm 56.14 28.2 12.67 Favored 'General case' 0 N--CA 1.498 1.933 0 C-N-CA 124.377 1.071 . . . . 0.0 113.164 174.855 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . 0.479 HD13 ' HB3' ' A' ' 81' ' ' ALA . 92.2 mt -88.43 -8.85 54.3 Favored 'General case' 0 N--CA 1.481 1.094 0 C-N-CA 123.609 0.763 . . . . 0.0 112.061 -178.214 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 1.4 pp -67.48 167.34 12.94 Favored 'General case' 0 N--CA 1.477 0.913 0 C-N-CA 122.92 0.488 . . . . 0.0 111.44 177.727 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 77.01 -154.81 43.62 Favored Glycine 0 C--N 1.338 0.674 0 CA-C-N 115.653 -0.703 . . . . 0.0 113.623 174.695 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 65' ' ' ASN . . . . . 0.405 ' O ' HG22 ' A' ' 69' ' ' VAL . 15.9 m120 -64.57 124.66 22.44 Favored 'General case' 0 N--CA 1.472 0.658 0 C-N-CA 123.698 0.799 . . . . 0.0 110.609 -176.952 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 49.7 mt -58.03 -45.83 88.1 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.974 0 C-N-CA 124.127 0.971 . . . . 0.0 110.546 -179.327 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 17.7 mtpp -51.46 -46.02 62.94 Favored 'General case' 0 N--CA 1.482 1.175 0 C-N-CA 124.642 1.177 . . . . 0.0 111.714 174.714 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 68' ' ' ASN . . . . . 0.431 ' O ' ' HG2' ' A' ' 71' ' ' LYS . 7.8 t30 -64.57 -40.77 96.16 Favored 'General case' 0 N--CA 1.478 0.943 0 C-N-CA 123.484 0.714 . . . . 0.0 111.02 -179.169 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 69' ' ' VAL . . . . . 0.405 HG22 ' O ' ' A' ' 65' ' ' ASN . 18.4 t -71.4 -32.14 45.59 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.094 0 CA-C-O 121.018 0.437 . . . . 0.0 110.038 178.074 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -76.55 -16.33 59.64 Favored 'General case' 0 N--CA 1.485 1.288 0 C-N-CA 123.635 0.774 . . . . 0.0 112.229 -177.122 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . 0.431 ' HG2' ' O ' ' A' ' 68' ' ' ASN . 20.0 ptmt -94.76 -17.35 22.25 Favored 'General case' 0 N--CA 1.479 1.003 0 C-N-CA 122.367 0.267 . . . . 0.0 111.521 178.925 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 13.1 t -114.29 -35.32 5.02 Favored 'General case' 0 N--CA 1.479 1.006 0 C-N-CA 122.89 0.476 . . . . 0.0 111.777 -172.087 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -99.59 119.66 38.42 Favored 'General case' 0 N--CA 1.47 0.544 0 C-N-CA 124.048 0.939 . . . . 0.0 109.702 -176.082 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 27.8 p-10 -74.67 169.7 17.29 Favored 'General case' 0 N--CA 1.481 1.096 0 C-N-CA 123.563 0.745 . . . . 0.0 111.226 -177.171 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 15.0 tptm -60.23 -39.05 85.29 Favored 'General case' 0 N--CA 1.481 1.081 0 C-N-CA 124.029 0.932 . . . . 0.0 110.929 -174.122 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 29.7 t70 -64.4 -38.46 91.11 Favored 'General case' 0 N--CA 1.475 0.793 0 C-N-CA 124.125 0.97 . . . . 0.0 111.338 -179.099 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 31.1 t60 -59.8 -37.43 79.11 Favored 'General case' 0 N--CA 1.481 1.084 0 C-N-CA 124.213 1.005 . . . . 0.0 110.446 176.492 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 27.2 mt -72.72 -35.36 67.56 Favored 'General case' 0 N--CA 1.478 0.931 0 CA-C-N 115.78 -0.645 . . . . 0.0 111.278 -174.954 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 21.5 t -69.86 -40.72 79.23 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.69 0 C-N-CA 123.306 0.642 . . . . 0.0 109.712 175.11 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 43.3 m -57.73 -45.1 86.26 Favored 'General case' 0 N--CA 1.478 0.928 0 C-N-CA 123.783 0.833 . . . . 0.0 110.489 175.118 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 81' ' ' ALA . . . . . 0.479 ' HB3' HD13 ' A' ' 62' ' ' LEU . . . -66.48 -43.53 85.18 Favored 'General case' 0 CA--C 1.534 0.335 0 CA-C-N 115.719 -0.673 . . . . 0.0 110.927 -179.592 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 82' ' ' TYR . . . . . 0.492 ' HD1' HD21 ' A' ' 83' ' ' ASN . 18.4 t80 -53.67 -56.39 17.69 Favored 'General case' 0 CA--C 1.543 0.676 0 C-N-CA 124.079 0.952 . . . . 0.0 110.409 176.816 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 83' ' ' ASN . . . . . 0.492 HD21 ' HD1' ' A' ' 82' ' ' TYR . 0.9 OUTLIER -55.68 -51.24 67.94 Favored 'General case' 0 N--CA 1.489 1.493 0 C-N-CA 123.46 0.704 . . . . 0.0 111.081 -175.824 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 66.4 m-70 -70.43 -22.83 62.67 Favored 'General case' 0 CA--C 1.543 0.707 0 C-N-CA 124.553 1.141 . . . . 0.0 112.567 -175.771 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 42.4 tp -63.19 -55.32 26.08 Favored 'General case' 0 N--CA 1.483 1.212 0 CA-C-O 121.603 0.716 . . . . 0.0 110.986 177.96 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 86' ' ' PHE . . . . . 0.483 ' HA ' ' HE1' ' A' ' 91' ' ' PHE . 37.2 m-85 -75.86 -28.78 58.31 Favored 'General case' 0 N--CA 1.474 0.735 0 CA-C-N 114.101 -1.409 . . . . 0.0 111.83 -175.744 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 11.6 tp10 -68.61 -18.49 64.32 Favored 'General case' 0 N--CA 1.479 1.017 0 C-N-CA 123.12 0.568 . . . . 0.0 112.063 -176.343 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 18.1 p -129.04 -1.42 5.21 Favored 'General case' 0 N--CA 1.479 0.985 0 C-N-CA 123.761 0.824 . . . . 0.0 111.811 -179.722 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 73.1 mmtt 59.57 38.78 22.1 Favored 'General case' 0 N--CA 1.487 1.397 0 C-N-CA 124.558 1.143 . . . . 0.0 111.71 177.301 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 62.2 mtt180 -73.23 -11.04 60.37 Favored 'General case' 0 N--CA 1.49 1.556 0 C-N-CA 123.625 0.77 . . . . 0.0 112.765 -178.232 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 91' ' ' PHE . . . . . 0.483 ' HE1' ' HA ' ' A' ' 86' ' ' PHE . 50.3 p90 -81.88 156.24 24.91 Favored 'General case' 0 C--O 1.242 0.666 0 C-N-CA 123.244 0.618 . . . . 0.0 110.946 171.872 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 33.2 ttpt . . . . . 0 C--O 1.253 1.272 0 N-CA-C 107.425 -1.324 . . . . 0.0 107.425 170.671 . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 20' ' ' MET . . . . . . . . . . . . . 56.2 mtt . . . . . 0 N--CA 1.476 0.836 0 N-CA-C 109.631 -0.507 . . . . 0.0 109.631 . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -91.03 143.4 26.74 Favored 'General case' 0 N--CA 1.474 0.754 0 C-N-CA 123.68 0.792 . . . . 0.0 110.09 178.02 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -70.38 97.07 1.21 Allowed 'General case' 0 N--CA 1.47 0.549 0 N-CA-C 108.547 -0.908 . . . . 0.0 108.547 174.894 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -84.88 49.78 1.79 Allowed 'General case' 0 N--CA 1.477 0.906 0 C-N-CA 123.887 0.875 . . . . 0.0 111.425 -173.231 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 16.4 m -60.51 123.4 73.7 Favored Pre-proline 0 CA--C 1.558 1.274 0 C-N-CA 124.499 1.12 . . . . 0.0 111.307 -177.605 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 58.9 Cg_endo -72.29 107.48 2.28 Favored 'Trans proline' 0 C--N 1.375 1.934 0 C-N-CA 122.125 1.883 . . . . 0.0 112.89 -174.692 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 17.8 pt20 -88.3 150.09 23.43 Favored 'General case' 0 C--O 1.247 0.97 0 N-CA-C 108.043 -1.095 . . . . 0.0 108.043 167.521 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -61.53 132.33 53.03 Favored 'General case' 0 CA--C 1.539 0.529 0 O-C-N 123.455 0.472 . . . . 0.0 110.734 179.129 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -78.82 -31.96 46.02 Favored 'General case' 0 N--CA 1.467 0.412 0 CA-C-N 115.452 -0.795 . . . . 0.0 109.643 176.243 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 29' ' ' TRP . . . . . . . . . . . . . 3.4 m-90 -129.25 142.67 50.78 Favored 'General case' 0 N--CA 1.463 0.192 0 C-N-CA 124.439 1.096 . . . . 0.0 109.043 -175.456 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 42.7 p -82.03 174.75 10.95 Favored 'General case' 0 N--CA 1.473 0.691 0 C-N-CA 123.085 0.554 . . . . 0.0 109.597 173.648 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 7.5 p -58.62 -39.01 74.61 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.328 0 C-N-CA 122.732 0.413 . . . . 0.0 111.423 -176.799 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 11.4 pt-20 -69.32 -39.43 78.21 Favored 'General case' 0 N--CA 1.48 1.074 0 C-N-CA 123.58 0.752 . . . . 0.0 111.53 178.311 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 52.9 mt-30 -63.56 -36.76 84.85 Favored 'General case' 0 N--CA 1.481 1.083 0 C-N-CA 122.888 0.475 . . . . 0.0 110.807 177.963 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 89.7 mt -60.94 -51.48 69.09 Favored 'General case' 0 N--CA 1.48 1.045 0 O-C-N 123.473 0.483 . . . . 0.0 109.866 176.878 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 43.7 mtm105 -65.36 -18.87 65.66 Favored 'General case' 0 C--N 1.353 0.74 0 CA-C-N 114.43 -1.259 . . . . 0.0 111.865 -175.718 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 44.8 t -56.47 123.91 16.38 Favored 'General case' 0 C--N 1.354 0.789 0 N-CA-C 109.649 -0.5 . . . . 0.0 109.649 173.316 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 28.9 mt-10 -57.98 -37.1 73.58 Favored 'General case' 0 N--CA 1.474 0.749 0 C-N-CA 124.452 1.101 . . . . 0.0 111.278 -177.854 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 74.7 mt-30 -64.25 -30.21 71.27 Favored 'General case' 0 N--CA 1.475 0.794 0 C-N-CA 123.79 0.836 . . . . 0.0 111.484 -178.14 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 4.1 tt -81.05 113.0 37.39 Favored Pre-proline 0 CA--C 1.549 0.935 0 N-CA-C 107.553 -1.277 . . . . 0.0 107.553 172.692 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 40' ' ' PRO . . . . . 0.517 ' HB2' ' HG2' ' A' ' 42' ' ' LYS . 11.3 Cg_exo -70.55 147.34 57.59 Favored 'Trans proline' 0 C--N 1.371 1.717 0 C-N-CA 122.906 2.404 . . . . 0.0 112.81 -179.222 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 52.4 mtmt -56.83 -29.11 62.49 Favored 'General case' 0 N--CA 1.478 0.951 0 C-N-CA 124.602 1.161 . . . . 0.0 112.23 177.026 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . 0.517 ' HG2' ' HB2' ' A' ' 40' ' ' PRO . 17.4 ptpt -66.3 -36.91 84.16 Favored 'General case' 0 N--CA 1.47 0.533 0 C-N-CA 123.342 0.657 . . . . 0.0 111.71 -179.754 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 43' ' ' ASP . . . . . 0.472 ' HA ' ' HE2' ' A' ' 46' ' ' LYS . 2.3 m-20 -67.16 -35.36 79.52 Favored 'General case' 0 N--CA 1.479 1.009 0 O-C-N 123.293 0.37 . . . . 0.0 111.229 178.948 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 37.6 mt -65.65 -54.12 31.43 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.748 0 O-C-N 123.708 0.63 . . . . 0.0 109.635 177.949 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 68.0 mt -58.02 -39.52 72.62 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.253 0 C-N-CA 123.489 0.716 . . . . 0.0 111.096 177.945 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 46' ' ' LYS . . . . . 0.472 ' HE2' ' HA ' ' A' ' 43' ' ' ASP . 36.5 ttpt -59.92 -43.24 95.0 Favored 'General case' 0 N--CA 1.478 0.956 0 C-N-CA 124.086 0.955 . . . . 0.0 110.88 179.301 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 22.5 t80 -64.4 -47.13 80.36 Favored 'General case' 0 CA--C 1.548 0.889 0 CA-C-N 114.962 -1.017 . . . . 0.0 110.947 176.874 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 87.3 mt -70.82 -30.53 66.99 Favored 'General case' 0 N--CA 1.472 0.665 0 CA-C-N 115.326 -0.852 . . . . 0.0 111.741 -174.723 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . 0.458 ' HA ' HD23 ' A' ' 57' ' ' LEU . 3.4 pt20 -84.15 -27.5 28.08 Favored 'General case' 0 N--CA 1.482 1.13 0 C-N-CA 122.639 0.375 . . . . 0.0 110.909 177.748 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 14.4 tp10 -56.72 -37.26 70.71 Favored 'General case' 0 N--CA 1.475 0.816 0 C-N-CA 124.167 0.987 . . . . 0.0 111.505 179.699 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 31.9 m80 -129.99 -21.59 2.98 Favored 'General case' 0 N--CA 1.476 0.83 0 N-CA-C 113.032 0.753 . . . . 0.0 113.032 -177.46 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -60.18 136.34 49.73 Favored Glycine 0 N--CA 1.474 1.204 0 CA-C-N 118.694 0.679 . . . . 0.0 112.818 176.27 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 53' ' ' SER . . . . . 0.413 ' O ' ' HG ' ' A' ' 57' ' ' LEU . 39.7 t -64.08 158.71 22.03 Favored 'General case' 0 N--CA 1.481 1.089 0 C-N-CA 123.618 0.767 . . . . 0.0 110.752 179.133 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 7.2 p-10 -66.14 -29.58 69.9 Favored 'General case' 0 N--CA 1.483 1.181 0 C-N-CA 123.37 0.668 . . . . 0.0 111.396 -171.853 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 42.1 t -71.85 -38.43 70.09 Favored 'General case' 0 N--CA 1.473 0.694 0 C-N-CA 123.555 0.742 . . . . 0.0 110.722 175.397 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 57.4 t80 -63.44 -44.35 94.79 Favored 'General case' 0 N--CA 1.479 0.995 0 N-CA-C 109.14 -0.689 . . . . 0.0 109.14 174.771 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . 0.458 HD23 ' HA ' ' A' ' 49' ' ' GLN . 62.0 mt -68.05 -31.65 71.45 Favored 'General case' 0 C--O 1.222 -0.345 0 CA-C-N 115.243 -0.889 . . . . 0.0 111.081 -178.599 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -71.19 -50.06 37.16 Favored 'General case' 0 N--CA 1.472 0.65 0 C-N-CA 123.001 0.52 . . . . 0.0 111.212 177.632 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 27.1 mm-40 -73.79 -16.41 61.16 Favored 'General case' 0 N--CA 1.477 0.912 0 N-CA-C 112.335 0.495 . . . . 0.0 112.335 -176.851 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 44.6 m-70 -114.19 1.18 14.46 Favored 'General case' 0 N--CA 1.489 1.48 0 C-N-CA 123.176 0.59 . . . . 0.0 111.74 176.8 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 74.6 mmtt 58.09 30.51 19.4 Favored 'General case' 0 N--CA 1.493 1.708 0 C-N-CA 124.613 1.165 . . . . 0.0 113.103 174.499 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . 0.437 HD11 ' HB2' ' A' ' 81' ' ' ALA . 65.6 mt -90.41 -6.96 54.32 Favored 'General case' 0 N--CA 1.487 1.394 0 C-N-CA 123.755 0.822 . . . . 0.0 111.988 -176.415 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -74.57 173.73 10.0 Favored 'General case' 0 N--CA 1.477 0.923 0 C-N-CA 123.06 0.544 . . . . 0.0 111.699 177.196 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 82.6 -165.84 44.75 Favored Glycine 0 C--O 1.246 0.868 0 CA-C-N 115.353 -0.839 . . . . 0.0 112.919 178.278 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 45.5 t-20 -68.2 125.09 25.28 Favored 'General case' 0 C--O 1.241 0.646 0 N-CA-C 109.014 -0.735 . . . . 0.0 109.014 176.884 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 66' ' ' ILE . . . . . 0.429 HD11 ' HB2' ' A' ' 46' ' ' LYS . 32.5 mt -58.5 -53.22 49.71 Favored 'Isoleucine or valine' 0 C--O 1.214 -0.811 0 O-C-N 124.317 1.01 . . . . 0.0 111.707 -169.885 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 22.9 pttp -59.41 -34.92 73.06 Favored 'General case' 0 N--CA 1.489 1.489 0 C-N-CA 123.886 0.875 . . . . 0.0 112.99 -172.051 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 47.9 t30 -65.4 -45.29 84.55 Favored 'General case' 0 N--CA 1.473 0.692 0 C-N-CA 123.452 0.701 . . . . 0.0 110.115 178.86 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 97.3 t -70.61 -43.44 77.63 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.787 0 CA-C-N 115.162 -0.926 . . . . 0.0 110.91 178.167 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -59.22 -50.56 73.54 Favored 'General case' 0 N--CA 1.479 1.009 0 C-N-CA 124.875 1.27 . . . . 0.0 112.603 -167.121 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 19.4 ptpt -55.53 -45.41 77.19 Favored 'General case' 0 CA--C 1.558 1.26 0 O-C-N 123.863 0.727 . . . . 0.0 112.063 -179.545 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 13.3 t -93.0 -9.72 38.83 Favored 'General case' 0 N--CA 1.479 1.01 0 C-N-CA 123.662 0.785 . . . . 0.0 111.874 -173.981 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -93.41 118.03 30.81 Favored 'General case' 0 N--CA 1.472 0.662 0 N-CA-C 108.62 -0.881 . . . . 0.0 108.62 173.306 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 29.2 p-10 -73.98 148.54 42.0 Favored 'General case' 0 C--O 1.239 0.535 0 N-CA-C 109.78 -0.452 . . . . 0.0 109.78 176.9 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 39.2 ttmt -63.94 -26.71 68.71 Favored 'General case' 0 CA--C 1.541 0.602 0 C-N-CA 123.559 0.744 . . . . 0.0 111.124 -174.435 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 28.3 t70 -59.74 -40.66 88.83 Favored 'General case' 0 CA--C 1.544 0.739 0 C-N-CA 124.272 1.029 . . . . 0.0 111.28 177.758 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 75.0 t60 -66.37 -39.34 89.05 Favored 'General case' 0 N--CA 1.474 0.77 0 C-N-CA 123.955 0.902 . . . . 0.0 110.086 175.66 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 29.7 mt -69.87 -36.46 75.5 Favored 'General case' 0 N--CA 1.481 1.1 0 C-N-CA 123.348 0.659 . . . . 0.0 112.009 -174.693 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 77.2 t -67.83 -42.83 86.3 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.668 0 C-N-CA 123.849 0.859 . . . . 0.0 109.659 177.295 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 51.5 m -61.09 -40.38 93.5 Favored 'General case' 0 CA--C 1.549 0.91 0 C-N-CA 122.882 0.473 . . . . 0.0 110.725 175.046 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 81' ' ' ALA . . . . . 0.437 ' HB2' HD11 ' A' ' 62' ' ' LEU . . . -65.82 -40.64 92.01 Favored 'General case' 0 N--CA 1.474 0.745 0 C-N-CA 123.497 0.719 . . . . 0.0 111.011 177.414 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 82' ' ' TYR . . . . . . . . . . . . . 13.9 t80 -58.59 -55.34 36.32 Favored 'General case' 0 CA--C 1.541 0.629 0 CA-C-N 114.532 -1.213 . . . . 0.0 110.989 179.206 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 83' ' ' ASN . . . . . . . . . . . . . 67.3 m-80 -64.7 -44.08 91.41 Favored 'General case' 0 N--CA 1.483 1.176 0 C-N-CA 122.454 0.302 . . . . 0.0 111.161 -174.129 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 25.2 m-70 -64.3 -26.63 68.57 Favored 'General case' 0 N--CA 1.485 1.315 0 C-N-CA 123.708 0.803 . . . . 0.0 111.845 179.155 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 85' ' ' LEU . . . . . 0.481 HD12 ' HB2' ' A' ' 90' ' ' ARG . 53.6 tp -58.34 -52.95 63.43 Favored 'General case' 0 N--CA 1.482 1.13 0 CA-C-O 121.219 0.533 . . . . 0.0 111.163 177.327 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 45.3 m-85 -75.61 -35.68 60.47 Favored 'General case' 0 N--CA 1.475 0.807 0 CA-C-N 115.041 -0.981 . . . . 0.0 111.65 -178.65 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 17.4 tp10 -60.29 -47.05 87.65 Favored 'General case' 0 N--CA 1.473 0.68 0 C-N-CA 124.162 0.985 . . . . 0.0 111.613 -172.516 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 7.6 p -117.04 11.84 14.38 Favored 'General case' 0 CA--C 1.548 0.87 0 C-N-CA 123.999 0.919 . . . . 0.0 111.236 -179.583 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 27.2 mtpp 55.14 56.8 6.11 Favored 'General case' 0 N--CA 1.486 1.336 0 C-N-CA 125.241 1.416 . . . . 0.0 112.251 168.604 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 90' ' ' ARG . . . . . 0.481 ' HB2' HD12 ' A' ' 85' ' ' LEU . 11.7 mmm180 -73.26 -16.81 61.38 Favored 'General case' 0 N--CA 1.484 1.266 0 CA-C-N 115.163 -0.926 . . . . 0.0 111.864 -176.971 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 91' ' ' PHE . . . . . . . . . . . . . 3.4 p90 -69.08 144.26 53.99 Favored 'General case' 0 CA--C 1.544 0.747 0 CA-C-O 121.631 0.729 . . . . 0.0 111.865 -179.533 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 6.7 mtpm? . . . . . 0 C--O 1.247 0.941 0 C-N-CA 125.379 1.472 . . . . 0.0 108.78 170.675 . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 20' ' ' MET . . . . . . . . . . . . . 25.9 ptt? . . . . . 0 N--CA 1.486 1.344 0 N-CA-C 109.991 -0.374 . . . . 0.0 109.991 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -69.88 89.39 0.58 Allowed 'General case' 0 CA--C 1.542 0.67 0 O-C-N 123.793 0.683 . . . . 0.0 110.22 174.364 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -161.33 15.56 0.1 Allowed 'General case' 0 N--CA 1.476 0.829 0 C-N-CA 124.339 1.056 . . . . 0.0 110.49 -177.291 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -157.11 125.94 5.82 Favored 'General case' 0 CA--C 1.537 0.457 0 C-N-CA 123.916 0.886 . . . . 0.0 109.255 -173.204 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 61.1 t -76.56 122.28 86.34 Favored Pre-proline 0 CA--C 1.546 0.825 0 C-N-CA 123.415 0.686 . . . . 0.0 109.646 178.506 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 90.7 Cg_endo -81.73 131.03 7.02 Favored 'Trans proline' 0 C--N 1.369 1.619 0 C-N-CA 122.636 2.224 . . . . 0.0 113.212 176.146 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 49.2 mt-30 -98.02 148.95 22.98 Favored 'General case' 0 C--O 1.245 0.827 0 N-CA-C 106.049 -1.834 . . . . 0.0 106.049 153.407 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -56.37 128.24 34.95 Favored 'General case' 0 CA--C 1.544 0.737 0 CA-C-O 120.867 0.365 . . . . 0.0 110.515 -178.13 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -85.72 -38.86 17.82 Favored 'General case' 0 N--CA 1.472 0.638 0 CA-C-N 115.841 -0.618 . . . . 0.0 109.372 179.127 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 29' ' ' TRP . . . . . . . . . . . . . 5.1 m-90 -137.34 154.54 50.02 Favored 'General case' 0 N--CA 1.476 0.828 0 C-N-CA 124.669 1.188 . . . . 0.0 108.636 178.649 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 77.2 p -85.82 173.16 10.22 Favored 'General case' 0 N--CA 1.477 0.901 0 N-CA-C 109.683 -0.488 . . . . 0.0 109.683 174.266 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 8.0 p -56.96 -40.8 74.8 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.139 0 C-N-CA 123.762 0.825 . . . . 0.0 111.766 -177.396 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 10.2 pt-20 -71.43 -37.51 71.43 Favored 'General case' 0 N--CA 1.476 0.835 0 C-N-CA 123.782 0.833 . . . . 0.0 111.563 179.377 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 49.9 mt-30 -66.33 -36.06 81.95 Favored 'General case' 0 N--CA 1.474 0.736 0 C-N-CA 123.023 0.529 . . . . 0.0 110.99 175.915 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . 0.449 ' HB3' HG22 ' A' ' 79' ' ' VAL . 84.2 mt -65.05 -50.06 67.69 Favored 'General case' 0 N--CA 1.475 0.812 0 C-N-CA 123.21 0.604 . . . . 0.0 110.941 -179.788 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . 0.565 ' HA ' ' HD3' ' A' ' 75' ' ' LYS . 17.8 ptm180 -73.87 -14.89 61.15 Favored 'General case' 0 N--CA 1.477 0.923 0 CA-C-N 115.699 -0.682 . . . . 0.0 111.707 -178.325 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 47.7 t -56.56 129.46 40.96 Favored 'General case' 0 N--CA 1.478 0.944 0 C-N-CA 123.389 0.676 . . . . 0.0 111.043 179.242 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 33.5 mt-10 -67.67 -18.83 65.07 Favored 'General case' 0 N--CA 1.479 1.012 0 C-N-CA 124.353 1.061 . . . . 0.0 111.883 -177.659 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 13.7 mm100 -70.8 -28.29 64.54 Favored 'General case' 0 CA--C 1.542 0.645 0 C-N-CA 123.52 0.728 . . . . 0.0 111.309 175.406 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 4.6 tt -91.99 127.24 50.35 Favored Pre-proline 0 CA--C 1.561 1.38 0 N-CA-C 108.229 -1.026 . . . . 0.0 108.229 178.5 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 24.5 Cg_exo -68.8 -149.06 0.02 OUTLIER 'Trans proline' 0 C--N 1.378 2.117 0 C-N-CA 123.571 2.847 . . . . 0.0 113.524 171.512 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -122.83 -30.65 3.8 Favored 'General case' 0 N--CA 1.482 1.134 0 C-N-CA 123.526 0.731 . . . . 0.0 111.169 177.559 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . 0.507 ' HA ' HD12 ' A' ' 45' ' ' ILE . 19.3 pttp -61.03 -39.27 89.15 Favored 'General case' 0 N--CA 1.486 1.335 0 C-N-CA 123.899 0.88 . . . . 0.0 112.776 -171.799 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 15.4 p-10 -69.7 -32.75 71.52 Favored 'General case' 0 CA--C 1.544 0.735 0 C-N-CA 122.697 0.399 . . . . 0.0 111.372 176.678 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 42.3 mt -67.18 -44.1 88.02 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.357 0 C-N-CA 122.315 0.246 . . . . 0.0 110.343 176.378 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 45' ' ' ILE . . . . . 0.507 HD12 ' HA ' ' A' ' 42' ' ' LYS . 67.3 mt -55.33 -44.27 74.74 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.325 0 C-N-CA 123.506 0.722 . . . . 0.0 110.011 175.21 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 46' ' ' LYS . . . . . 0.414 ' O ' ' HB2' ' A' ' 50' ' ' GLU . 55.0 tttp -58.37 -44.63 88.94 Favored 'General case' 0 CA--C 1.542 0.67 0 O-C-N 124.213 0.946 . . . . 0.0 110.845 178.414 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 23.7 t80 -59.63 -49.47 77.63 Favored 'General case' 0 N--CA 1.483 1.218 0 O-C-N 123.773 0.671 . . . . 0.0 111.219 177.318 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 97.7 mt -70.0 -31.8 69.67 Favored 'General case' 0 CA--C 1.544 0.731 0 C-N-CA 123.579 0.752 . . . . 0.0 112.115 -174.472 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 3.4 pt20 -84.23 -31.1 25.2 Favored 'General case' 0 N--CA 1.488 1.458 0 CA-C-N 117.711 0.232 . . . . 0.0 111.556 179.004 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . 0.414 ' HB2' ' O ' ' A' ' 46' ' ' LYS . 7.1 tp10 -63.9 -27.41 69.13 Favored 'General case' 0 N--CA 1.486 1.363 0 C-N-CA 124.168 0.987 . . . . 0.0 111.539 -175.576 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 52.0 m80 -120.95 -33.02 3.83 Favored 'General case' 0 N--CA 1.469 0.519 0 CA-C-N 115.072 -0.967 . . . . 0.0 111.422 -173.624 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -75.97 156.5 47.55 Favored Glycine 0 C--N 1.352 1.418 0 O-C-N 123.314 0.384 . . . . 0.0 113.597 -174.746 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 20.7 t -87.79 172.06 9.93 Favored 'General case' 0 N--CA 1.476 0.841 0 C-N-CA 123.583 0.753 . . . . 0.0 110.898 177.715 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 14.9 m-20 -60.27 -42.19 94.86 Favored 'General case' 0 N--CA 1.479 0.993 0 C-N-CA 124.436 1.094 . . . . 0.0 112.811 -171.206 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 32.9 t -70.42 -27.92 64.65 Favored 'General case' 0 N--CA 1.477 0.911 0 C-N-CA 123.299 0.64 . . . . 0.0 111.25 -176.545 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 56' ' ' PHE . . . . . 0.455 ' HD1' HH11 ' A' ' 90' ' ' ARG . 32.3 t80 -67.73 -46.22 72.79 Favored 'General case' 0 N--CA 1.482 1.155 0 CA-C-O 121.443 0.64 . . . . 0.0 110.085 174.149 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 66.0 mt -69.97 -44.87 68.57 Favored 'General case' 0 CA--C 1.538 0.492 0 CA-C-N 114.81 -1.086 . . . . 0.0 110.577 -175.854 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -54.65 -24.44 21.62 Favored 'General case' 0 N--CA 1.484 1.26 0 C-N-CA 125.674 1.59 . . . . 0.0 113.399 -176.815 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 53.8 mt-10 -54.37 -51.35 65.08 Favored 'General case' 0 N--CA 1.482 1.144 0 C-N-CA 123.512 0.725 . . . . 0.0 111.354 -179.459 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 15.9 t60 -119.03 13.79 13.05 Favored 'General case' 0 N--CA 1.487 1.384 0 C-N-CA 122.697 0.399 . . . . 0.0 111.241 175.778 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 61.7 mttp 56.82 65.29 1.43 Allowed 'General case' 0 N--CA 1.478 0.931 0 C-N-CA 124.417 1.087 . . . . 0.0 111.175 -176.184 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . 0.513 ' HA ' HG11 ' A' ' 69' ' ' VAL . 77.9 mt -86.24 -9.5 56.38 Favored 'General case' 0 N--CA 1.477 0.921 0 C-N-CA 123.972 0.909 . . . . 0.0 110.042 176.767 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 1.5 pp -80.43 156.06 26.8 Favored 'General case' 0 CA--C 1.545 0.783 0 C-N-CA 124.303 1.041 . . . . 0.0 110.781 177.201 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 90.03 -149.69 20.51 Favored Glycine 0 C--N 1.34 0.79 0 CA-C-N 115.696 -0.684 . . . . 0.0 112.732 178.327 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 65' ' ' ASN . . . . . 0.427 ' O ' HG23 ' A' ' 69' ' ' VAL . 82.3 m-20 -65.05 113.45 3.92 Favored 'General case' 0 N--CA 1.48 1.025 0 C-N-CA 123.927 0.891 . . . . 0.0 110.427 -177.001 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 70.4 mt -59.44 -42.92 89.24 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.125 0 C-N-CA 123.928 0.891 . . . . 0.0 110.605 -176.591 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 17.9 mtpp -55.61 -47.62 76.24 Favored 'General case' 0 CA--C 1.545 0.757 0 C-N-CA 124.063 0.945 . . . . 0.0 111.208 177.643 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 68' ' ' ASN . . . . . 0.51 ' O ' ' HG2' ' A' ' 71' ' ' LYS . 7.0 t30 -61.8 -42.83 99.5 Favored 'General case' 0 N--CA 1.479 0.984 0 C-N-CA 123.599 0.759 . . . . 0.0 111.336 176.068 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 69' ' ' VAL . . . . . 0.513 HG11 ' HA ' ' A' ' 62' ' ' LEU . 87.9 t -68.93 -30.13 45.76 Favored 'Isoleucine or valine' 0 CA--C 1.554 1.109 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.856 -178.988 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -65.82 -8.12 19.91 Favored 'General case' 0 N--CA 1.492 1.652 0 N-CA-C 114.363 1.246 . . . . 0.0 114.363 -173.929 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . 0.51 ' HG2' ' O ' ' A' ' 68' ' ' ASN . 64.7 pttt -91.54 -24.47 19.61 Favored 'General case' 0 N--CA 1.483 1.198 0 C-N-CA 122.88 0.472 . . . . 0.0 111.328 178.593 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 6.9 t -111.9 -27.94 8.25 Favored 'General case' 0 N--CA 1.474 0.772 0 C-N-CA 123.584 0.754 . . . . 0.0 110.996 -176.465 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . 0.462 ' HB3' HD23 ' A' ' 78' ' ' LEU . . . -73.39 85.28 1.48 Allowed 'General case' 0 C--O 1.243 0.756 0 N-CA-C 108.586 -0.894 . . . . 0.0 108.586 178.435 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 7.6 p30 -73.92 142.93 45.93 Favored 'General case' 0 C--O 1.239 0.529 0 CA-C-N 113.559 -1.655 . . . . 0.0 109.023 179.347 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . 0.565 ' HD3' ' HA ' ' A' ' 35' ' ' ARG . 40.4 ttmt -60.49 -34.16 73.65 Favored 'General case' 0 CA--C 1.538 0.492 0 C-N-CA 124.383 1.073 . . . . 0.0 111.419 -174.294 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 27.8 t70 -58.04 -39.91 79.58 Favored 'General case' 0 N--CA 1.472 0.671 0 C-N-CA 123.626 0.77 . . . . 0.0 111.175 177.922 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 73.6 t60 -71.21 -42.42 68.97 Favored 'General case' 0 C--O 1.213 -0.856 0 C-N-CA 123.633 0.773 . . . . 0.0 110.253 176.186 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . 0.462 HD23 ' HB3' ' A' ' 73' ' ' ALA . 98.2 mt -67.36 -31.21 71.3 Favored 'General case' 0 N--CA 1.483 1.187 0 N-CA-C 113.051 0.76 . . . . 0.0 113.051 -170.893 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 79' ' ' VAL . . . . . 0.449 HG22 ' HB3' ' A' ' 34' ' ' LEU . 60.0 t -71.58 -46.55 62.41 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.782 0 C-N-CA 123.407 0.683 . . . . 0.0 109.66 174.335 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 34.9 m -63.73 -32.38 73.86 Favored 'General case' 0 N--CA 1.477 0.877 0 CA-C-N 115.431 -0.804 . . . . 0.0 110.921 176.775 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -74.96 -37.52 61.93 Favored 'General case' 0 N--CA 1.473 0.713 0 C-N-CA 124.183 0.993 . . . . 0.0 110.358 179.639 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 82' ' ' TYR . . . . . . . . . . . . . 35.7 t80 -55.25 -55.22 33.87 Favored 'General case' 0 N--CA 1.472 0.673 0 C-N-CA 124.428 1.091 . . . . 0.0 109.954 173.676 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 83' ' ' ASN . . . . . . . . . . . . . 68.5 m-80 -64.59 -41.68 96.09 Favored 'General case' 0 N--CA 1.482 1.133 0 C-N-CA 122.639 0.376 . . . . 0.0 110.842 -178.396 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 16.6 t-160 -67.47 -27.45 67.03 Favored 'General case' 0 N--CA 1.485 1.28 0 C-N-CA 124.037 0.935 . . . . 0.0 110.787 -178.684 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -59.72 -53.05 62.53 Favored 'General case' 0 N--CA 1.48 1.075 0 C-N-CA 124.182 0.993 . . . . 0.0 109.822 -179.448 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 32.2 m-85 -74.08 -28.28 61.31 Favored 'General case' 0 CA--C 1.547 0.849 0 CA-C-N 114.22 -1.354 . . . . 0.0 111.462 -179.963 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 9.4 tm-20 -73.19 -26.76 61.29 Favored 'General case' 0 N--CA 1.48 1.058 0 C-N-CA 124.149 0.979 . . . . 0.0 111.498 -174.345 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 23.0 p -116.79 -7.16 11.51 Favored 'General case' 0 N--CA 1.479 0.98 0 C-N-CA 123.315 0.646 . . . . 0.0 111.403 178.05 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 41.5 mtmt 59.79 35.29 22.03 Favored 'General case' 0 N--CA 1.487 1.387 0 C-N-CA 124.197 0.999 . . . . 0.0 111.901 175.212 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 90' ' ' ARG . . . . . 0.455 HH11 ' HD1' ' A' ' 56' ' ' PHE . 99.4 mtt180 -62.91 -15.74 56.39 Favored 'General case' 0 N--CA 1.49 1.569 0 N-CA-C 113.562 0.949 . . . . 0.0 113.562 -173.26 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 91' ' ' PHE . . . . . . . . . . . . . 21.9 p90 -71.37 162.08 30.02 Favored 'General case' 0 C--N 1.321 -0.654 0 C-N-CA 123.722 0.809 . . . . 0.0 111.904 172.645 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 1.4 tmtp? . . . . . 0 C--O 1.243 0.734 0 N-CA-C 105.668 -1.975 . . . . 0.0 105.668 167.294 . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 20' ' ' MET . . . . . . . . . . . . . 14.6 tpt . . . . . 0 N--CA 1.48 1.072 0 N-CA-C 110.325 -0.25 . . . . 0.0 110.325 . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -73.85 91.17 1.95 Allowed 'General case' 0 N--CA 1.47 0.545 0 C-N-CA 123.186 0.594 . . . . 0.0 109.602 173.772 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -144.66 88.68 1.93 Allowed 'General case' 0 N--CA 1.468 0.46 0 C-N-CA 123.622 0.769 . . . . 0.0 109.598 -177.941 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -77.6 99.03 5.6 Favored 'General case' 0 N--CA 1.472 0.66 0 N-CA-C 109.289 -0.634 . . . . 0.0 109.289 178.918 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 31.0 m -64.86 132.24 95.4 Favored Pre-proline 0 CA--C 1.555 1.162 0 N-CA-C 109.865 -0.42 . . . . 0.0 109.865 176.568 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 73.8 Cg_endo -68.71 169.16 18.13 Favored 'Trans proline' 0 C--N 1.369 1.61 0 C-N-CA 122.842 2.361 . . . . 0.0 113.085 -173.598 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 29.6 pt20 -119.01 147.86 43.62 Favored 'General case' 0 C--O 1.245 0.827 0 CA-C-N 114.751 -1.113 . . . . 0.0 108.952 -178.941 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 36.0 ttp180 -72.3 108.0 5.2 Favored 'General case' 0 CA--C 1.534 0.334 0 N-CA-C 108.542 -0.91 . . . . 0.0 108.542 169.862 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -89.64 -18.02 27.29 Favored 'General case' 0 CA--C 1.543 0.703 0 CA-C-N 114.324 -1.307 . . . . 0.0 111.751 -172.498 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 29' ' ' TRP . . . . . . . . . . . . . 5.7 m-90 -130.51 139.25 50.51 Favored 'General case' 0 N--CA 1.473 0.718 0 C-N-CA 123.856 0.863 . . . . 0.0 109.792 -174.221 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 73.8 p -80.27 167.31 20.44 Favored 'General case' 0 C--O 1.242 0.702 0 N-CA-C 108.329 -0.989 . . . . 0.0 108.329 171.796 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . 0.567 ' HA ' HD12 ' A' ' 34' ' ' LEU . 9.5 p -62.81 -30.04 48.51 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.89 0 CA-C-N 117.572 0.169 . . . . 0.0 111.376 -174.946 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 9.9 pt-20 -68.76 -40.49 79.72 Favored 'General case' 0 C--N 1.359 0.981 0 C-N-CA 123.067 0.547 . . . . 0.0 110.706 175.185 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 52.6 mt-30 -64.14 -41.71 97.09 Favored 'General case' 0 N--CA 1.482 1.148 0 C-N-CA 123.002 0.521 . . . . 0.0 110.599 178.151 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . 0.567 HD12 ' HA ' ' A' ' 31' ' ' VAL . 84.3 mt -60.29 -52.99 62.91 Favored 'General case' 0 N--CA 1.47 0.555 0 O-C-N 124.361 1.038 . . . . 0.0 111.219 -178.539 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 16.6 ptm180 -72.74 -23.19 60.81 Favored 'General case' 0 N--CA 1.475 0.818 0 O-C-N 124.418 1.074 . . . . 0.0 110.768 -175.876 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 24.7 t -63.19 123.3 18.28 Favored 'General case' 0 C--N 1.356 0.853 0 C-N-CA 123.032 0.533 . . . . 0.0 110.291 -177.788 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 12.0 pt-20 -65.01 -21.01 66.78 Favored 'General case' 0 N--CA 1.474 0.754 0 C-N-CA 123.858 0.863 . . . . 0.0 112.521 -177.653 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 94.8 mt-30 -68.56 -26.91 65.65 Favored 'General case' 0 CA--C 1.542 0.655 0 C-N-CA 123.749 0.82 . . . . 0.0 110.905 177.265 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 60.5 tp -83.14 117.97 70.23 Favored Pre-proline 0 N--CA 1.478 0.942 0 N-CA-C 108.363 -0.976 . . . . 0.0 108.363 169.511 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 40' ' ' PRO . . . . . 0.598 ' HG2' ' HB2' ' A' ' 43' ' ' ASP . 30.1 Cg_endo -64.01 141.23 76.21 Favored 'Trans proline' 0 C--N 1.376 2.004 0 C-N-CA 122.175 1.916 . . . . 0.0 112.254 176.414 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 50.5 mtmt -61.24 -32.68 72.47 Favored 'General case' 0 N--CA 1.474 0.748 0 C-N-CA 124.203 1.001 . . . . 0.0 111.026 178.832 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . 0.58 ' HG2' ' HB2' ' A' ' 40' ' ' PRO . 17.8 ptpt -65.99 -31.52 72.46 Favored 'General case' 0 N--CA 1.469 0.517 0 C-N-CA 123.858 0.863 . . . . 0.0 111.021 -179.568 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 43' ' ' ASP . . . . . 0.598 ' HB2' ' HG2' ' A' ' 40' ' ' PRO . 2.4 t70 -67.05 -38.05 85.13 Favored 'General case' 0 N--CA 1.481 1.089 0 N-CA-C 109.391 -0.596 . . . . 0.0 109.391 -178.246 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 44' ' ' ILE . . . . . 0.515 ' O ' ' HG ' ' A' ' 48' ' ' LEU . 23.6 mt -67.34 -53.93 28.3 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.765 0 CA-C-N 115.17 -0.923 . . . . 0.0 109.705 177.411 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 73.8 mt -60.09 -36.18 66.03 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.733 0 C-N-CA 123.655 0.782 . . . . 0.0 111.955 -178.453 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 33.8 ttpt -53.86 -45.19 70.91 Favored 'General case' 0 N--CA 1.48 1.052 0 C-N-CA 124.364 1.066 . . . . 0.0 110.479 174.314 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 31.9 t80 -67.51 -45.62 75.26 Favored 'General case' 0 CA--C 1.551 1.0 0 CA-C-N 114.353 -1.294 . . . . 0.0 111.442 177.384 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . 0.515 ' HG ' ' O ' ' A' ' 44' ' ' ILE . 73.9 mt -65.55 -34.25 77.81 Favored 'General case' 0 N--CA 1.477 0.923 0 C-N-CA 123.857 0.863 . . . . 0.0 111.673 -172.903 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . 0.421 ' HA ' HD21 ' A' ' 57' ' ' LEU . 3.4 pt20 -83.92 -28.03 28.16 Favored 'General case' 0 N--CA 1.481 1.081 0 C-N-CA 122.637 0.375 . . . . 0.0 110.766 176.004 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 11.5 tp10 -61.83 -48.91 78.47 Favored 'General case' 0 N--CA 1.482 1.134 0 C-N-CA 123.699 0.8 . . . . 0.0 110.73 179.1 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 1.1 m80 -140.59 22.86 2.32 Favored 'General case' 0 N--CA 1.482 1.135 0 N-CA-C 113.203 0.816 . . . . 0.0 113.203 -171.23 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -84.99 -144.18 6.76 Favored Glycine 0 CA--C 1.534 1.243 0 N-CA-C 109.375 -1.49 . . . . 0.0 109.375 157.467 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 53' ' ' SER . . . . . 0.449 ' O ' ' HG ' ' A' ' 57' ' ' LEU . 28.1 t -149.67 162.68 39.75 Favored 'General case' 0 N--CA 1.478 0.932 0 CA-C-N 117.59 0.695 . . . . 0.0 109.847 174.77 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 4.0 p30 -52.48 -36.04 54.07 Favored 'General case' 0 N--CA 1.487 1.377 0 C-N-CA 124.485 1.114 . . . . 0.0 112.988 -174.424 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 20.4 m -70.69 -43.43 69.04 Favored 'General case' 0 CA--C 1.546 0.791 0 C-N-CA 123.706 0.802 . . . . 0.0 110.762 179.623 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 56' ' ' PHE . . . . . 0.42 ' HE2' ' HB3' ' A' ' 48' ' ' LEU . 66.2 t80 -60.41 -38.92 85.56 Favored 'General case' 0 N--CA 1.483 1.196 0 C-N-CA 124.16 0.984 . . . . 0.0 110.348 174.474 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . 0.449 ' HG ' ' O ' ' A' ' 53' ' ' SER . 51.6 mt -73.9 -32.49 63.6 Favored 'General case' 0 C--O 1.211 -0.936 0 CA-C-N 115.012 -0.994 . . . . 0.0 110.485 -178.983 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -69.92 -47.15 63.55 Favored 'General case' 0 N--CA 1.483 1.18 0 C-N-CA 123.334 0.654 . . . . 0.0 111.391 179.024 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 42.2 mt-10 -55.15 -47.11 75.58 Favored 'General case' 0 N--CA 1.486 1.364 0 C-N-CA 123.631 0.773 . . . . 0.0 111.003 179.196 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 28.6 m80 -107.76 4.68 25.88 Favored 'General case' 0 CA--C 1.543 0.705 0 CA-C-N 115.583 -0.735 . . . . 0.0 111.871 -170.088 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 48.9 mtmt 55.73 39.24 30.81 Favored 'General case' 0 N--CA 1.492 1.639 0 C-N-CA 123.91 0.884 . . . . 0.0 111.824 176.754 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . 0.506 ' HA ' HG11 ' A' ' 69' ' ' VAL . 73.2 mt -88.12 -6.48 57.87 Favored 'General case' 0 N--CA 1.479 0.998 0 C-N-CA 123.93 0.892 . . . . 0.0 111.099 -179.723 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 1.8 pp -73.04 159.99 32.75 Favored 'General case' 0 N--CA 1.474 0.771 0 C-N-CA 124.011 0.924 . . . . 0.0 111.513 174.34 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 92.22 -168.46 31.1 Favored Glycine 0 CA--C 1.524 0.621 0 CA-C-N 115.518 -0.764 . . . . 0.0 112.682 179.729 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 16.1 m120 -62.37 126.15 26.35 Favored 'General case' 0 N--CA 1.478 0.948 0 C-N-CA 123.635 0.774 . . . . 0.0 109.831 -179.58 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 54.8 mt -57.09 -48.12 82.53 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.86 0 O-C-N 124.268 0.98 . . . . 0.0 112.434 -168.543 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 22.4 pttp -65.38 -31.55 72.72 Favored 'General case' 0 N--CA 1.482 1.159 0 C-N-CA 123.688 0.795 . . . . 0.0 111.575 -178.137 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 48.9 t30 -66.75 -41.77 87.26 Favored 'General case' 0 N--CA 1.481 1.121 0 C-N-CA 123.372 0.669 . . . . 0.0 109.862 176.458 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 69' ' ' VAL . . . . . 0.506 HG11 ' HA ' ' A' ' 62' ' ' LEU . 38.4 t -69.04 -34.57 64.56 Favored 'Isoleucine or valine' 0 C--O 1.212 -0.889 0 CA-C-N 115.03 -0.986 . . . . 0.0 109.644 175.31 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -75.37 -2.14 27.11 Favored 'General case' 0 N--CA 1.484 1.23 0 C-N-CA 123.683 0.793 . . . . 0.0 111.341 179.372 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 40.2 ttmt -95.06 -49.63 5.44 Favored 'General case' 0 CA--C 1.547 0.83 0 C-N-CA 123.554 0.742 . . . . 0.0 110.347 172.313 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 15.1 t -83.03 -33.63 26.44 Favored 'General case' 0 CA--C 1.555 1.167 0 C-N-CA 123.435 0.694 . . . . 0.0 111.955 -172.679 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -92.41 118.16 30.66 Favored 'General case' 0 N--CA 1.47 0.563 0 C-N-CA 123.972 0.909 . . . . 0.0 109.735 -179.452 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 74' ' ' ASN . . . . . 0.428 ' O ' ' HB3' ' A' ' 77' ' ' HIS . 24.0 p-10 -76.73 168.41 20.13 Favored 'General case' 0 N--CA 1.476 0.835 0 C-N-CA 123.173 0.589 . . . . 0.0 110.042 173.328 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . 0.427 ' HD3' ' O ' ' A' ' 34' ' ' LEU . 32.3 ttmt -71.99 -32.3 67.08 Favored 'General case' 0 CA--C 1.543 0.703 0 C-N-CA 122.78 0.432 . . . . 0.0 111.709 -175.184 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 33.9 t70 -60.74 -28.58 68.8 Favored 'General case' 0 N--CA 1.487 1.409 0 C-N-CA 123.283 0.633 . . . . 0.0 111.527 177.354 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 77' ' ' HIS . . . . . 0.471 ' HD2' HD23 ' A' ' 78' ' ' LEU . 42.1 t60 -71.2 -48.91 48.68 Favored 'General case' 0 CA--C 1.552 1.045 0 C-N-CA 125.055 1.342 . . . . 0.0 109.978 172.211 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . 0.471 HD23 ' HD2' ' A' ' 77' ' ' HIS . 77.6 mt -67.22 -45.79 75.76 Favored 'General case' 0 N--CA 1.487 1.408 0 N-CA-C 113.454 0.909 . . . . 0.0 113.454 -169.132 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 79' ' ' VAL . . . . . 0.517 HG21 ' HB3' ' A' ' 34' ' ' LEU . 61.9 t -59.53 -42.06 86.83 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.218 0 O-C-N 123.941 0.775 . . . . 0.0 110.207 -177.812 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 24.8 m -62.54 -44.41 96.4 Favored 'General case' 0 N--CA 1.476 0.847 0 CA-C-N 115.203 -0.908 . . . . 0.0 111.496 177.815 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -66.42 -39.35 88.89 Favored 'General case' 0 N--CA 1.48 1.041 0 C-N-CA 123.55 0.74 . . . . 0.0 110.7 -179.803 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 82' ' ' TYR . . . . . . . . . . . . . 86.6 t80 -63.13 -54.56 35.87 Favored 'General case' 0 N--CA 1.471 0.621 0 C-N-CA 124.387 1.075 . . . . 0.0 111.105 -177.328 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 83' ' ' ASN . . . . . . . . . . . . . 67.8 m-80 -68.71 -35.76 77.57 Favored 'General case' 0 N--CA 1.481 1.115 0 C-N-CA 123.055 0.542 . . . . 0.0 110.96 -177.492 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 37.9 t60 -63.97 -30.54 71.61 Favored 'General case' 0 N--CA 1.483 1.218 0 C-N-CA 123.859 0.863 . . . . 0.0 110.647 174.292 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 85' ' ' LEU . . . . . 0.421 HD12 HD21 ' A' ' 48' ' ' LEU . 1.5 tt -60.1 -51.93 67.53 Favored 'General case' 0 N--CA 1.479 1.018 0 C-N-CA 123.467 0.707 . . . . 0.0 109.522 -176.842 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 35.0 m-85 -73.11 -31.89 64.61 Favored 'General case' 0 N--CA 1.48 1.055 0 CA-C-N 115.499 -0.773 . . . . 0.0 110.991 -179.108 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 9.7 tp10 -60.68 -41.61 95.42 Favored 'General case' 0 N--CA 1.477 0.911 0 C-N-CA 124.345 1.058 . . . . 0.0 111.699 -177.114 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 12.2 p -120.32 3.73 10.81 Favored 'General case' 0 N--CA 1.477 0.916 0 C-N-CA 124.152 0.981 . . . . 0.0 111.779 -175.602 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 56.2 mtpt 53.85 70.17 0.63 Allowed 'General case' 0 N--CA 1.48 1.038 0 C-N-CA 124.673 1.189 . . . . 0.0 111.787 178.634 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 26.3 mmm180 -80.12 14.33 1.93 Allowed 'General case' 0 N--CA 1.493 1.693 0 C-N-CA 124.241 1.016 . . . . 0.0 112.369 -179.722 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 91' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -65.15 163.25 15.4 Favored 'General case' 0 N--CA 1.479 1.012 0 C-N-CA 123.671 0.788 . . . . 0.0 110.839 -177.854 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 23.1 ttmm . . . . . 0 C--O 1.254 1.338 0 CA-C-N 115.256 -0.884 . . . . 0.0 109.287 174.952 . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 20' ' ' MET . . . . . . . . . . . . . 25.8 ptt? . . . . . 0 N--CA 1.485 1.29 0 N-CA-C 111.112 0.042 . . . . 0.0 111.112 . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -158.33 151.5 22.87 Favored 'General case' 0 N--CA 1.477 0.9 0 C-N-CA 123.849 0.859 . . . . 0.0 109.858 -178.22 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -100.32 137.88 38.15 Favored 'General case' 0 C--O 1.241 0.626 0 N-CA-C 109.513 -0.551 . . . . 0.0 109.513 174.784 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -72.13 88.38 1.11 Allowed 'General case' 0 N--CA 1.473 0.722 0 C-N-CA 123.435 0.694 . . . . 0.0 109.907 179.986 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 6.2 m -117.76 82.06 16.01 Favored Pre-proline 0 N--CA 1.477 0.886 0 C-N-CA 123.751 0.821 . . . . 0.0 109.902 -178.481 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 44.2 Cg_endo -72.25 128.83 14.21 Favored 'Trans proline' 0 C--N 1.37 1.71 0 C-N-CA 122.155 1.903 . . . . 0.0 111.061 179.583 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 51.6 mt-30 -74.84 178.11 5.76 Favored 'General case' 0 C--O 1.244 0.767 0 CA-C-N 115.578 -0.737 . . . . 0.0 109.178 167.309 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -57.96 135.53 56.94 Favored 'General case' 0 CA--C 1.545 0.786 0 CA-C-O 121.128 0.49 . . . . 0.0 111.3 175.45 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -78.97 -34.56 44.13 Favored 'General case' 0 CA--C 1.535 0.39 0 N-CA-C 108.697 -0.853 . . . . 0.0 108.697 173.348 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 29' ' ' TRP . . . . . . . . . . . . . 4.7 m-90 -134.13 149.83 51.1 Favored 'General case' 0 N--CA 1.476 0.835 0 C-N-CA 124.679 1.192 . . . . 0.0 108.344 178.782 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 21.6 p -91.72 178.1 6.01 Favored 'General case' 0 N--CA 1.478 0.929 0 C-N-CA 122.814 0.446 . . . . 0.0 110.916 -178.482 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 7.2 p -54.34 -45.78 68.96 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.608 0 N-CA-C 113.441 0.904 . . . . 0.0 113.441 -169.873 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . 0.408 ' HA ' ' HG2' ' A' ' 35' ' ' ARG . 1.3 pm0 -71.42 -31.3 67.07 Favored 'General case' 0 N--CA 1.476 0.843 0 C-N-CA 123.133 0.573 . . . . 0.0 111.447 179.305 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 23.4 mm-40 -71.28 -32.98 69.33 Favored 'General case' 0 N--CA 1.476 0.844 0 C-N-CA 123.139 0.576 . . . . 0.0 110.613 175.69 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 70.3 mt -81.34 -27.3 35.0 Favored 'General case' 0 N--CA 1.475 0.797 0 C-N-CA 123.79 0.836 . . . . 0.0 111.827 -176.25 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . 0.408 ' HG2' ' HA ' ' A' ' 32' ' ' GLU . 3.6 ptm180 -82.68 -25.26 33.2 Favored 'General case' 0 N--CA 1.479 0.983 0 CA-C-O 119.669 -0.205 . . . . 0.0 110.829 169.715 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 37.1 t -59.94 125.33 23.23 Favored 'General case' 0 N--CA 1.486 1.36 0 C-N-CA 124.093 0.957 . . . . 0.0 112.111 -172.974 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 10.9 tp10 -65.46 -17.16 64.34 Favored 'General case' 0 CA--C 1.555 1.161 0 C-N-CA 124.487 1.115 . . . . 0.0 111.558 178.534 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 71.3 mt-30 -62.89 -38.59 91.51 Favored 'General case' 0 N--CA 1.476 0.869 0 C-N-CA 123.852 0.861 . . . . 0.0 110.418 173.377 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . 0.487 HD12 ' HD2' ' A' ' 40' ' ' PRO . 51.4 tp -86.52 128.09 58.22 Favored Pre-proline 0 N--CA 1.482 1.134 0 C-N-CA 123.777 0.831 . . . . 0.0 110.016 177.573 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 40' ' ' PRO . . . . . 0.487 ' HD2' HD12 ' A' ' 39' ' ' LEU . 39.0 Cg_endo -70.14 134.26 26.78 Favored 'Trans proline' 0 C--N 1.379 2.144 0 C-N-CA 122.363 2.042 . . . . 0.0 112.318 173.168 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . 0.501 ' HB3' ' HD3' ' A' ' 75' ' ' LYS . 21.5 pttp -76.95 -20.01 56.65 Favored 'General case' 0 N--CA 1.48 1.051 0 N-CA-C 113.235 0.828 . . . . 0.0 113.235 -173.213 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . 0.533 ' HA ' HD12 ' A' ' 45' ' ' ILE . 60.1 pttt -63.77 -30.76 71.82 Favored 'General case' 0 N--CA 1.478 0.941 0 C-N-CA 122.966 0.507 . . . . 0.0 110.706 171.256 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -73.94 -26.25 60.4 Favored 'General case' 0 N--CA 1.479 0.996 0 C-N-CA 122.967 0.507 . . . . 0.0 111.596 177.692 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 39.3 mt -74.55 -43.99 47.75 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.971 0 N-CA-C 109.438 -0.578 . . . . 0.0 109.438 174.846 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 45' ' ' ILE . . . . . 0.533 HD12 ' HA ' ' A' ' 42' ' ' LYS . 77.9 mt -53.89 -46.85 64.57 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.165 0 C-N-CA 123.358 0.663 . . . . 0.0 109.314 172.119 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 29.0 ttpp -63.79 -39.37 94.1 Favored 'General case' 0 CA--C 1.538 0.519 0 CA-C-N 114.467 -1.242 . . . . 0.0 110.893 -177.948 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 26.5 t80 -64.64 -54.31 33.77 Favored 'General case' 0 N--CA 1.473 0.693 0 O-C-N 123.969 0.793 . . . . 0.0 110.623 177.13 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 95.8 mt -69.03 -29.69 67.91 Favored 'General case' 0 N--CA 1.474 0.726 0 C-N-CA 123.656 0.782 . . . . 0.0 111.846 -173.03 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 3.0 pt20 -79.45 -26.21 41.81 Favored 'General case' 0 N--CA 1.48 1.039 0 C-N-CA 122.222 0.209 . . . . 0.0 110.621 176.646 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 10.7 tp10 -61.23 -37.71 84.03 Favored 'General case' 0 N--CA 1.482 1.159 0 C-N-CA 123.679 0.791 . . . . 0.0 111.269 -179.477 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 31.2 p-80 -124.34 -32.21 3.2 Favored 'General case' 0 N--CA 1.485 1.32 0 N-CA-C 113.253 0.834 . . . . 0.0 113.253 -174.24 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -61.83 139.84 46.78 Favored Glycine 0 C--N 1.348 1.198 0 CA-C-N 118.221 0.464 . . . . 0.0 113.6 178.115 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 53' ' ' SER . . . . . 0.457 ' O ' ' HG ' ' A' ' 57' ' ' LEU . 44.1 t -60.14 148.36 36.33 Favored 'General case' 0 N--CA 1.48 1.057 0 C-N-CA 123.582 0.753 . . . . 0.0 111.597 179.556 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 14.2 m-20 -61.52 -32.9 72.96 Favored 'General case' 0 N--CA 1.487 1.419 0 C-N-CA 123.65 0.78 . . . . 0.0 112.489 -174.181 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 21.5 m -67.42 -41.93 84.05 Favored 'General case' 0 CA--C 1.544 0.716 0 O-C-N 123.607 0.567 . . . . 0.0 110.402 177.827 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 56' ' ' PHE . . . . . 0.51 ' HB2' ' HD3' ' A' ' 90' ' ' ARG . 62.4 t80 -60.98 -43.9 98.14 Favored 'General case' 0 N--CA 1.477 0.882 0 C-N-CA 123.849 0.86 . . . . 0.0 109.934 174.027 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . 0.457 ' HG ' ' O ' ' A' ' 53' ' ' SER . 73.1 mt -64.53 -44.49 90.67 Favored 'General case' 0 C--O 1.209 -1.068 0 CA-C-N 115.097 -0.956 . . . . 0.0 110.491 -177.506 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -61.72 -45.28 94.64 Favored 'General case' 0 N--CA 1.482 1.138 0 C-N-CA 123.655 0.782 . . . . 0.0 111.393 -177.39 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 46.7 mt-10 -60.38 -36.58 78.39 Favored 'General case' 0 N--CA 1.482 1.168 0 C-N-CA 123.666 0.787 . . . . 0.0 112.006 177.668 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 53.2 m80 -105.11 6.82 33.51 Favored 'General case' 0 N--CA 1.487 1.393 0 C-N-CA 122.967 0.507 . . . . 0.0 112.132 -177.59 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 68.8 mmtt 59.96 27.22 16.57 Favored 'General case' 0 N--CA 1.488 1.436 0 C-N-CA 125.094 1.358 . . . . 0.0 112.981 175.65 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 70.1 mt -81.92 -21.51 37.3 Favored 'General case' 0 N--CA 1.483 1.198 0 C-N-CA 124.157 0.983 . . . . 0.0 112.669 -174.703 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -78.09 170.04 17.27 Favored 'General case' 0 N--CA 1.485 1.283 0 CA-C-O 120.809 0.337 . . . . 0.0 111.683 179.818 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 90.96 -157.55 25.23 Favored Glycine 0 C--N 1.341 0.848 0 CA-C-N 115.391 -0.822 . . . . 0.0 112.367 177.303 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 17.8 m120 -69.41 115.93 9.25 Favored 'General case' 0 N--CA 1.47 0.567 0 C-N-CA 123.62 0.768 . . . . 0.0 110.205 -179.437 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 65.7 mt -54.29 -50.35 57.11 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.967 0 C-N-CA 124.515 1.126 . . . . 0.0 112.187 -173.758 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 67' ' ' LYS . . . . . 0.424 ' H ' ' HD2' ' A' ' 67' ' ' LYS . 0.0 OUTLIER -60.92 -41.64 96.59 Favored 'General case' 0 N--CA 1.48 1.049 0 O-C-N 123.774 0.671 . . . . 0.0 109.661 -175.898 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 49.5 t30 -61.35 -47.82 84.11 Favored 'General case' 0 N--CA 1.479 1.008 0 CA-C-N 115.075 -0.966 . . . . 0.0 110.975 176.959 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 85.8 t -62.28 -32.35 54.57 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.099 0 C-N-CA 123.585 0.754 . . . . 0.0 110.732 178.676 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -70.69 8.02 0.97 Allowed 'General case' 0 CA--C 1.554 1.134 0 C-N-CA 123.738 0.815 . . . . 0.0 112.976 -178.453 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 16.5 ptpt -94.81 -27.4 15.78 Favored 'General case' 0 N--CA 1.484 1.255 0 CA-C-N 119.179 0.9 . . . . 0.0 110.824 169.69 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 10.2 t -109.23 -28.94 8.74 Favored 'General case' 0 N--CA 1.482 1.155 0 C-N-CA 123.732 0.813 . . . . 0.0 111.045 -175.207 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -80.62 86.36 5.89 Favored 'General case' 0 C--O 1.237 0.447 0 C-N-CA 123.511 0.724 . . . . 0.0 109.656 -178.66 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 3.9 p-10 -70.27 160.95 31.26 Favored 'General case' 0 C--O 1.239 0.538 0 CA-C-N 114.489 -1.232 . . . . 0.0 110.389 174.877 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . 0.501 ' HD3' ' HB3' ' A' ' 41' ' ' LYS . 13.3 tptm -61.19 -47.73 84.79 Favored 'General case' 0 N--CA 1.471 0.59 0 CA-C-N 115.712 -0.676 . . . . 0.0 111.3 -166.923 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 4.4 p30 -69.43 -29.94 67.76 Favored 'General case' 0 N--CA 1.485 1.3 0 CA-C-N 115.975 -0.557 . . . . 0.0 111.649 -176.304 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 74.5 t60 -59.83 -41.53 91.53 Favored 'General case' 0 N--CA 1.481 1.099 0 C-N-CA 123.883 0.873 . . . . 0.0 110.128 173.094 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . 0.44 ' CD1' ' HB2' ' A' ' 41' ' ' LYS . 83.5 mt -74.1 -28.95 61.6 Favored 'General case' 0 N--CA 1.47 0.533 0 CA-C-N 115.242 -0.89 . . . . 0.0 112.24 -176.92 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 79' ' ' VAL . . . . . 0.406 HG23 ' O ' ' A' ' 75' ' ' LYS . 21.3 t -73.73 -39.1 52.49 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.914 0 N-CA-C 109.732 -0.47 . . . . 0.0 109.732 173.553 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 29.2 m -67.5 -36.62 81.44 Favored 'General case' 0 N--CA 1.48 1.061 0 C-N-CA 122.895 0.478 . . . . 0.0 111.098 176.094 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -68.34 -39.65 81.84 Favored 'General case' 0 N--CA 1.473 0.688 0 C-N-CA 123.378 0.671 . . . . 0.0 109.955 175.663 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 82' ' ' TYR . . . . . . . . . . . . . 15.2 t80 -53.57 -58.86 5.67 Favored 'General case' 0 CA--C 1.542 0.65 0 CA-C-N 115.084 -0.962 . . . . 0.0 110.217 174.859 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 83' ' ' ASN . . . . . . . . . . . . . 49.4 m-80 -64.72 -31.19 72.3 Favored 'General case' 0 N--CA 1.481 1.112 0 C-N-CA 122.749 0.42 . . . . 0.0 111.501 -175.513 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 6.4 t60 -65.7 -45.66 81.91 Favored 'General case' 0 CA--C 1.549 0.938 0 C-N-CA 123.471 0.708 . . . . 0.0 110.267 178.218 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 85' ' ' LEU . . . . . 0.415 HD11 ' HB2' ' A' ' 90' ' ' ARG . 20.2 tp -57.13 -54.72 43.57 Favored 'General case' 0 N--CA 1.49 1.531 0 C-N-CA 123.701 0.8 . . . . 0.0 112.34 -172.691 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 83.0 m-85 -74.6 -21.73 59.32 Favored 'General case' 0 CA--C 1.543 0.697 0 CA-C-N 113.625 -1.625 . . . . 0.0 111.409 -174.519 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 7.9 tp10 -82.91 -10.84 58.62 Favored 'General case' 0 N--CA 1.478 0.96 0 C-N-CA 123.165 0.586 . . . . 0.0 111.601 178.524 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 31.4 p -125.5 -3.17 7.34 Favored 'General case' 0 N--CA 1.483 1.211 0 C-N-CA 123.617 0.767 . . . . 0.0 110.94 178.691 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 74.4 mmtt 61.04 23.84 13.99 Favored 'General case' 0 N--CA 1.486 1.359 0 C-N-CA 125.033 1.333 . . . . 0.0 113.125 174.052 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 90' ' ' ARG . . . . . 0.51 ' HD3' ' HB2' ' A' ' 56' ' ' PHE . 51.1 mtt180 -65.15 -18.87 65.67 Favored 'General case' 0 N--CA 1.491 1.605 0 N-CA-C 113.812 1.041 . . . . 0.0 113.812 -170.296 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 91' ' ' PHE . . . . . . . . . . . . . 24.6 p90 -59.68 145.65 44.08 Favored 'General case' 0 N--CA 1.476 0.841 0 C-N-CA 122.688 0.395 . . . . 0.0 111.571 177.56 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 14.1 mmmm . . . . . 0 CA--C 1.554 1.107 0 C-N-CA 124.736 1.214 . . . . 0.0 111.561 -167.27 . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 20' ' ' MET . . . . . . . . . . . . . 12.5 tpt . . . . . 0 N--CA 1.484 1.243 0 N-CA-C 110.276 -0.268 . . . . 0.0 110.276 . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -160.49 117.97 2.48 Favored 'General case' 0 C--O 1.245 0.858 0 C-N-CA 123.723 0.809 . . . . 0.0 109.648 178.502 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -72.14 82.71 0.99 Allowed 'General case' 0 N--CA 1.476 0.863 0 C-N-CA 123.759 0.824 . . . . 0.0 109.51 177.411 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -153.65 123.63 6.88 Favored 'General case' 0 CA--C 1.54 0.566 0 C-N-CA 124.643 1.177 . . . . 0.0 109.297 -173.599 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 35.4 m -102.02 138.97 19.91 Favored Pre-proline 0 N--CA 1.477 0.899 0 C-N-CA 123.211 0.604 . . . . 0.0 110.822 -179.06 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 25' ' ' PRO . . . . . 0.429 ' HD2' ' NH2' ' A' ' 27' ' ' ARG . 56.3 Cg_endo -82.43 160.54 17.2 Favored 'Trans proline' 0 C--N 1.371 1.76 0 C-N-CA 122.909 2.406 . . . . 0.0 111.987 176.886 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 27.1 mt-30 -90.98 61.86 4.74 Favored 'General case' 0 C--O 1.244 0.79 0 N-CA-C 109.484 -0.562 . . . . 0.0 109.484 173.793 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . 0.429 ' NH2' ' HD2' ' A' ' 25' ' ' PRO . 0.7 OUTLIER -64.08 138.76 58.61 Favored 'General case' 0 CA--C 1.547 0.858 0 N-CA-C 108.341 -0.985 . . . . 0.0 108.341 176.639 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -128.9 -17.57 3.94 Favored 'General case' 0 N--CA 1.482 1.169 0 N-CA-C 112.543 0.572 . . . . 0.0 112.543 -167.537 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 29' ' ' TRP . . . . . . . . . . . . . 2.1 m-90 -126.27 138.1 53.57 Favored 'General case' 0 N--CA 1.481 1.101 0 C-N-CA 122.606 0.362 . . . . 0.0 110.143 -167.765 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 8.4 m -81.83 161.95 23.02 Favored 'General case' 0 CA--C 1.549 0.935 0 N-CA-C 108.191 -1.04 . . . . 0.0 108.191 171.353 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . 0.494 ' HA ' HD11 ' A' ' 34' ' ' LEU . 60.1 t -57.48 -33.3 43.95 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.485 0 C-N-CA 123.003 0.521 . . . . 0.0 110.74 -177.483 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 12.0 pt-20 -68.07 -38.56 82.53 Favored 'General case' 0 N--CA 1.478 0.97 0 C-N-CA 124.558 1.143 . . . . 0.0 111.83 176.026 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 43.2 mt-30 -65.49 -37.76 87.76 Favored 'General case' 0 N--CA 1.48 1.044 0 C-N-CA 122.54 0.336 . . . . 0.0 110.467 176.552 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . 0.5 HD12 ' CD2' ' A' ' 82' ' ' TYR . 72.9 mt -65.15 -56.45 12.83 Favored 'General case' 0 C--N 1.347 0.492 0 O-C-N 123.969 0.793 . . . . 0.0 110.233 -178.516 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 40.2 ptt180 -65.01 -24.47 67.51 Favored 'General case' 0 N--CA 1.481 1.1 0 CA-C-N 115.331 -0.85 . . . . 0.0 111.194 -173.517 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 33.6 t -65.39 116.09 6.33 Favored 'General case' 0 C--O 1.24 0.582 0 N-CA-C 108.599 -0.889 . . . . 0.0 108.599 173.408 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 5.2 tp10 -73.76 -7.01 50.48 Favored 'General case' 0 CA--C 1.553 1.065 0 C-N-CA 123.189 0.596 . . . . 0.0 110.844 -174.668 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 70.8 mt-30 -55.28 -39.29 69.66 Favored 'General case' 0 N--CA 1.479 0.986 0 C-N-CA 124.417 1.087 . . . . 0.0 110.049 167.801 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 3.6 tt -78.88 124.8 84.82 Favored Pre-proline 0 CA--C 1.557 1.221 0 N-CA-C 107.926 -1.139 . . . . 0.0 107.926 173.961 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 40.9 Cg_exo -59.49 -178.54 0.16 Allowed 'Trans proline' 0 C--N 1.379 2.167 0 C-N-CA 123.475 2.783 . . . . 0.0 113.98 171.36 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 52.0 mtmt -106.16 -20.15 13.49 Favored 'General case' 0 N--CA 1.473 0.697 0 CA-C-N 115.901 -0.591 . . . . 0.0 110.808 178.686 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 18.9 ptpt -62.08 -47.21 85.66 Favored 'General case' 0 N--CA 1.474 0.769 0 C-N-CA 123.726 0.811 . . . . 0.0 112.089 -174.764 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 43' ' ' ASP . . . . . 0.528 ' HA ' ' HE2' ' A' ' 46' ' ' LYS . 9.4 p-10 -73.86 -27.95 61.34 Favored 'General case' 0 N--CA 1.472 0.625 0 CA-C-N 116.07 -0.514 . . . . 0.0 111.907 -174.256 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 32.6 mt -68.66 -56.08 13.58 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.944 0 N-CA-C 109.735 -0.469 . . . . 0.0 109.735 175.88 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 79.9 mt -54.77 -38.47 43.96 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.544 0 C-N-CA 123.558 0.743 . . . . 0.0 110.654 175.812 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 46' ' ' LYS . . . . . 0.528 ' HE2' ' HA ' ' A' ' 43' ' ' ASP . 38.6 ttpt -62.63 -45.56 92.28 Favored 'General case' 0 N--CA 1.48 1.054 0 C-N-CA 124.092 0.957 . . . . 0.0 111.721 179.602 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 47' ' ' PHE . . . . . 0.465 ' HE2' ' HZ ' ' A' ' 86' ' ' PHE . 24.3 t80 -66.72 -44.51 81.39 Favored 'General case' 0 N--CA 1.476 0.852 0 CA-C-N 115.719 -0.673 . . . . 0.0 111.295 179.808 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 83.6 mt -71.04 -30.3 66.45 Favored 'General case' 0 CA--C 1.539 0.526 0 CA-C-N 115.516 -0.765 . . . . 0.0 111.2 -175.435 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . 0.457 ' HA ' HD22 ' A' ' 57' ' ' LEU . 2.9 pt20 -81.44 -26.76 35.05 Favored 'General case' 0 N--CA 1.479 1.014 0 O-C-N 123.245 0.34 . . . . 0.0 110.764 175.638 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 10.8 tp10 -62.29 -43.4 98.92 Favored 'General case' 0 N--CA 1.477 0.878 0 C-N-CA 123.611 0.764 . . . . 0.0 110.95 179.196 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 0.7 OUTLIER -107.66 -36.17 6.51 Favored 'General case' 0 N--CA 1.476 0.836 0 CA-C-N 115.94 -0.573 . . . . 0.0 111.682 -171.167 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . 0.555 ' HA2' ' HA ' ' A' ' 91' ' ' PHE . . . -61.85 143.62 48.71 Favored Glycine 0 C--N 1.353 1.508 0 N-CA-C 114.431 0.532 . . . . 0.0 114.431 -177.757 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 92.4 p -78.74 174.7 11.17 Favored 'General case' 0 N--CA 1.485 1.321 0 C-N-CA 123.908 0.883 . . . . 0.0 111.217 -179.081 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 6.8 m-20 -57.24 -44.44 83.85 Favored 'General case' 0 N--CA 1.491 1.585 0 C-N-CA 123.494 0.718 . . . . 0.0 110.95 179.815 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 39.5 t -63.48 -32.68 74.19 Favored 'General case' 0 CA--C 1.548 0.896 0 CA-C-N 115.13 -0.941 . . . . 0.0 111.579 -179.119 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 54.7 t80 -74.27 -48.88 25.78 Favored 'General case' 0 N--CA 1.477 0.887 0 CA-C-O 120.864 0.364 . . . . 0.0 110.53 175.741 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . 0.457 HD22 ' HA ' ' A' ' 49' ' ' GLN . 37.2 mt -70.11 -36.64 74.99 Favored 'General case' 0 N--CA 1.478 0.941 0 CA-C-N 115.427 -0.806 . . . . 0.0 112.398 -169.296 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -71.03 -49.83 40.71 Favored 'General case' 0 N--CA 1.474 0.729 0 C-N-CA 122.919 0.488 . . . . 0.0 111.106 -179.717 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 39.2 mm-40 -69.25 -20.69 63.94 Favored 'General case' 0 N--CA 1.478 0.97 0 N-CA-C 112.745 0.646 . . . . 0.0 112.745 -179.164 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 62.8 m80 -108.77 -3.2 17.95 Favored 'General case' 0 N--CA 1.483 1.213 0 C-N-CA 123.1 0.56 . . . . 0.0 111.459 176.791 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 50.5 mtmt 59.46 28.36 17.72 Favored 'General case' 0 N--CA 1.495 1.79 0 C-N-CA 124.369 1.068 . . . . 0.0 112.732 174.5 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . 0.479 HD12 ' HB1' ' A' ' 81' ' ' ALA . 87.3 mt -88.98 -7.46 55.96 Favored 'General case' 0 N--CA 1.486 1.364 0 C-N-CA 123.776 0.831 . . . . 0.0 112.373 -174.232 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 2.2 pp -78.3 176.72 9.04 Favored 'General case' 0 N--CA 1.479 0.985 0 C-N-CA 123.029 0.532 . . . . 0.0 110.952 177.135 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 78.32 -162.13 49.29 Favored Glycine 0 CA--C 1.526 0.724 0 CA-C-N 115.685 -0.689 . . . . 0.0 113.505 176.816 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -64.6 113.38 3.68 Favored 'General case' 0 N--CA 1.477 0.921 0 C-N-CA 123.524 0.73 . . . . 0.0 109.185 -179.621 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 82.4 mt -54.6 -47.45 72.28 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.947 0 O-C-N 124.123 0.89 . . . . 0.0 111.775 -173.77 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -65.68 -30.29 70.96 Favored 'General case' 0 N--CA 1.483 1.186 0 N-CA-C 111.999 0.37 . . . . 0.0 111.999 -177.494 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 68' ' ' ASN . . . . . 0.483 ' O ' ' HG2' ' A' ' 71' ' ' LYS . 60.0 t30 -73.57 -34.58 65.19 Favored 'General case' 0 N--CA 1.483 1.188 0 C-N-CA 123.356 0.662 . . . . 0.0 110.268 178.141 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 67.1 t -72.94 -34.13 45.3 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.875 0 CA-C-N 115.536 -0.756 . . . . 0.0 110.082 172.247 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -75.75 1.86 13.67 Favored 'General case' 0 N--CA 1.484 1.242 0 C-N-CA 124.112 0.965 . . . . 0.0 112.953 -175.481 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . 0.483 ' HG2' ' O ' ' A' ' 68' ' ' ASN . 18.0 ptpt -94.7 -17.92 21.78 Favored 'General case' 0 N--CA 1.482 1.166 0 CA-C-N 118.186 0.448 . . . . 0.0 110.666 172.891 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 14.1 t -129.09 -12.98 4.58 Favored 'General case' 0 CA--C 1.547 0.84 0 C-N-CA 123.356 0.662 . . . . 0.0 111.861 -169.707 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -99.87 98.29 9.09 Favored 'General case' 0 N--CA 1.472 0.645 0 N-CA-C 107.999 -1.111 . . . . 0.0 107.999 174.863 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 26.6 p-10 -71.33 169.69 14.72 Favored 'General case' 0 N--CA 1.48 1.039 0 O-C-N 123.331 0.395 . . . . 0.0 110.388 -178.546 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . 0.469 ' O ' HG23 ' A' ' 79' ' ' VAL . 3.4 tppp? -61.46 -40.47 94.62 Favored 'General case' 0 CA--C 1.545 0.755 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.911 -175.81 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 23.2 m-20 -58.13 -41.11 82.97 Favored 'General case' 0 N--CA 1.486 1.374 0 C-N-CA 123.485 0.714 . . . . 0.0 111.473 -179.977 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 75.3 t60 -61.44 -40.45 94.52 Favored 'General case' 0 N--CA 1.479 0.993 0 C-N-CA 124.047 0.939 . . . . 0.0 110.827 175.72 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 58.3 mt -75.77 -28.44 58.44 Favored 'General case' 0 N--CA 1.48 1.034 0 C-N-CA 123.234 0.614 . . . . 0.0 112.54 -176.037 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 79' ' ' VAL . . . . . 0.469 HG23 ' O ' ' A' ' 75' ' ' LYS . 61.5 t -67.54 -48.27 77.47 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.704 0 N-CA-C 108.703 -0.851 . . . . 0.0 108.703 172.76 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 53.7 m -60.56 -39.96 89.9 Favored 'General case' 0 CA--C 1.542 0.659 0 CA-C-N 114.828 -1.078 . . . . 0.0 111.124 177.453 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 81' ' ' ALA . . . . . 0.479 ' HB1' HD12 ' A' ' 62' ' ' LEU . . . -70.12 -42.72 72.26 Favored 'General case' 0 CA--C 1.542 0.637 0 C-N-CA 123.049 0.54 . . . . 0.0 111.588 -178.9 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 82' ' ' TYR . . . . . 0.5 ' CD2' HD12 ' A' ' 34' ' ' LEU . 90.2 t80 -62.89 -55.89 22.1 Favored 'General case' 0 N--CA 1.479 0.995 0 C-N-CA 123.982 0.913 . . . . 0.0 110.797 -179.067 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 83' ' ' ASN . . . . . . . . . . . . . 60.8 m-80 -65.1 -46.98 78.83 Favored 'General case' 0 N--CA 1.48 1.041 0 C-N-CA 122.714 0.406 . . . . 0.0 111.589 -175.846 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 26.3 m-70 -67.04 -23.99 65.95 Favored 'General case' 0 N--CA 1.482 1.16 0 C-N-CA 123.511 0.724 . . . . 0.0 112.086 -179.121 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 21.1 tp -59.11 -54.44 47.02 Favored 'General case' 0 N--CA 1.483 1.182 0 CA-C-O 121.205 0.526 . . . . 0.0 110.553 177.5 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 86' ' ' PHE . . . . . 0.465 ' HZ ' ' HE2' ' A' ' 47' ' ' PHE . 6.3 m-85 -75.36 -29.75 60.01 Favored 'General case' 0 N--CA 1.471 0.586 0 CA-C-N 114.242 -1.344 . . . . 0.0 110.874 -176.1 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 22.8 tt0 -54.78 -40.31 69.3 Favored 'General case' 0 N--CA 1.481 1.12 0 C-N-CA 124.732 1.213 . . . . 0.0 111.105 176.378 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 40.7 p -111.62 -7.3 14.28 Favored 'General case' 0 CA--C 1.544 0.719 0 C-N-CA 124.279 1.031 . . . . 0.0 111.381 -176.634 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 89' ' ' LYS . . . . . 0.588 ' HB3' ' HZ1' ' A' ' 89' ' ' LYS . 8.5 mtpm? 52.84 43.26 31.74 Favored 'General case' 0 N--CA 1.481 1.11 0 C-N-CA 124.778 1.231 . . . . 0.0 111.91 -177.812 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 94.1 mtt180 -69.59 -9.01 52.29 Favored 'General case' 0 N--CA 1.49 1.528 0 C-N-CA 123.746 0.818 . . . . 0.0 113.004 179.845 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 91' ' ' PHE . . . . . 0.555 ' HA ' ' HA2' ' A' ' 52' ' ' GLY . 21.1 p90 -65.95 133.94 51.91 Favored 'General case' 0 CA--C 1.546 0.79 0 CA-C-O 120.973 0.416 . . . . 0.0 111.492 174.084 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 61.3 tttp . . . . . 0 C--O 1.252 1.216 0 CA-C-N 115.322 -0.853 . . . . 0.0 108.854 173.599 . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 20' ' ' MET . . . . . . . . . . . . . 55.2 tpp . . . . . 0 N--CA 1.478 0.937 0 N-CA-C 109.459 -0.571 . . . . 0.0 109.459 . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -80.77 93.91 6.31 Favored 'General case' 0 C--O 1.236 0.39 0 N-CA-C 107.772 -1.195 . . . . 0.0 107.772 170.817 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -92.35 15.35 14.07 Favored 'General case' 0 N--CA 1.476 0.875 0 C-N-CA 124.197 0.999 . . . . 0.0 112.066 -174.695 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -83.32 59.19 4.89 Favored 'General case' 0 N--CA 1.48 1.057 0 CA-C-O 121.703 0.763 . . . . 0.0 109.776 176.533 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 35.5 m -82.16 131.83 55.18 Favored Pre-proline 0 CA--C 1.546 0.803 0 CA-C-N 115.039 -0.982 . . . . 0.0 109.799 -176.289 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 25' ' ' PRO . . . . . 0.402 ' HB2' ' HE1' ' A' ' 86' ' ' PHE . 73.5 Cg_endo -74.64 97.28 1.04 Allowed 'Trans proline' 0 C--N 1.37 1.7 0 C-N-CA 122.408 2.072 . . . . 0.0 112.32 -179.772 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 89.4 mt-30 -75.6 88.66 2.73 Favored 'General case' 0 C--O 1.238 0.451 0 N-CA-C 106.415 -1.698 . . . . 0.0 106.415 169.913 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . 0.506 ' HB2' ' OH ' ' A' ' 82' ' ' TYR . 0.0 OUTLIER -55.76 126.34 25.13 Favored 'General case' 0 C--N 1.353 0.758 0 O-C-N 124.115 0.885 . . . . 0.0 110.918 -172.261 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -91.39 -34.96 14.66 Favored 'General case' 0 N--CA 1.469 0.525 0 CA-C-N 115.099 -0.955 . . . . 0.0 111.436 -169.222 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 29' ' ' TRP . . . . . . . . . . . . . 4.4 m-90 -115.17 149.86 36.98 Favored 'General case' 0 N--CA 1.469 0.48 0 CA-C-N 115.51 -0.768 . . . . 0.0 111.433 -169.443 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 80.8 p -90.74 168.98 11.35 Favored 'General case' 0 CA--C 1.54 0.574 0 CA-C-N 115.275 -0.875 . . . . 0.0 109.223 172.512 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . 0.488 ' HA ' HD13 ' A' ' 34' ' ' LEU . 2.6 p -52.17 -41.66 33.8 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.416 0 C-N-CA 123.737 0.815 . . . . 0.0 112.633 -177.214 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 12.7 pt-20 -73.77 -36.44 65.09 Favored 'General case' 0 N--CA 1.478 0.961 0 C-N-CA 124.135 0.974 . . . . 0.0 112.111 -178.398 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 52.7 mt-30 -61.1 -38.58 86.82 Favored 'General case' 0 N--CA 1.49 1.538 0 C-N-CA 122.705 0.402 . . . . 0.0 110.101 175.267 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . 0.495 HD11 ' CD2' ' A' ' 82' ' ' TYR . 36.1 mt -63.03 -41.32 99.5 Favored 'General case' 0 N--CA 1.473 0.699 0 CA-C-N 115.466 -0.788 . . . . 0.0 110.626 178.266 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 32.5 mtp180 -70.44 -30.31 67.13 Favored 'General case' 0 N--CA 1.478 0.939 0 C-N-CA 123.352 0.661 . . . . 0.0 111.518 -179.636 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 34.0 t -66.13 114.07 4.98 Favored 'General case' 0 N--CA 1.473 0.715 0 C-N-CA 123.308 0.643 . . . . 0.0 110.41 -179.949 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . 0.497 ' HA ' ' HZ1' ' A' ' 75' ' ' LYS . 41.0 mt-10 -73.32 -10.98 60.32 Favored 'General case' 0 CA--C 1.55 0.951 0 C-N-CA 123.454 0.702 . . . . 0.0 112.297 -176.642 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 79.1 mm-40 -55.57 -37.81 68.51 Favored 'General case' 0 N--CA 1.488 1.428 0 C-N-CA 123.695 0.798 . . . . 0.0 109.703 166.257 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 4.8 tt -78.44 128.87 76.42 Favored Pre-proline 0 CA--C 1.553 1.065 0 N-CA-C 107.329 -1.36 . . . . 0.0 107.329 170.746 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 47.5 Cg_exo -60.2 172.55 2.41 Favored 'Trans proline' 0 C--N 1.373 1.844 0 C-N-CA 123.259 2.639 . . . . 0.0 114.63 176.464 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 55.9 mtmt -93.36 -32.17 14.37 Favored 'General case' 0 N--CA 1.475 0.786 0 C-N-CA 123.662 0.785 . . . . 0.0 110.706 173.213 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 21.3 ptmt -63.83 -41.39 97.85 Favored 'General case' 0 CA--C 1.545 0.761 0 C-N-CA 123.911 0.884 . . . . 0.0 112.475 -172.801 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 30.4 p-10 -71.2 -32.37 68.76 Favored 'General case' 0 N--CA 1.481 1.103 0 C-N-CA 123.142 0.577 . . . . 0.0 111.912 -175.753 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 33.5 mt -68.85 -48.87 68.39 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.198 0 N-CA-C 109.982 -0.377 . . . . 0.0 109.982 176.079 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 79.6 mt -60.71 -39.97 83.34 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.364 0 C-N-CA 123.102 0.561 . . . . 0.0 110.938 178.005 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 84.7 tttt -62.76 -44.21 96.79 Favored 'General case' 0 CA--C 1.544 0.735 0 CA-C-N 115.436 -0.802 . . . . 0.0 110.784 177.788 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 1.0 OUTLIER -57.94 -52.08 66.99 Favored 'General case' 0 N--CA 1.484 1.256 0 O-C-N 124.248 0.967 . . . . 0.0 109.324 177.518 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . 0.471 HD23 ' HA ' ' A' ' 82' ' ' TYR . 96.3 mt -67.4 -31.6 71.92 Favored 'General case' 0 N--CA 1.471 0.612 0 CA-C-N 114.906 -1.043 . . . . 0.0 113.052 -174.732 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . 0.487 ' HA ' HD21 ' A' ' 57' ' ' LEU . 3.4 pt20 -84.18 -27.4 28.08 Favored 'General case' 0 N--CA 1.482 1.162 0 CA-C-N 117.886 0.312 . . . . 0.0 111.359 178.483 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 40.3 tt0 -75.19 -36.83 61.4 Favored 'General case' 0 N--CA 1.474 0.754 0 C-N-CA 123.387 0.675 . . . . 0.0 111.346 179.611 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 69.1 m80 -107.87 -35.46 6.64 Favored 'General case' 0 N--CA 1.476 0.855 0 CA-C-N 115.562 -0.745 . . . . 0.0 112.06 -173.163 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -66.67 172.89 27.4 Favored Glycine 0 CA--C 1.528 0.883 0 CA-C-N 117.691 0.223 . . . . 0.0 113.346 176.314 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 53' ' ' SER . . . . . 0.453 ' O ' ' HG ' ' A' ' 57' ' ' LEU . 64.0 p -94.32 161.42 14.25 Favored 'General case' 0 N--CA 1.48 1.033 0 C-N-CA 123.154 0.582 . . . . 0.0 109.825 176.514 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 5.1 p-10 -63.26 -34.27 77.31 Favored 'General case' 0 N--CA 1.485 1.283 0 C-N-CA 122.897 0.479 . . . . 0.0 111.757 -176.384 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 23.1 t -67.86 -39.6 83.75 Favored 'General case' 0 N--CA 1.481 1.076 0 C-N-CA 123.619 0.768 . . . . 0.0 110.44 177.821 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 47.7 t80 -59.78 -37.66 79.68 Favored 'General case' 0 N--CA 1.483 1.208 0 C-N-CA 124.191 0.996 . . . . 0.0 110.161 172.972 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . 0.487 HD21 ' HA ' ' A' ' 49' ' ' GLN . 49.0 mt -74.9 -39.01 61.71 Favored 'General case' 0 C--O 1.216 -0.684 0 CA-C-N 115.836 -0.62 . . . . 0.0 112.012 -177.911 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -66.89 -46.74 73.97 Favored 'General case' 0 N--CA 1.481 1.086 0 CA-C-O 121.344 0.592 . . . . 0.0 110.435 -178.444 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 43.4 mt-10 -66.2 -26.11 67.24 Favored 'General case' 0 CA--C 1.55 0.954 0 CA-C-N 114.939 -1.028 . . . . 0.0 112.264 178.942 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 33.1 m80 -116.7 9.18 13.96 Favored 'General case' 0 N--CA 1.493 1.691 0 N-CA-C 112.888 0.699 . . . . 0.0 112.888 -178.862 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 34.1 mmtp 57.81 26.57 13.34 Favored 'General case' 0 N--CA 1.498 1.934 0 C-N-CA 124.224 1.01 . . . . 0.0 113.34 173.11 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . 0.413 HD12 ' HB1' ' A' ' 81' ' ' ALA . 73.1 mt -87.36 -9.67 54.19 Favored 'General case' 0 N--CA 1.485 1.303 0 C-N-CA 123.72 0.808 . . . . 0.0 112.187 -176.379 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 1.8 pp -80.13 165.85 22.06 Favored 'General case' 0 N--CA 1.479 0.99 0 C-N-CA 122.725 0.41 . . . . 0.0 111.002 175.923 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 92.9 -162.32 26.25 Favored Glycine 0 C--N 1.339 0.729 0 CA-C-N 115.307 -0.861 . . . . 0.0 111.891 -178.877 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 65' ' ' ASN . . . . . 0.435 ' O ' HG21 ' A' ' 69' ' ' VAL . 28.6 t-20 -69.77 122.25 18.83 Favored 'General case' 0 N--CA 1.467 0.401 0 N-CA-C 109.564 -0.532 . . . . 0.0 109.564 -178.921 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 62.6 mt -60.57 -44.6 97.07 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.376 0 C-N-CA 124.19 0.996 . . . . 0.0 111.305 -169.904 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 41.1 mtpt -57.31 -43.07 82.95 Favored 'General case' 0 CA--C 1.548 0.899 0 C-N-CA 124.495 1.118 . . . . 0.0 111.118 177.201 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 68' ' ' ASN . . . . . 0.448 ' O ' ' HG2' ' A' ' 71' ' ' LYS . 5.9 t30 -72.87 -29.86 63.52 Favored 'General case' 0 CA--C 1.55 0.964 0 CA-C-N 115.31 -0.859 . . . . 0.0 111.09 -178.857 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 69' ' ' VAL . . . . . 0.435 HG21 ' O ' ' A' ' 65' ' ' ASN . 57.7 t -72.11 -39.1 64.98 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.058 0 N-CA-C 109.798 -0.445 . . . . 0.0 109.798 173.527 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -71.18 -8.38 53.14 Favored 'General case' 0 N--CA 1.479 1.011 0 C-N-CA 124.145 0.978 . . . . 0.0 112.903 -175.272 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . 0.448 ' HG2' ' O ' ' A' ' 68' ' ' ASN . 53.1 pttt -88.38 -19.93 25.97 Favored 'General case' 0 N--CA 1.481 1.089 0 CA-C-N 117.872 0.305 . . . . 0.0 110.51 177.781 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 10.3 t -128.85 -13.76 4.6 Favored 'General case' 0 N--CA 1.478 0.932 0 C-N-CA 123.587 0.755 . . . . 0.0 111.862 -167.716 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -103.81 100.99 10.8 Favored 'General case' 0 N--CA 1.469 0.508 0 N-CA-C 107.514 -1.291 . . . . 0.0 107.514 175.336 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 25.6 p-10 -71.04 174.2 6.56 Favored 'General case' 0 N--CA 1.478 0.965 0 C-N-CA 122.884 0.474 . . . . 0.0 111.113 -173.249 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . 0.497 ' HZ1' ' HA ' ' A' ' 37' ' ' GLU . 9.2 tptm -64.57 -38.09 89.8 Favored 'General case' 0 CA--C 1.545 0.778 0 C-N-CA 122.598 0.359 . . . . 0.0 110.846 -173.274 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 28.5 m-20 -64.32 -35.8 82.05 Favored 'General case' 0 N--CA 1.48 1.039 0 C-N-CA 123.508 0.723 . . . . 0.0 111.237 178.849 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 18.8 t60 -60.62 -42.32 96.63 Favored 'General case' 0 N--CA 1.482 1.15 0 C-N-CA 124.159 0.984 . . . . 0.0 110.503 176.538 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 42.2 mt -68.34 -37.31 80.39 Favored 'General case' 0 N--CA 1.473 0.716 0 CA-C-N 115.159 -0.928 . . . . 0.0 111.528 -175.528 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 79' ' ' VAL . . . . . 0.474 ' HA ' HD12 ' A' ' 34' ' ' LEU . 47.2 t -62.89 -49.12 84.9 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.751 0 C-N-CA 124.025 0.93 . . . . 0.0 110.008 175.495 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 70.7 m -60.81 -46.27 91.17 Favored 'General case' 0 CA--C 1.545 0.761 0 CA-C-N 114.293 -1.321 . . . . 0.0 111.681 -179.045 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 81' ' ' ALA . . . . . 0.413 ' HB1' HD12 ' A' ' 62' ' ' LEU . . . -68.84 -43.32 75.73 Favored 'General case' 0 N--CA 1.478 0.975 0 C-N-CA 123.516 0.727 . . . . 0.0 111.443 -177.639 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 82' ' ' TYR . . . . . 0.506 ' OH ' ' HB2' ' A' ' 27' ' ' ARG . 86.5 t80 -58.64 -55.31 36.77 Favored 'General case' 0 N--CA 1.476 0.853 0 C-N-CA 124.276 1.03 . . . . 0.0 110.408 -179.334 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 83' ' ' ASN . . . . . . . . . . . . . 93.0 m-20 -64.9 -34.7 79.02 Favored 'General case' 0 N--CA 1.477 0.879 0 C-N-CA 123.43 0.692 . . . . 0.0 111.545 -175.992 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 24.5 m170 -72.29 -26.81 62.12 Favored 'General case' 0 N--CA 1.487 1.419 0 C-N-CA 123.225 0.61 . . . . 0.0 112.354 176.965 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 85' ' ' LEU . . . . . 0.496 ' HG ' ' HD2' ' A' ' 91' ' ' PHE . 43.5 tp -57.1 -53.09 61.99 Favored 'General case' 0 N--CA 1.485 1.31 0 CA-C-O 121.935 0.874 . . . . 0.0 110.768 178.223 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 86' ' ' PHE . . . . . 0.422 ' HA ' ' HE2' ' A' ' 91' ' ' PHE . 31.7 m-85 -74.2 -32.23 62.95 Favored 'General case' 0 CA--C 1.54 0.587 0 CA-C-N 113.532 -1.667 . . . . 0.0 110.974 -177.916 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 34.2 tt0 -61.26 -44.86 96.55 Favored 'General case' 0 N--CA 1.48 1.055 0 C-N-CA 123.928 0.891 . . . . 0.0 111.847 -176.2 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 37.4 p -109.59 6.67 24.12 Favored 'General case' 0 CA--C 1.544 0.743 0 C-N-CA 123.644 0.778 . . . . 0.0 111.418 -176.004 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 13.4 mmmm 57.14 35.09 25.82 Favored 'General case' 0 N--CA 1.492 1.629 0 C-N-CA 124.471 1.108 . . . . 0.0 111.504 173.644 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 47.2 mtt-85 -65.74 -24.02 66.86 Favored 'General case' 0 N--CA 1.491 1.624 0 N-CA-C 113.518 0.933 . . . . 0.0 113.518 -172.146 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 91' ' ' PHE . . . . . 0.496 ' HD2' ' HG ' ' A' ' 85' ' ' LEU . 5.5 p90 -57.51 161.56 3.44 Favored 'General case' 0 CA--C 1.551 0.996 0 N-CA-C 114.351 1.241 . . . . 0.0 114.351 -172.946 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 16.3 ptmt . . . . . 0 CA--C 1.562 1.413 0 C-N-CA 126.101 1.76 . . . . 0.0 113.573 -171.198 . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 20' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.481 1.123 0 CA-C-O 120.988 0.423 . . . . 0.0 110.5 . . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -151.34 91.04 1.63 Allowed 'General case' 0 C--O 1.235 0.341 0 N-CA-C 108.121 -1.066 . . . . 0.0 108.121 174.543 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -71.63 83.07 0.85 Allowed 'General case' 0 N--CA 1.474 0.743 0 C-N-CA 123.341 0.656 . . . . 0.0 110.819 -176.406 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -88.29 83.42 6.91 Favored 'General case' 0 C--O 1.238 0.46 0 C-N-CA 124.063 0.945 . . . . 0.0 108.836 178.689 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . 0.415 ' HB ' ' CD2' ' A' ' 91' ' ' PHE . 23.7 m -68.28 134.52 91.23 Favored Pre-proline 0 CA--C 1.548 0.898 0 CA-C-N 115.695 -0.684 . . . . 0.0 110.071 -176.582 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 46.0 Cg_exo -58.74 102.11 0.14 Allowed 'Trans proline' 0 C--N 1.383 2.361 0 C-N-CA 122.739 2.292 . . . . 0.0 112.179 178.372 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 30.0 pt20 -64.68 167.86 6.81 Favored 'General case' 0 C--O 1.24 0.582 0 CA-C-N 114.725 -1.125 . . . . 0.0 110.167 178.03 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -53.53 125.34 17.72 Favored 'General case' 0 CA--C 1.547 0.847 0 CA-C-O 121.391 0.615 . . . . 0.0 111.135 175.865 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -82.0 -29.72 31.94 Favored 'General case' 0 N--CA 1.473 0.695 0 CA-C-N 115.193 -0.912 . . . . 0.0 108.787 176.439 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 29' ' ' TRP . . . . . . . . . . . . . 4.8 m-90 -134.63 146.51 49.63 Favored 'General case' 0 N--CA 1.464 0.274 0 CA-C-N 114.065 -1.425 . . . . 0.0 108.95 -177.28 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 22.7 p -86.59 175.35 8.36 Favored 'General case' 0 N--CA 1.472 0.641 0 N-CA-C 108.967 -0.753 . . . . 0.0 108.967 170.375 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . 0.474 HG22 HH21 ' A' ' 35' ' ' ARG . 14.8 p -62.21 -31.92 53.07 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.214 0 C-N-CA 122.693 0.397 . . . . 0.0 111.319 -176.157 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 12.5 pt-20 -70.99 -38.78 72.71 Favored 'General case' 0 N--CA 1.48 1.063 0 C-N-CA 124.003 0.921 . . . . 0.0 111.79 176.681 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 53.1 mt-30 -69.11 -38.15 78.76 Favored 'General case' 0 N--CA 1.477 0.92 0 C-N-CA 122.921 0.488 . . . . 0.0 110.554 176.171 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . 0.473 HD12 ' HA ' ' A' ' 31' ' ' VAL . 87.3 mt -63.48 -50.93 67.75 Favored 'General case' 0 N--CA 1.48 1.062 0 C-N-CA 123.482 0.713 . . . . 0.0 111.171 -178.719 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . 0.474 HH21 HG22 ' A' ' 31' ' ' VAL . 18.6 ptp180 -69.89 -12.93 61.99 Favored 'General case' 0 CA--C 1.553 1.067 0 O-C-N 124.18 0.925 . . . . 0.0 111.474 -175.97 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 35.7 t -63.23 118.27 7.73 Favored 'General case' 0 N--CA 1.472 0.635 0 C-N-CA 123.387 0.675 . . . . 0.0 109.219 173.721 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 14.1 pt-20 -64.4 -30.21 71.25 Favored 'General case' 0 CA--C 1.548 0.879 0 C-N-CA 123.376 0.67 . . . . 0.0 111.725 -176.893 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 77.6 mt-30 -66.91 -19.06 65.66 Favored 'General case' 0 N--CA 1.484 1.252 0 C-N-CA 123.652 0.781 . . . . 0.0 111.584 179.942 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 1.8 tt -79.12 116.4 59.91 Favored Pre-proline 0 CA--C 1.551 1.008 0 N-CA-C 106.429 -1.693 . . . . 0.0 106.429 170.795 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 19.2 Cg_endo -58.57 119.97 7.55 Favored 'Trans proline' 0 C--N 1.378 2.085 0 C-N-CA 122.722 2.281 . . . . 0.0 111.62 177.011 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 58.2 pttt -56.65 -30.48 63.4 Favored 'General case' 0 N--CA 1.48 1.068 0 C-N-CA 125.039 1.335 . . . . 0.0 112.67 -177.987 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . 0.424 ' HA ' HD13 ' A' ' 45' ' ' ILE . 22.5 pttp -71.41 -31.96 67.84 Favored 'General case' 0 CA--C 1.545 0.755 0 C-N-CA 123.408 0.683 . . . . 0.0 110.796 -179.486 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -73.28 -25.94 60.88 Favored 'General case' 0 N--CA 1.478 0.926 0 C-N-CA 123.028 0.531 . . . . 0.0 110.814 177.624 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 59.9 mt -67.68 -51.18 53.66 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.93 0 N-CA-C 109.294 -0.632 . . . . 0.0 109.294 171.649 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 45' ' ' ILE . . . . . 0.424 HD13 ' HA ' ' A' ' 42' ' ' LYS . 62.8 mt -54.25 -41.84 53.97 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.694 0 C-N-CA 123.827 0.851 . . . . 0.0 110.41 175.911 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 37.1 ttpt -63.45 -41.65 98.65 Favored 'General case' 0 CA--C 1.543 0.68 0 C-N-CA 124.625 1.17 . . . . 0.0 111.419 -178.089 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 27.4 t80 -66.02 -47.63 73.8 Favored 'General case' 0 N--CA 1.479 0.999 0 CA-C-N 115.794 -0.639 . . . . 0.0 111.015 178.116 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 84.9 mt -70.41 -29.83 66.55 Favored 'General case' 0 N--CA 1.471 0.61 0 C-N-CA 123.883 0.873 . . . . 0.0 111.947 -174.287 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 2.9 pt20 -79.57 -26.61 41.31 Favored 'General case' 0 N--CA 1.484 1.248 0 O-C-N 123.13 0.269 . . . . 0.0 110.482 175.163 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 43.5 tt0 -66.14 -26.98 67.69 Favored 'General case' 0 N--CA 1.482 1.153 0 C-N-CA 123.697 0.799 . . . . 0.0 112.003 -177.332 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 51' ' ' HIS . . . . . 0.469 ' NE2' HD11 ' A' ' 85' ' ' LEU . 47.7 p-80 -126.62 -17.01 5.14 Favored 'General case' 0 N--CA 1.486 1.334 0 N-CA-C 112.952 0.723 . . . . 0.0 112.952 -179.645 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -73.19 142.99 32.45 Favored Glycine 0 N--CA 1.472 1.052 0 CA-C-N 118.132 0.424 . . . . 0.0 112.593 176.247 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 53' ' ' SER . . . . . 0.43 ' O ' ' HG ' ' A' ' 57' ' ' LEU . 32.7 t -76.1 155.18 34.96 Favored 'General case' 0 N--CA 1.48 1.039 0 C-N-CA 123.142 0.577 . . . . 0.0 110.26 177.052 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 22.1 m-20 -63.73 -31.83 73.12 Favored 'General case' 0 N--CA 1.492 1.634 0 C-N-CA 123.204 0.602 . . . . 0.0 112.493 -170.473 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 28.9 t -70.05 -28.26 65.31 Favored 'General case' 0 N--CA 1.474 0.76 0 C-N-CA 123.179 0.592 . . . . 0.0 110.869 179.575 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 82.1 t80 -74.92 -48.97 21.86 Favored 'General case' 0 CA--C 1.545 0.759 0 N-CA-C 109.589 -0.523 . . . . 0.0 109.589 170.102 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . 0.43 ' HG ' ' O ' ' A' ' 53' ' ' SER . 79.0 mt -60.07 -46.62 88.96 Favored 'General case' 0 C--O 1.213 -0.839 0 CA-C-N 115.144 -0.934 . . . . 0.0 111.867 -169.965 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -64.63 -44.8 89.35 Favored 'General case' 0 N--CA 1.481 1.105 0 C-N-CA 123.729 0.811 . . . . 0.0 111.704 -177.361 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 19.1 mm-40 -62.03 -21.66 65.08 Favored 'General case' 0 N--CA 1.483 1.204 0 C-N-CA 123.186 0.595 . . . . 0.0 112.192 177.39 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 21.3 m80 -113.95 1.15 14.62 Favored 'General case' 0 N--CA 1.488 1.448 0 C-N-CA 123.611 0.764 . . . . 0.0 111.098 179.083 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 38.4 mtmm 56.99 25.68 10.96 Favored 'General case' 0 N--CA 1.483 1.202 0 C-N-CA 125.47 1.508 . . . . 0.0 113.706 -179.91 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . 0.449 HD12 ' HB2' ' A' ' 81' ' ' ALA . 90.0 mt -76.09 -14.77 60.18 Favored 'General case' 0 N--CA 1.477 0.886 0 C-N-CA 123.006 0.523 . . . . 0.0 112.344 -178.597 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 2.0 pp -86.08 174.99 8.8 Favored 'General case' 0 N--CA 1.479 1.013 0 CA-C-O 121.018 0.437 . . . . 0.0 110.946 176.109 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 84.53 -163.35 38.76 Favored Glycine 0 C--N 1.344 0.994 0 CA-C-N 115.481 -0.781 . . . . 0.0 112.384 179.473 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 30.4 m-80 -61.92 110.2 1.48 Allowed 'General case' 0 C--N 1.354 0.767 0 N-CA-C 109.139 -0.689 . . . . 0.0 109.139 176.491 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 66' ' ' ILE . . . . . 0.407 HG22 ' HB2' ' A' ' 42' ' ' LYS . 75.0 mt -61.02 -38.91 80.56 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.702 0 O-C-N 124.119 0.887 . . . . 0.0 110.769 -176.42 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 61.9 pttt -59.31 -36.89 76.44 Favored 'General case' 0 CA--C 1.553 1.084 0 C-N-CA 123.503 0.721 . . . . 0.0 111.271 176.483 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 68' ' ' ASN . . . . . 0.414 ' O ' ' HG2' ' A' ' 71' ' ' LYS . 48.3 t-20 -72.22 -44.5 62.83 Favored 'General case' 0 N--CA 1.478 0.97 0 C-N-CA 123.459 0.704 . . . . 0.0 109.726 179.594 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 69' ' ' VAL . . . . . 0.419 HG13 ' HB3' ' A' ' 73' ' ' ALA . 98.0 t -60.58 -39.03 80.09 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.733 0 CA-C-N 115.707 -0.679 . . . . 0.0 110.49 178.457 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -63.29 -17.25 62.32 Favored 'General case' 0 N--CA 1.478 0.967 0 C-N-CA 124.416 1.086 . . . . 0.0 113.282 -175.215 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . 0.414 ' HG2' ' O ' ' A' ' 68' ' ' ASN . 16.1 ptpt -75.61 -22.27 57.02 Favored 'General case' 0 N--CA 1.489 1.521 0 CA-C-N 118.49 0.586 . . . . 0.0 110.91 -178.754 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 13.5 t -122.12 -12.31 8.33 Favored 'General case' 0 CA--C 1.543 0.703 0 C-N-CA 124.169 0.987 . . . . 0.0 110.607 -179.135 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . 0.481 ' HB1' HD21 ' A' ' 78' ' ' LEU . . . -77.49 86.19 3.85 Favored 'General case' 0 C--N 1.349 0.552 0 CA-C-O 121.461 0.648 . . . . 0.0 109.67 179.673 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 74' ' ' ASN . . . . . 0.425 ' ND2' ' HB3' ' A' ' 76' ' ' ASP . 7.9 p-10 -73.12 150.36 42.29 Favored 'General case' 0 C--O 1.24 0.58 0 CA-C-N 114.507 -1.224 . . . . 0.0 108.548 174.838 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . 0.521 ' HB2' ' HZ3' ' A' ' 75' ' ' LYS . 2.1 ttmp? -68.96 -26.66 65.16 Favored 'General case' 0 CA--C 1.544 0.72 0 C-N-CA 123.4 0.68 . . . . 0.0 111.482 -167.125 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 76' ' ' ASP . . . . . 0.425 ' HB3' ' ND2' ' A' ' 74' ' ' ASN . 28.4 t70 -62.95 -43.24 99.33 Favored 'General case' 0 N--CA 1.478 0.959 0 C-N-CA 123.555 0.742 . . . . 0.0 110.604 173.868 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 61.0 t60 -61.95 -42.39 99.05 Favored 'General case' 0 N--CA 1.482 1.165 0 C-N-CA 124.404 1.082 . . . . 0.0 110.664 175.857 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . 0.481 HD21 ' HB1' ' A' ' 73' ' ' ALA . 96.3 mt -65.1 -38.64 91.37 Favored 'General case' 0 N--CA 1.481 1.083 0 C-N-CA 123.571 0.748 . . . . 0.0 112.196 -175.392 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 98.2 t -69.24 -40.33 80.21 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.942 0 CA-C-N 115.606 -0.724 . . . . 0.0 110.503 176.085 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 57.2 m -62.21 -41.47 98.41 Favored 'General case' 0 N--CA 1.48 1.048 0 C-N-CA 123.273 0.629 . . . . 0.0 111.118 177.31 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 81' ' ' ALA . . . . . 0.449 ' HB2' HD12 ' A' ' 62' ' ' LEU . . . -68.74 -42.19 77.92 Favored 'General case' 0 CA--C 1.543 0.699 0 C-N-CA 123.436 0.694 . . . . 0.0 110.659 178.492 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 82' ' ' TYR . . . . . . . . . . . . . 7.5 t80 -52.08 -55.55 20.02 Favored 'General case' 0 N--CA 1.475 0.802 0 C-N-CA 124.434 1.094 . . . . 0.0 110.542 175.61 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 83' ' ' ASN . . . . . . . . . . . . . 28.9 m-80 -64.37 -45.71 86.54 Favored 'General case' 0 N--CA 1.482 1.153 0 C-N-CA 123.31 0.644 . . . . 0.0 111.594 -175.855 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 23.9 m-70 -62.01 -25.37 67.6 Favored 'General case' 0 N--CA 1.481 1.084 0 C-N-CA 123.484 0.714 . . . . 0.0 111.827 -179.541 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 85' ' ' LEU . . . . . 0.469 HD11 ' NE2' ' A' ' 51' ' ' HIS . 2.9 mt -60.85 -52.36 65.38 Favored 'General case' 0 N--CA 1.476 0.857 0 CA-C-O 120.766 0.317 . . . . 0.0 111.126 173.139 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 60.8 m-85 -72.97 -30.68 64.02 Favored 'General case' 0 CA--C 1.553 1.083 0 CA-C-N 115.475 -0.784 . . . . 0.0 111.092 -176.837 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 37.4 tt0 -48.36 -48.55 36.43 Favored 'General case' 0 N--CA 1.491 1.597 0 C-N-CA 126.055 1.742 . . . . 0.0 113.83 -173.532 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 27.3 p -120.62 -4.04 9.79 Favored 'General case' 0 CA--C 1.538 0.492 0 C-N-CA 124.342 1.057 . . . . 0.0 109.99 -178.71 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 32.1 mtmm 62.23 69.88 0.6 Allowed 'General case' 0 C--N 1.357 0.922 0 C-N-CA 124.402 1.081 . . . . 0.0 109.783 -173.843 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 44.6 mtt85 -86.01 15.02 5.36 Favored 'General case' 0 N--CA 1.489 1.524 0 C-N-CA 125.244 1.417 . . . . 0.0 111.837 175.816 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 91' ' ' PHE . . . . . 0.415 ' CD2' ' HB ' ' A' ' 24' ' ' VAL . 1.8 m-30 -56.67 160.11 3.51 Favored 'General case' 0 N--CA 1.477 0.901 0 C-N-CA 124.646 1.178 . . . . 0.0 111.331 171.356 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 92' ' ' LYS . . . . . 0.422 ' HE3' ' HA ' ' A' ' 53' ' ' SER . 40.7 ttmt . . . . . 0 C--O 1.249 1.058 0 N-CA-C 108.106 -1.072 . . . . 0.0 108.106 -179.617 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.541 0.612 0 CA-C-O 121.6 0.714 . . . . 0.0 111.056 . . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -76.24 -37.39 57.74 Favored 'General case' 0 N--CA 1.472 0.627 0 CA-C-N 114.53 -1.214 . . . . 0.0 109.919 -176.859 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 29' ' ' TRP . . . . . . . . . . . . . 2.5 m-90 -120.94 148.13 44.5 Favored 'General case' 0 N--CA 1.471 0.6 0 CA-C-N 114.932 -1.031 . . . . 0.0 109.1 -177.279 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 76.3 p -87.18 175.33 8.11 Favored 'General case' 0 CA--C 1.54 0.596 0 C-N-CA 123.073 0.549 . . . . 0.0 110.006 176.167 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 31' ' ' VAL . . . . . 0.436 HG12 ' HE ' ' A' ' 35' ' ' ARG . 51.8 t -55.87 -46.26 80.07 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.052 0 C-N-CA 123.687 0.795 . . . . 0.0 111.484 -178.732 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 12.7 pt-20 -66.94 -41.51 86.87 Favored 'General case' 0 N--CA 1.475 0.782 0 C-N-CA 123.335 0.654 . . . . 0.0 111.403 -179.245 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 55.3 mt-30 -60.17 -36.52 77.76 Favored 'General case' 0 N--CA 1.479 0.995 0 C-N-CA 123.196 0.598 . . . . 0.0 110.974 178.329 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 85.0 mt -70.19 -51.43 31.1 Favored 'General case' 0 N--CA 1.469 0.497 0 C-N-CA 122.74 0.416 . . . . 0.0 110.427 178.864 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 35' ' ' ARG . . . . . 0.436 ' HE ' HG12 ' A' ' 31' ' ' VAL . 50.5 mtm180 -57.27 -28.45 62.99 Favored 'General case' 0 N--CA 1.484 1.251 0 C-N-CA 123.913 0.885 . . . . 0.0 111.755 -179.371 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 44.6 t -53.93 122.19 9.56 Favored 'General case' 0 CA--C 1.541 0.619 0 C-N-CA 124.262 1.025 . . . . 0.0 110.941 174.848 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 10.9 pt-20 -71.14 -8.82 56.07 Favored 'General case' 0 CA--C 1.549 0.939 0 C-N-CA 123.973 0.909 . . . . 0.0 111.482 179.038 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 95.7 mt-30 -65.89 -47.92 73.2 Favored 'General case' 0 N--CA 1.472 0.667 0 C-N-CA 123.914 0.886 . . . . 0.0 109.712 168.753 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 3.8 tt -76.89 116.92 61.25 Favored Pre-proline 0 CA--C 1.553 1.085 0 N-CA-C 108.126 -1.065 . . . . 0.0 108.126 179.509 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 32.4 Cg_exo -61.63 165.45 13.58 Favored 'Trans proline' 0 C--N 1.38 2.187 0 C-N-CA 123.479 2.786 . . . . 0.0 114.126 176.763 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 36.6 mtmm -81.54 -25.94 35.48 Favored 'General case' 0 N--CA 1.475 0.82 0 CA-C-N 115.722 -0.672 . . . . 0.0 111.004 179.536 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 18.5 ptpt -64.77 -48.11 75.68 Favored 'General case' 0 CA--C 1.547 0.865 0 C-N-CA 123.524 0.73 . . . . 0.0 112.797 -171.394 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 13.6 p-10 -73.28 -23.65 60.33 Favored 'General case' 0 N--CA 1.478 0.936 0 C-N-CA 122.666 0.386 . . . . 0.0 111.852 -176.794 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 54.2 mt -66.89 -52.69 41.76 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.084 0 C-N-CA 123.071 0.549 . . . . 0.0 110.1 171.496 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 80.3 mt -60.13 -34.73 57.92 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.17 0 C-N-CA 123.132 0.573 . . . . 0.0 110.416 177.545 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 2.7 tmtp? -59.77 -50.29 74.41 Favored 'General case' 0 N--CA 1.474 0.761 0 C-N-CA 123.714 0.806 . . . . 0.0 109.075 175.498 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 24.0 t80 -58.77 -45.16 90.39 Favored 'General case' 0 N--CA 1.485 1.319 0 C-N-CA 124.035 0.934 . . . . 0.0 111.627 179.978 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 48' ' ' LEU . . . . . 0.486 ' HB3' ' HE2' ' A' ' 56' ' ' PHE . 92.4 mt -72.01 -32.3 67.05 Favored 'General case' 0 CA--C 1.545 0.782 0 CA-C-N 115.277 -0.874 . . . . 0.0 111.816 -175.879 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 49' ' ' GLN . . . . . 0.559 ' HA ' HD21 ' A' ' 57' ' ' LEU . 3.0 pt20 -85.53 -23.86 27.52 Favored 'General case' 0 N--CA 1.491 1.594 0 C-N-CA 122.724 0.41 . . . . 0.0 112.013 175.051 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 8.5 tp10 -58.36 -39.04 78.47 Favored 'General case' 0 N--CA 1.482 1.165 0 C-N-CA 124.458 1.103 . . . . 0.0 111.24 -179.759 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 2.0 m80 -132.59 -30.23 1.47 Allowed 'General case' 0 N--CA 1.479 0.98 0 CA-C-O 119.034 -0.508 . . . . 0.0 112.169 -175.004 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -59.31 120.16 21.41 Favored Glycine 0 N--CA 1.478 1.434 0 CA-C-O 119.489 -0.617 . . . . 0.0 111.949 175.758 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 22.8 t -70.97 176.44 4.35 Favored 'General case' 0 N--CA 1.484 1.246 0 C-N-CA 123.607 0.763 . . . . 0.0 112.17 -171.251 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 5.6 p-10 -58.57 -36.49 74.02 Favored 'General case' 0 N--CA 1.48 1.056 0 C-N-CA 124.292 1.037 . . . . 0.0 113.429 -168.16 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 27.8 t -69.38 -40.7 77.26 Favored 'General case' 0 N--CA 1.476 0.827 0 C-N-CA 122.839 0.456 . . . . 0.0 110.096 -178.998 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 56' ' ' PHE . . . . . 0.64 ' HB2' ' HB3' ' A' ' 90' ' ' ARG . 65.7 t80 -59.69 -49.29 78.33 Favored 'General case' 0 N--CA 1.477 0.906 0 CA-C-O 121.378 0.609 . . . . 0.0 110.368 175.454 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 57' ' ' LEU . . . . . 0.559 HD21 ' HA ' ' A' ' 49' ' ' GLN . 68.7 mt -67.71 -31.78 71.96 Favored 'General case' 0 C--O 1.221 -0.424 0 CA-C-N 114.626 -1.17 . . . . 0.0 112.082 -176.128 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -73.68 -49.97 23.2 Favored 'General case' 0 N--CA 1.478 0.943 0 C-N-CA 122.798 0.439 . . . . 0.0 111.647 179.345 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 43.6 mt-10 -67.17 -36.59 82.12 Favored 'General case' 0 N--CA 1.485 1.301 0 C-N-CA 123.58 0.752 . . . . 0.0 111.612 -177.782 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 42.6 m-70 -98.77 -4.96 32.22 Favored 'General case' 0 N--CA 1.478 0.972 0 C-N-CA 123.122 0.569 . . . . 0.0 111.892 -177.85 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 62.9 mttp 58.56 41.35 22.54 Favored 'General case' 0 N--CA 1.496 1.849 0 C-N-CA 124.482 1.113 . . . . 0.0 112.641 175.736 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 85.1 mt -102.73 0.94 33.72 Favored 'General case' 0 N--CA 1.479 1.0 0 C-N-CA 123.592 0.757 . . . . 0.0 111.487 -178.749 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 63' ' ' LEU . . . . . 0.433 ' HB3' ' HB3' ' A' ' 57' ' ' LEU . 1.1 pp -77.07 160.73 28.85 Favored 'General case' 0 N--CA 1.483 1.206 0 C-N-CA 122.95 0.5 . . . . 0.0 111.369 174.651 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 89.28 -158.67 27.99 Favored Glycine 0 C--N 1.338 0.666 0 CA-C-N 115.167 -0.924 . . . . 0.0 112.942 173.79 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 36.8 m-80 -61.91 118.3 7.05 Favored 'General case' 0 CA--C 1.539 0.541 0 C-N-CA 123.573 0.749 . . . . 0.0 110.423 179.957 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 84.4 mt -50.05 -51.89 15.7 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.117 0 C-N-CA 124.136 0.975 . . . . 0.0 111.398 -177.617 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 67' ' ' LYS . . . . . 0.44 ' HD3' ' H ' ' A' ' 67' ' ' LYS . 0.0 OUTLIER -61.76 -38.55 88.44 Favored 'General case' 0 CA--C 1.552 1.047 0 C-N-CA 123.47 0.708 . . . . 0.0 112.148 -178.399 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 23.9 t-20 -61.54 -38.34 87.06 Favored 'General case' 0 N--CA 1.485 1.311 0 C-N-CA 123.411 0.684 . . . . 0.0 110.777 175.841 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 99.2 t -73.5 -39.72 54.75 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.786 0 CA-C-N 115.183 -0.917 . . . . 0.0 110.355 175.141 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -69.35 -26.71 64.82 Favored 'General case' 0 N--CA 1.484 1.232 0 C-N-CA 124.388 1.075 . . . . 0.0 112.589 -171.902 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 22.1 ptmt -76.82 -17.13 59.2 Favored 'General case' 0 N--CA 1.477 0.91 0 C-N-CA 122.425 0.29 . . . . 0.0 111.523 -179.94 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 9.1 t -120.98 2.29 10.46 Favored 'General case' 0 CA--C 1.55 0.966 0 C-N-CA 123.94 0.896 . . . . 0.0 110.452 177.801 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 73' ' ' ALA . . . . . 0.423 ' HB1' HD21 ' A' ' 78' ' ' LEU . . . -91.95 121.16 33.28 Favored 'General case' 0 N--CA 1.47 0.55 0 C-N-CA 123.148 0.579 . . . . 0.0 109.932 175.063 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 12.5 p-10 -93.42 145.92 24.13 Favored 'General case' 0 N--CA 1.473 0.678 0 N-CA-C 108.493 -0.929 . . . . 0.0 108.493 168.829 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 4.6 tppp? -59.64 -42.3 92.45 Favored 'General case' 0 N--CA 1.477 0.88 0 C-N-CA 123.842 0.857 . . . . 0.0 112.143 -169.839 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 6.2 p-10 -64.5 -32.45 74.08 Favored 'General case' 0 N--CA 1.477 0.893 0 C-N-CA 123.265 0.626 . . . . 0.0 111.833 -177.102 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 47.5 t60 -68.37 -34.91 76.91 Favored 'General case' 0 N--CA 1.487 1.376 0 C-N-CA 123.484 0.713 . . . . 0.0 110.465 174.046 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 78' ' ' LEU . . . . . 0.423 HD21 ' HB1' ' A' ' 73' ' ' ALA . 84.4 mt -70.23 -35.33 73.79 Favored 'General case' 0 N--CA 1.479 0.977 0 C-N-CA 122.892 0.477 . . . . 0.0 111.465 -179.174 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 53.4 t -71.71 -37.95 64.54 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.788 0 O-C-N 124.084 0.865 . . . . 0.0 110.045 176.748 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 63.6 m -61.49 -47.17 86.87 Favored 'General case' 0 CA--C 1.545 0.756 0 CA-C-N 115.625 -0.716 . . . . 0.0 110.265 173.216 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -63.48 -41.63 98.58 Favored 'General case' 0 N--CA 1.476 0.825 0 C-N-CA 123.606 0.762 . . . . 0.0 110.951 -179.608 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 82' ' ' TYR . . . . . . . . . . . . . 7.8 t80 -55.77 -55.49 31.72 Favored 'General case' 0 CA--C 1.543 0.711 0 C-N-CA 124.954 1.302 . . . . 0.0 111.11 175.964 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 83' ' ' ASN . . . . . . . . . . . . . 70.7 m-20 -65.17 -41.09 94.98 Favored 'General case' 0 N--CA 1.486 1.36 0 C-N-CA 123.302 0.641 . . . . 0.0 111.683 -175.924 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 22.2 m-70 -68.79 -25.58 64.77 Favored 'General case' 0 N--CA 1.479 0.979 0 C-N-CA 123.878 0.871 . . . . 0.0 111.567 178.171 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 85' ' ' LEU . . . . . 0.519 ' HG ' ' HD2' ' A' ' 91' ' ' PHE . 51.2 tp -57.57 -53.95 52.42 Favored 'General case' 0 N--CA 1.487 1.405 0 CA-C-O 121.831 0.824 . . . . 0.0 111.069 178.872 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 43.4 m-85 -73.11 -30.9 63.97 Favored 'General case' 0 CA--C 1.538 0.506 0 CA-C-N 113.787 -1.551 . . . . 0.0 110.889 -177.174 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 44.9 tt0 -66.51 -30.33 70.62 Favored 'General case' 0 CA--C 1.548 0.871 0 C-N-CA 124.141 0.976 . . . . 0.0 111.774 -176.221 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 11.6 p -116.98 2.58 12.74 Favored 'General case' 0 N--CA 1.48 1.071 0 C-N-CA 123.421 0.688 . . . . 0.0 111.618 179.153 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 27.2 mtpp 58.21 30.97 20.2 Favored 'General case' 0 N--CA 1.485 1.285 0 C-N-CA 123.92 0.888 . . . . 0.0 111.815 177.461 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 90' ' ' ARG . . . . . 0.64 ' HB3' ' HB2' ' A' ' 56' ' ' PHE . 53.2 mtt85 -62.8 -12.36 23.88 Favored 'General case' 0 N--CA 1.489 1.513 0 C-N-CA 124.14 0.976 . . . . 0.0 113.095 -175.748 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 91' ' ' PHE . . . . . 0.519 ' HD2' ' HG ' ' A' ' 85' ' ' LEU . 6.9 p90 -77.15 161.66 28.05 Favored 'General case' 0 CA--C 1.542 0.644 0 C-N-CA 123.462 0.705 . . . . 0.0 112.046 174.997 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 19.4 ptmt . . . . . 0 CA--C 1.557 1.218 0 N-CA-C 108.127 -1.064 . . . . 0.0 108.127 169.047 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 38.0 ttp180 . . . . . 0 CA--C 1.537 0.473 0 N-CA-C 109.279 -0.638 . . . . 0.0 109.279 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -93.83 -15.95 24.58 Favored 'General case' 0 N--CA 1.47 0.53 0 CA-C-N 114.485 -1.234 . . . . 0.0 110.847 -174.898 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 29' ' ' TRP . . . . . . . . . . . . . 4.1 m0 -130.57 132.31 45.48 Favored 'General case' 0 N--CA 1.466 0.357 0 C-N-CA 123.791 0.836 . . . . 0.0 108.9 -174.062 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 64.7 p -80.4 174.1 11.94 Favored 'General case' 0 C--O 1.245 0.844 0 N-CA-C 108.912 -0.773 . . . . 0.0 108.912 167.927 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 31' ' ' VAL . . . . . 0.433 ' HA ' HD12 ' A' ' 34' ' ' LEU . 13.5 p -57.35 -35.38 48.97 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.262 0 C-N-CA 122.565 0.346 . . . . 0.0 111.38 -174.724 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 14.8 pt-20 -73.73 -37.75 65.0 Favored 'General case' 0 CA--C 1.551 0.99 0 C-N-CA 123.963 0.905 . . . . 0.0 111.635 178.879 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 33' ' ' GLN . . . . . 0.413 ' O ' HD13 ' A' ' 39' ' ' LEU . 15.4 mm100 -67.49 -33.49 75.22 Favored 'General case' 0 N--CA 1.479 1.014 0 C-N-CA 123.311 0.644 . . . . 0.0 110.666 179.998 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.509 HD11 ' CD2' ' A' ' 82' ' ' TYR . 83.2 mt -59.02 -48.83 80.16 Favored 'General case' 0 N--CA 1.473 0.721 0 N-CA-C 109.256 -0.646 . . . . 0.0 109.256 171.738 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 29.6 mtp180 -68.09 -12.93 61.74 Favored 'General case' 0 N--CA 1.487 1.422 0 CA-C-N 114.638 -1.164 . . . . 0.0 113.221 -176.949 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 46.1 t -56.85 117.64 4.14 Favored 'General case' 0 N--CA 1.48 1.032 0 C-N-CA 123.67 0.788 . . . . 0.0 109.929 176.784 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 12.4 pt-20 -65.58 -33.93 77.06 Favored 'General case' 0 N--CA 1.48 1.044 0 C-N-CA 123.427 0.691 . . . . 0.0 112.06 -172.248 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 18.0 mm-40 -74.07 -22.53 59.49 Favored 'General case' 0 N--CA 1.471 0.597 0 C-N-CA 123.309 0.643 . . . . 0.0 111.19 179.65 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 39' ' ' LEU . . . . . 0.413 HD13 ' O ' ' A' ' 33' ' ' GLN . 5.3 tt -76.2 116.97 60.77 Favored Pre-proline 0 CA--C 1.545 0.781 0 N-CA-C 107.281 -1.377 . . . . 0.0 107.281 171.002 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 17.9 Cg_exo -66.62 136.14 41.4 Favored 'Trans proline' 0 C--N 1.375 1.963 0 C-N-CA 122.831 2.354 . . . . 0.0 111.831 -177.895 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 41' ' ' LYS . . . . . 0.404 ' HB2' ' CD1' ' A' ' 78' ' ' LEU . 16.7 ptpt -64.72 -33.4 75.87 Favored 'General case' 0 CA--C 1.548 0.899 0 C-N-CA 122.963 0.505 . . . . 0.0 110.036 177.365 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 55.0 pttt -71.19 -27.06 63.24 Favored 'General case' 0 N--CA 1.478 0.956 0 C-N-CA 123.946 0.898 . . . . 0.0 111.356 179.912 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 14.9 t70 -63.34 -36.72 84.65 Favored 'General case' 0 CA--C 1.552 1.022 0 C-N-CA 122.97 0.508 . . . . 0.0 109.702 172.561 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 42.8 mt -73.28 -47.17 47.66 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.923 0 C-N-CA 123.902 0.881 . . . . 0.0 110.183 177.818 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 82.7 mt -56.82 -39.53 65.12 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.707 0 C-N-CA 123.553 0.741 . . . . 0.0 110.953 178.973 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 37.8 ttmt -62.96 -44.52 95.84 Favored 'General case' 0 N--CA 1.476 0.865 0 C-N-CA 123.254 0.622 . . . . 0.0 110.679 178.702 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 22.8 t80 -59.34 -46.39 88.74 Favored 'General case' 0 N--CA 1.478 0.951 0 CA-C-N 115.269 -0.878 . . . . 0.0 110.42 177.274 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 48' ' ' LEU . . . . . 0.407 ' HB3' ' HE2' ' A' ' 56' ' ' PHE . 96.6 mt -72.47 -30.76 64.84 Favored 'General case' 0 CA--C 1.539 0.555 0 CA-C-N 114.625 -1.171 . . . . 0.0 112.212 -175.187 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 49' ' ' GLN . . . . . 0.542 ' HA ' HD21 ' A' ' 57' ' ' LEU . 3.0 pt20 -84.08 -34.24 24.21 Favored 'General case' 0 N--CA 1.483 1.176 0 CA-C-N 117.895 0.316 . . . . 0.0 111.42 179.796 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 43.0 tt0 -67.89 -39.67 83.63 Favored 'General case' 0 N--CA 1.48 1.056 0 CA-C-O 121.403 0.621 . . . . 0.0 110.569 -179.913 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 76.7 m80 -96.37 -49.8 5.03 Favored 'General case' 0 N--CA 1.469 0.503 0 CA-C-N 114.865 -1.061 . . . . 0.0 111.297 -175.584 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 52' ' ' GLY . . . . . 0.542 ' HA2' ' HA ' ' A' ' 91' ' ' PHE . . . -60.77 141.31 48.1 Favored Glycine 0 C--N 1.345 1.063 0 O-C-N 123.396 0.435 . . . . 0.0 113.698 178.505 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 16.8 t -88.54 174.03 8.31 Favored 'General case' 0 N--CA 1.479 1.016 0 C-N-CA 122.737 0.415 . . . . 0.0 111.296 -176.842 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 3.2 m-20 -48.29 -45.43 34.78 Favored 'General case' 0 N--CA 1.489 1.477 0 C-N-CA 125.839 1.656 . . . . 0.0 113.831 -170.187 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 42.0 t -66.35 -43.09 87.03 Favored 'General case' 0 N--CA 1.478 0.975 0 C-N-CA 123.402 0.681 . . . . 0.0 110.855 -178.386 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 56' ' ' PHE . . . . . 0.543 ' HB2' ' HB3' ' A' ' 90' ' ' ARG . 85.1 t80 -62.08 -40.2 95.01 Favored 'General case' 0 N--CA 1.48 1.037 0 C-N-CA 123.324 0.65 . . . . 0.0 110.316 176.499 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 57' ' ' LEU . . . . . 0.542 HD21 ' HA ' ' A' ' 49' ' ' GLN . 32.0 mt -73.01 -35.68 66.86 Favored 'General case' 0 C--O 1.218 -0.591 0 CA-C-N 115.095 -0.957 . . . . 0.0 111.906 -175.532 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -73.54 -49.32 27.07 Favored 'General case' 0 N--CA 1.473 0.69 0 C-N-CA 122.64 0.376 . . . . 0.0 110.785 179.416 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 27.2 mm-40 -55.15 -36.89 66.29 Favored 'General case' 0 N--CA 1.481 1.114 0 C-N-CA 123.756 0.822 . . . . 0.0 112.253 178.586 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 57.9 m80 -108.11 1.5 22.33 Favored 'General case' 0 CA--C 1.55 0.978 0 C-N-CA 123.022 0.529 . . . . 0.0 112.338 -177.117 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 57.4 mtpt 54.93 35.31 24.19 Favored 'General case' 0 N--CA 1.496 1.857 0 C-N-CA 124.405 1.082 . . . . 0.0 112.796 177.375 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 62' ' ' LEU . . . . . 0.441 ' HA ' HG11 ' A' ' 69' ' ' VAL . 92.3 mt -90.13 -6.62 55.19 Favored 'General case' 0 N--CA 1.482 1.133 0 C-N-CA 123.483 0.713 . . . . 0.0 111.931 -176.319 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 63' ' ' LEU . . . . . 0.418 ' H ' ' HG ' ' A' ' 63' ' ' LEU . 1.2 pp -73.51 162.65 29.03 Favored 'General case' 0 N--CA 1.481 1.079 0 C-N-CA 123.749 0.82 . . . . 0.0 111.75 179.146 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 81.23 -148.26 28.05 Favored Glycine 0 CA--C 1.528 0.864 0 CA-C-N 115.353 -0.84 . . . . 0.0 113.613 174.614 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 4.0 m-20 -68.0 113.96 6.13 Favored 'General case' 0 N--CA 1.478 0.949 0 C-N-CA 123.269 0.628 . . . . 0.0 109.505 -178.465 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 41.4 mt -55.02 -45.33 76.75 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.874 0 O-C-N 124.822 1.326 . . . . 0.0 110.968 -177.063 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 62.6 pttt -60.71 -37.44 81.69 Favored 'General case' 0 CA--C 1.554 1.114 0 C-N-CA 123.994 0.917 . . . . 0.0 111.93 179.459 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 68' ' ' ASN . . . . . 0.404 ' O ' ' HG2' ' A' ' 71' ' ' LYS . 61.5 t30 -72.75 -36.68 67.75 Favored 'General case' 0 N--CA 1.48 1.056 0 C-N-CA 123.376 0.67 . . . . 0.0 110.456 179.485 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 69' ' ' VAL . . . . . 0.441 HG11 ' HA ' ' A' ' 62' ' ' LEU . 57.8 t -66.25 -36.4 77.31 Favored 'Isoleucine or valine' 0 C--O 1.214 -0.789 0 CA-C-N 115.562 -0.745 . . . . 0.0 109.621 173.017 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -67.52 -15.42 63.65 Favored 'General case' 0 N--CA 1.478 0.962 0 C-N-CA 123.963 0.905 . . . . 0.0 113.349 -174.317 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 71' ' ' LYS . . . . . 0.404 ' HG2' ' O ' ' A' ' 68' ' ' ASN . 21.2 ptmt -94.65 -19.99 19.95 Favored 'General case' 0 N--CA 1.481 1.077 0 O-C-N 121.617 -0.677 . . . . 0.0 111.872 177.691 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 9.0 t -112.84 -15.07 12.99 Favored 'General case' 0 N--CA 1.484 1.23 0 C-N-CA 123.155 0.582 . . . . 0.0 111.716 -176.574 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -110.91 101.56 10.13 Favored 'General case' 0 C--O 1.24 0.56 0 C-N-CA 124.139 0.976 . . . . 0.0 108.41 178.892 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 26.1 p-10 -72.06 160.76 31.93 Favored 'General case' 0 CA--C 1.534 0.353 0 CA-C-N 116.242 -0.436 . . . . 0.0 110.277 177.009 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 75' ' ' LYS . . . . . 0.461 ' HD3' ' O ' ' A' ' 34' ' ' LEU . 36.8 ttmt -63.84 -33.28 75.34 Favored 'General case' 0 CA--C 1.543 0.704 0 C-N-CA 123.549 0.74 . . . . 0.0 111.708 -173.883 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 21.6 t70 -62.81 -33.18 74.69 Favored 'General case' 0 N--CA 1.485 1.321 0 C-N-CA 123.638 0.775 . . . . 0.0 110.857 178.985 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 40.9 t60 -70.63 -36.89 73.7 Favored 'General case' 0 N--CA 1.477 0.912 0 C-N-CA 124.603 1.161 . . . . 0.0 110.468 174.499 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 78' ' ' LEU . . . . . 0.404 ' CD1' ' HB2' ' A' ' 41' ' ' LYS . 60.8 mt -71.03 -31.24 67.67 Favored 'General case' 0 N--CA 1.483 1.179 0 C-N-CA 123.137 0.575 . . . . 0.0 111.577 -177.561 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 79' ' ' VAL . . . . . 0.42 HG23 ' O ' ' A' ' 75' ' ' LYS . 99.5 t -64.03 -44.27 97.74 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.759 0 O-C-N 123.959 0.787 . . . . 0.0 109.355 173.641 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 24.6 m -61.62 -42.79 99.38 Favored 'General case' 0 N--CA 1.474 0.746 0 CA-C-N 115.16 -0.927 . . . . 0.0 110.982 176.304 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -67.4 -39.97 85.58 Favored 'General case' 0 N--CA 1.473 0.698 0 C-N-CA 123.085 0.554 . . . . 0.0 111.04 178.271 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 82' ' ' TYR . . . . . 0.509 ' CD2' HD11 ' A' ' 34' ' ' LEU . 64.5 t80 -62.96 -56.97 12.46 Favored 'General case' 0 N--CA 1.472 0.658 0 C-N-CA 124.047 0.939 . . . . 0.0 110.419 -175.363 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 83' ' ' ASN . . . . . . . . . . . . . 27.8 m-80 -62.83 -40.69 98.2 Favored 'General case' 0 N--CA 1.482 1.141 0 C-N-CA 123.293 0.637 . . . . 0.0 111.25 -176.129 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 84' ' ' HIS . . . . . 0.409 ' HA ' ' HB3' ' A' ' 87' ' ' GLU . 13.2 m170 -70.08 -25.49 63.55 Favored 'General case' 0 N--CA 1.481 1.114 0 C-N-CA 123.773 0.829 . . . . 0.0 111.954 -179.465 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 85' ' ' LEU . . . . . 0.426 ' HG ' ' HD2' ' A' ' 91' ' ' PHE . 57.7 tp -56.71 -54.22 48.68 Favored 'General case' 0 N--CA 1.486 1.359 0 CA-C-O 121.912 0.863 . . . . 0.0 110.763 178.809 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 20.1 m-85 -73.88 -32.06 63.43 Favored 'General case' 0 CA--C 1.554 1.114 0 CA-C-N 113.483 -1.689 . . . . 0.0 110.16 -178.605 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 87' ' ' GLU . . . . . 0.409 ' HB3' ' HA ' ' A' ' 84' ' ' HIS . 9.7 tp10 -68.85 -23.33 64.23 Favored 'General case' 0 N--CA 1.485 1.292 0 C-N-CA 124.718 1.207 . . . . 0.0 112.285 -174.352 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 19.9 p -128.39 5.24 5.71 Favored 'General case' 0 N--CA 1.487 1.415 0 C-N-CA 123.289 0.636 . . . . 0.0 111.867 179.694 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 14.3 mmmm 60.6 29.71 19.21 Favored 'General case' 0 N--CA 1.487 1.408 0 C-N-CA 124.109 0.964 . . . . 0.0 111.869 175.665 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 90' ' ' ARG . . . . . 0.543 ' HB3' ' HB2' ' A' ' 56' ' ' PHE . 52.2 mtt85 -66.81 -11.19 54.42 Favored 'General case' 0 N--CA 1.496 1.838 0 N-CA-C 114.403 1.26 . . . . 0.0 114.403 -171.079 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 91' ' ' PHE . . . . . 0.542 ' HA ' ' HA2' ' A' ' 52' ' ' GLY . 16.6 p90 -67.74 138.44 56.24 Favored 'General case' 0 CA--C 1.54 0.573 0 N-CA-C 112.484 0.55 . . . . 0.0 112.484 176.852 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 3.8 tmtp? . . . . . 0 CA--C 1.552 1.048 0 C-N-CA 125.153 1.381 . . . . 0.0 109.639 -178.796 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.473 0.69 0 CA-C-O 122.002 0.906 . . . . 0.0 111.592 . . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -84.36 -21.25 30.96 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 114.28 -1.327 . . . . 0.0 110.118 -178.691 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 29' ' ' TRP . . . . . . . . . . . . . 4.5 m-90 -140.94 147.6 39.06 Favored 'General case' 0 N--CA 1.476 0.833 0 C-N-CA 124.439 1.096 . . . . 0.0 109.614 -176.297 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 36.3 p -83.02 174.29 11.01 Favored 'General case' 0 N--CA 1.476 0.857 0 N-CA-C 109.629 -0.508 . . . . 0.0 109.629 169.098 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 31' ' ' VAL . . . . . 0.584 HG13 HG11 ' A' ' 79' ' ' VAL . 45.5 t -52.26 -45.52 43.85 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.022 0 C-N-CA 123.821 0.848 . . . . 0.0 111.743 179.781 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -66.31 -42.81 87.75 Favored 'General case' 0 N--CA 1.48 1.059 0 C-N-CA 123.238 0.615 . . . . 0.0 111.395 179.051 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 15.7 mm-40 -64.7 -29.07 70.06 Favored 'General case' 0 N--CA 1.482 1.146 0 C-N-CA 123.253 0.621 . . . . 0.0 110.94 179.883 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.449 ' HA ' HD23 ' A' ' 39' ' ' LEU . 79.0 mt -69.53 -53.67 17.9 Favored 'General case' 0 N--CA 1.469 0.522 0 C-N-CA 123.129 0.572 . . . . 0.0 109.772 172.984 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 35' ' ' ARG . . . . . 0.406 ' HG3' ' O ' ' A' ' 31' ' ' VAL . 83.0 mtp180 -65.05 -15.15 62.02 Favored 'General case' 0 N--CA 1.485 1.321 0 C-N-CA 123.937 0.895 . . . . 0.0 112.125 -173.706 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 47.8 t -59.72 117.65 5.21 Favored 'General case' 0 CA--C 1.54 0.587 0 N-CA-C 109.29 -0.633 . . . . 0.0 109.29 169.61 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 11.5 pt-20 -65.65 -16.29 63.59 Favored 'General case' 0 N--CA 1.477 0.884 0 C-N-CA 124.3 1.04 . . . . 0.0 111.893 178.954 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 12.7 mm100 -68.64 -25.68 64.95 Favored 'General case' 0 CA--C 1.545 0.753 0 C-N-CA 123.945 0.898 . . . . 0.0 110.639 173.822 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 39' ' ' LEU . . . . . 0.449 HD23 ' HA ' ' A' ' 34' ' ' LEU . 26.0 tp -88.65 117.77 68.67 Favored Pre-proline 0 CA--C 1.545 0.755 0 N-CA-C 108.252 -1.018 . . . . 0.0 108.252 171.082 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 34.6 Cg_exo -62.08 143.35 94.73 Favored 'Trans proline' 0 C--N 1.374 1.892 0 C-N-CA 122.776 2.318 . . . . 0.0 112.571 177.522 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 54.3 mtmt -60.61 -36.65 79.1 Favored 'General case' 0 N--CA 1.471 0.613 0 CA-C-N 115.538 -0.756 . . . . 0.0 110.693 174.915 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 61.5 pttt -65.51 -33.98 77.19 Favored 'General case' 0 N--CA 1.473 0.698 0 C-N-CA 123.34 0.656 . . . . 0.0 111.152 178.878 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 27.9 t0 -69.1 -31.63 70.48 Favored 'General case' 0 N--CA 1.476 0.868 0 CA-C-O 121.288 0.566 . . . . 0.0 110.696 -178.775 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 53.7 mt -73.59 -47.12 46.09 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.736 0 CA-C-N 115.667 -0.697 . . . . 0.0 110.351 176.125 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 73.5 mt -59.95 -35.24 59.62 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.184 0 C-N-CA 123.507 0.723 . . . . 0.0 110.498 177.225 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 88.0 tttt -60.27 -42.59 95.69 Favored 'General case' 0 CA--C 1.548 0.896 0 C-N-CA 124.308 1.043 . . . . 0.0 110.708 176.822 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 22.3 t80 -67.03 -47.27 71.9 Favored 'General case' 0 CA--C 1.547 0.841 0 CA-C-N 114.1 -1.409 . . . . 0.0 111.231 176.313 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 48' ' ' LEU . . . . . 0.541 ' HB3' ' HE2' ' A' ' 56' ' ' PHE . 87.4 mt -70.38 -36.95 74.43 Favored 'General case' 0 N--CA 1.473 0.709 0 C-N-CA 124.056 0.942 . . . . 0.0 112.414 -173.921 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 3.1 pt20 -80.56 -32.24 36.69 Favored 'General case' 0 N--CA 1.478 0.959 0 C-N-CA 122.457 0.303 . . . . 0.0 111.059 -175.556 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 44.4 tt0 -59.87 -37.0 78.08 Favored 'General case' 0 N--CA 1.478 0.96 0 C-N-CA 123.278 0.631 . . . . 0.0 111.053 -176.8 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 81.8 m-70 -106.19 -37.13 6.68 Favored 'General case' 0 N--CA 1.476 0.852 0 CA-C-N 115.609 -0.723 . . . . 0.0 111.247 -176.355 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 52' ' ' GLY . . . . . 0.486 ' HA2' ' HA ' ' A' ' 91' ' ' PHE . . . -60.26 127.31 43.55 Favored Glycine 0 C--N 1.346 1.128 0 O-C-N 123.924 0.765 . . . . 0.0 113.841 -178.349 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 25.7 t -68.28 168.09 13.11 Favored 'General case' 0 CA--C 1.548 0.88 0 C-N-CA 124.274 1.03 . . . . 0.0 110.948 -179.906 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 19.5 m-20 -57.25 -27.79 62.38 Favored 'General case' 0 N--CA 1.486 1.371 0 C-N-CA 124.156 0.983 . . . . 0.0 112.801 -172.877 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 19.6 p -64.57 -50.62 66.52 Favored 'General case' 0 CA--C 1.548 0.878 0 C-N-CA 123.723 0.809 . . . . 0.0 110.925 174.426 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 56' ' ' PHE . . . . . 0.554 ' HB2' ' HB3' ' A' ' 90' ' ' ARG . 58.9 t80 -61.23 -37.22 82.28 Favored 'General case' 0 N--CA 1.482 1.128 0 C-N-CA 123.959 0.904 . . . . 0.0 110.905 178.398 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 84.9 mt -66.41 -41.79 88.74 Favored 'General case' 0 CA--C 1.54 0.578 0 CA-C-N 114.357 -1.292 . . . . 0.0 110.976 176.85 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -71.08 -27.03 63.32 Favored 'General case' 0 N--CA 1.479 1.011 0 C-N-CA 123.894 0.878 . . . . 0.0 112.5 -179.64 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -61.72 -50.24 73.21 Favored 'General case' 0 CA--C 1.547 0.838 0 C-N-CA 123.675 0.79 . . . . 0.0 112.521 -177.467 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 22.4 t-80 -119.07 14.26 13.1 Favored 'General case' 0 N--CA 1.487 1.411 0 N-CA-C 112.568 0.581 . . . . 0.0 112.568 -179.761 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 50.5 mtpt 55.31 49.51 16.9 Favored 'General case' 0 N--CA 1.482 1.175 0 C-N-CA 123.7 0.8 . . . . 0.0 110.962 -172.917 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 62' ' ' LEU . . . . . 0.446 ' HA ' HG11 ' A' ' 69' ' ' VAL . 86.7 mt -79.69 -6.99 58.3 Favored 'General case' 0 N--CA 1.48 1.05 0 C-N-CA 123.759 0.824 . . . . 0.0 110.76 176.349 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 63' ' ' LEU . . . . . 0.406 ' HG ' ' H ' ' A' ' 63' ' ' LEU . 1.2 pp -76.12 159.86 30.32 Favored 'General case' 0 N--CA 1.475 0.805 0 C-N-CA 123.945 0.898 . . . . 0.0 110.936 173.225 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 86.14 -160.5 33.56 Favored Glycine 0 C--N 1.343 0.947 0 CA-C-N 115.524 -0.762 . . . . 0.0 113.2 179.212 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 90.5 m-20 -63.5 123.56 19.09 Favored 'General case' 0 N--CA 1.474 0.73 0 C-N-CA 123.209 0.604 . . . . 0.0 110.4 179.622 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 53.3 mt -56.49 -46.29 82.24 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.657 0 C-N-CA 124.599 1.16 . . . . 0.0 111.73 -175.006 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 62.7 pttt -58.84 -37.43 76.44 Favored 'General case' 0 CA--C 1.556 1.182 0 C-N-CA 123.855 0.862 . . . . 0.0 111.537 178.516 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 68' ' ' ASN . . . . . 0.4 ' O ' ' HG2' ' A' ' 71' ' ' LYS . 5.9 m-20 -70.42 -31.22 68.32 Favored 'General case' 0 N--CA 1.481 1.088 0 C-N-CA 124.201 1.0 . . . . 0.0 110.62 179.695 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 69' ' ' VAL . . . . . 0.446 HG11 ' HA ' ' A' ' 62' ' ' LEU . 30.7 t -74.28 -37.19 45.09 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.937 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.064 172.289 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -68.3 -21.66 64.77 Favored 'General case' 0 N--CA 1.484 1.256 0 C-N-CA 124.059 0.944 . . . . 0.0 112.765 -174.608 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 71' ' ' LYS . . . . . 0.4 ' HG2' ' O ' ' A' ' 68' ' ' ASN . 20.9 ptmt -83.0 -18.14 40.9 Favored 'General case' 0 N--CA 1.482 1.163 0 C-N-CA 122.758 0.423 . . . . 0.0 111.442 179.714 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 8.9 t -114.11 -5.67 13.08 Favored 'General case' 0 N--CA 1.478 0.969 0 C-N-CA 123.762 0.825 . . . . 0.0 110.605 179.471 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -95.35 131.7 41.17 Favored 'General case' 0 N--CA 1.47 0.537 0 C-N-CA 123.504 0.722 . . . . 0.0 110.378 177.555 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 30.7 t30 -97.14 145.04 26.4 Favored 'General case' 0 C--O 1.242 0.677 0 N-CA-C 108.169 -1.048 . . . . 0.0 108.169 170.37 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 4.6 tppp? -55.85 -43.94 77.56 Favored 'General case' 0 N--CA 1.474 0.748 0 C-N-CA 124.044 0.938 . . . . 0.0 111.754 -178.693 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 22.3 t70 -57.97 -44.03 86.84 Favored 'General case' 0 N--CA 1.479 0.98 0 C-N-CA 123.758 0.823 . . . . 0.0 111.633 -177.842 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 26.2 t60 -75.38 -26.37 58.41 Favored 'General case' 0 N--CA 1.473 0.702 0 C-N-CA 122.639 0.375 . . . . 0.0 111.085 179.729 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 67.6 mt -68.16 -31.11 70.44 Favored 'General case' 0 N--CA 1.486 1.332 0 CA-C-N 118.225 0.466 . . . . 0.0 111.931 176.026 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 79' ' ' VAL . . . . . 0.584 HG11 HG13 ' A' ' 31' ' ' VAL . 97.0 t -69.65 -39.73 78.55 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.734 0 CA-C-N 115.565 -0.743 . . . . 0.0 109.66 171.169 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 37.4 m -63.37 -40.25 96.74 Favored 'General case' 0 CA--C 1.547 0.848 0 C-N-CA 123.524 0.73 . . . . 0.0 111.204 176.576 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -71.44 -40.64 70.25 Favored 'General case' 0 N--CA 1.476 0.833 0 C-N-CA 123.895 0.878 . . . . 0.0 109.592 178.988 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 82' ' ' TYR . . . . . . . . . . . . . 11.7 t80 -54.49 -54.75 36.84 Favored 'General case' 0 N--CA 1.474 0.731 0 C-N-CA 124.648 1.179 . . . . 0.0 110.762 175.741 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 83' ' ' ASN . . . . . . . . . . . . . 14.8 m120 -67.46 -40.67 85.36 Favored 'General case' 0 N--CA 1.478 0.933 0 C-N-CA 122.475 0.31 . . . . 0.0 110.997 -176.712 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 38.6 m170 -66.65 -24.62 66.31 Favored 'General case' 0 N--CA 1.483 1.21 0 C-N-CA 123.535 0.734 . . . . 0.0 111.663 178.608 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 85' ' ' LEU . . . . . 0.455 ' HG ' ' HD2' ' A' ' 91' ' ' PHE . 35.4 tp -58.6 -53.83 53.93 Favored 'General case' 0 N--CA 1.482 1.148 0 C-N-CA 123.793 0.837 . . . . 0.0 110.653 177.042 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 36.6 m-85 -74.85 -29.78 61.15 Favored 'General case' 0 N--CA 1.474 0.729 0 CA-C-N 114.593 -1.185 . . . . 0.0 111.428 -178.896 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 40.7 tt0 -58.78 -47.69 83.85 Favored 'General case' 0 N--CA 1.477 0.887 0 C-N-CA 125.013 1.325 . . . . 0.0 112.831 -173.367 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 30.2 p -120.18 8.59 10.94 Favored 'General case' 0 N--CA 1.477 0.91 0 C-N-CA 123.634 0.774 . . . . 0.0 111.271 -178.043 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 96.6 mttt 54.78 61.78 2.82 Favored 'General case' 0 N--CA 1.477 0.915 0 C-N-CA 124.277 1.031 . . . . 0.0 111.072 -177.108 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 90' ' ' ARG . . . . . 0.554 ' HB3' ' HB2' ' A' ' 56' ' ' PHE . 44.5 mtt85 -75.63 -8.53 57.02 Favored 'General case' 0 N--CA 1.476 0.831 0 CA-C-N 114.06 -1.427 . . . . 0.0 111.807 178.403 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 91' ' ' PHE . . . . . 0.486 ' HA ' ' HA2' ' A' ' 52' ' ' GLY . 23.2 p90 -81.49 162.02 23.41 Favored 'General case' 0 N--CA 1.469 0.524 0 C-N-CA 124.164 0.986 . . . . 0.0 111.11 172.131 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 6.5 tmtm? . . . . . 0 C--O 1.253 1.265 0 CA-C-N 115.045 -0.98 . . . . 0.0 109.003 175.016 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 27' ' ' ARG . . . . . 0.665 HH21 HG22 ' A' ' 30' ' ' THR . 15.4 ttt180 . . . . . 0 CA--C 1.549 0.905 0 CA-C-O 121.279 0.561 . . . . 0.0 110.522 . . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -90.09 -60.01 2.04 Favored 'General case' 0 CA--C 1.549 0.924 0 CA-C-N 114.589 -1.187 . . . . 0.0 109.456 174.852 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 29' ' ' TRP . . . . . . . . . . . . . 3.8 m-90 -89.67 149.54 22.74 Favored 'General case' 0 N--CA 1.474 0.762 0 C-N-CA 124.121 0.969 . . . . 0.0 111.896 -175.672 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 30' ' ' THR . . . . . 0.665 HG22 HH21 ' A' ' 27' ' ' ARG . 66.8 p -82.07 173.67 11.94 Favored 'General case' 0 N--CA 1.471 0.611 0 C-N-CA 123.328 0.651 . . . . 0.0 109.854 168.494 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 31' ' ' VAL . . . . . 0.532 ' HA ' HD12 ' A' ' 34' ' ' LEU . 69.3 t -58.99 -38.28 72.81 Favored 'Isoleucine or valine' 0 CA--C 1.554 1.1 0 C-N-CA 123.581 0.753 . . . . 0.0 111.381 -179.013 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 11.6 pt-20 -73.49 -36.25 65.75 Favored 'General case' 0 N--CA 1.482 1.158 0 CA-C-N 116.112 -0.494 . . . . 0.0 111.743 178.402 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 99.5 mt-30 -67.13 -28.17 67.92 Favored 'General case' 0 N--CA 1.482 1.134 0 C-N-CA 123.156 0.582 . . . . 0.0 111.33 175.667 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.584 HD13 ' HA ' ' A' ' 79' ' ' VAL . 89.2 mt -68.04 -52.48 34.93 Favored 'General case' 0 N--CA 1.477 0.918 0 C-N-CA 123.355 0.662 . . . . 0.0 110.963 175.463 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 15.5 ptm180 -74.7 -10.92 59.99 Favored 'General case' 0 N--CA 1.485 1.308 0 C-N-CA 123.154 0.582 . . . . 0.0 111.654 -177.606 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 33.3 t -53.7 121.23 7.43 Favored 'General case' 0 N--CA 1.478 0.965 0 C-N-CA 123.619 0.767 . . . . 0.0 110.719 171.302 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 44.1 mt-10 -67.55 -25.82 66.0 Favored 'General case' 0 N--CA 1.477 0.881 0 C-N-CA 124.234 1.014 . . . . 0.0 111.927 -174.634 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 94.8 mt-30 -65.93 -29.45 69.86 Favored 'General case' 0 N--CA 1.479 0.981 0 C-N-CA 123.812 0.845 . . . . 0.0 110.838 177.004 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 44.0 tp -83.05 117.1 67.54 Favored Pre-proline 0 CA--C 1.549 0.905 0 N-CA-C 107.749 -1.204 . . . . 0.0 107.749 170.88 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 15.9 Cg_exo -70.99 163.73 38.21 Favored 'Trans proline' 0 C--N 1.372 1.791 0 C-N-CA 122.844 2.363 . . . . 0.0 113.272 177.864 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 37.1 mtmm -68.24 -42.48 79.66 Favored 'General case' 0 N--CA 1.475 0.775 0 CA-C-N 115.537 -0.756 . . . . 0.0 110.587 175.984 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 55.2 pttt -61.41 -28.95 69.62 Favored 'General case' 0 N--CA 1.48 1.048 0 C-N-CA 123.947 0.899 . . . . 0.0 111.505 -179.216 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 6.5 t70 -70.81 -43.37 68.76 Favored 'General case' 0 CA--C 1.545 0.779 0 C-N-CA 122.598 0.359 . . . . 0.0 110.469 -179.158 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 27.9 mt -72.3 -45.68 60.08 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.122 0 C-N-CA 122.678 0.391 . . . . 0.0 110.388 179.941 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 45' ' ' ILE . . . . . 0.47 HD12 ' HB2' ' A' ' 70' ' ' ALA . 98.2 mt -58.89 -39.54 77.91 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.556 0 C-N-CA 123.366 0.667 . . . . 0.0 110.915 177.757 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 46' ' ' LYS . . . . . 0.414 ' O ' ' HB2' ' A' ' 50' ' ' GLU . 62.6 tttm -62.28 -46.72 87.54 Favored 'General case' 0 N--CA 1.473 0.723 0 C-N-CA 123.057 0.543 . . . . 0.0 110.347 175.887 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 20.5 t80 -58.56 -51.11 71.26 Favored 'General case' 0 N--CA 1.476 0.866 0 O-C-N 124.362 1.039 . . . . 0.0 110.569 -179.752 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 48' ' ' LEU . . . . . 0.416 HD21 ' CD1' ' A' ' 82' ' ' TYR . 95.3 mt -70.87 -31.33 67.97 Favored 'General case' 0 N--CA 1.468 0.466 0 CA-C-N 115.536 -0.756 . . . . 0.0 112.084 -173.746 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 1.9 pt20 -81.2 -26.35 36.02 Favored 'General case' 0 N--CA 1.481 1.093 0 N-CA-C 110.079 -0.341 . . . . 0.0 110.079 176.871 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 50' ' ' GLU . . . . . 0.414 ' HB2' ' O ' ' A' ' 46' ' ' LYS . 7.6 tp10 -59.68 -33.57 71.74 Favored 'General case' 0 N--CA 1.474 0.758 0 C-N-CA 123.694 0.798 . . . . 0.0 110.964 -178.057 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 54.8 p-80 -132.09 -20.18 2.48 Favored 'General case' 0 N--CA 1.479 0.983 0 CA-C-O 117.858 -1.068 . . . . 0.0 113.573 -176.29 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 52' ' ' GLY . . . . . 0.461 ' HA2' ' HA ' ' A' ' 91' ' ' PHE . . . -67.24 144.97 45.39 Favored Glycine 0 N--CA 1.48 1.575 0 CA-C-N 119.447 1.022 . . . . 0.0 112.362 177.876 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 53.7 m -77.73 163.08 26.47 Favored 'General case' 0 N--CA 1.486 1.344 0 CA-C-N 117.546 0.673 . . . . 0.0 111.92 -177.114 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 9.1 m-20 -54.29 -43.41 71.04 Favored 'General case' 0 N--CA 1.485 1.295 0 C-N-CA 124.533 1.133 . . . . 0.0 113.199 -170.42 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 34.5 t -68.21 -40.71 82.04 Favored 'General case' 0 N--CA 1.479 1.019 0 C-N-CA 123.38 0.672 . . . . 0.0 111.223 -176.224 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 89.8 t80 -63.49 -48.08 79.1 Favored 'General case' 0 N--CA 1.478 0.954 0 C-N-CA 123.257 0.623 . . . . 0.0 109.713 177.386 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 63.6 mt -65.02 -32.45 74.18 Favored 'General case' 0 C--O 1.22 -0.487 0 CA-C-N 115.173 -0.921 . . . . 0.0 111.18 -178.205 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -70.17 -48.43 57.32 Favored 'General case' 0 N--CA 1.475 0.82 0 C-N-CA 123.313 0.645 . . . . 0.0 110.813 179.276 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 55.2 mt-10 -61.66 -36.59 81.26 Favored 'General case' 0 N--CA 1.481 1.078 0 C-N-CA 123.23 0.612 . . . . 0.0 111.947 -179.866 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 94.5 m-70 -99.27 -4.05 32.77 Favored 'General case' 0 N--CA 1.481 1.093 0 C-N-CA 122.517 0.327 . . . . 0.0 111.866 -178.444 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 33.8 mmtp 61.18 30.34 19.26 Favored 'General case' 0 N--CA 1.495 1.807 0 C-N-CA 124.177 0.991 . . . . 0.0 112.108 179.747 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 80.4 mt -80.3 -13.49 59.15 Favored 'General case' 0 N--CA 1.482 1.165 0 C-N-CA 124.177 0.991 . . . . 0.0 111.564 179.653 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -74.33 179.78 4.37 Favored 'General case' 0 N--CA 1.485 1.317 0 C-N-CA 123.484 0.713 . . . . 0.0 111.822 177.644 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 76.43 -160.0 50.51 Favored Glycine 0 C--N 1.342 0.891 0 CA-C-N 115.362 -0.835 . . . . 0.0 113.239 175.734 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 13.3 m120 -67.98 113.51 5.74 Favored 'General case' 0 N--CA 1.479 0.992 0 C-N-CA 123.087 0.555 . . . . 0.0 109.928 -178.88 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 44.2 mt -51.99 -53.06 19.62 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.116 0 C-N-CA 125.313 1.445 . . . . 0.0 112.287 -172.159 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 41.8 mtmt -64.25 -38.41 90.94 Favored 'General case' 0 N--CA 1.482 1.14 0 C-N-CA 124.257 1.023 . . . . 0.0 111.428 -175.674 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 50.6 t30 -66.02 -39.86 90.58 Favored 'General case' 0 N--CA 1.481 1.091 0 C-N-CA 124.113 0.965 . . . . 0.0 110.894 178.49 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 69' ' ' VAL . . . . . 0.417 HG12 HD13 ' A' ' 45' ' ' ILE . 97.5 t -67.39 -39.53 82.86 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.878 0 CA-C-N 115.853 -0.612 . . . . 0.0 109.597 174.129 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 70' ' ' ALA . . . . . 0.47 ' HB2' HD12 ' A' ' 45' ' ' ILE . . . -81.77 12.23 4.15 Favored 'General case' 0 N--CA 1.483 1.209 0 C-N-CA 124.216 1.006 . . . . 0.0 111.743 179.568 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 65.4 tttp -94.43 -31.03 14.15 Favored 'General case' 0 CA--C 1.544 0.731 0 C-N-CA 124.148 0.979 . . . . 0.0 110.123 170.985 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 8.8 t -122.28 -19.86 6.35 Favored 'General case' 0 N--CA 1.482 1.167 0 N-CA-C 112.667 0.618 . . . . 0.0 112.667 -170.759 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -77.89 148.41 34.61 Favored 'General case' 0 N--CA 1.477 0.893 0 C-N-CA 122.794 0.438 . . . . 0.0 109.848 176.771 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 9.4 p30 -98.76 163.87 12.45 Favored 'General case' 0 N--CA 1.483 1.203 0 C-N-CA 122.587 0.355 . . . . 0.0 110.4 176.422 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 19.0 tptm -71.59 -39.39 70.58 Favored 'General case' 0 N--CA 1.478 0.953 0 C-N-CA 123.658 0.783 . . . . 0.0 111.357 -172.75 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 25.2 t70 -63.69 -33.08 74.84 Favored 'General case' 0 N--CA 1.483 1.217 0 C-N-CA 124.412 1.085 . . . . 0.0 111.088 -176.435 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 69.5 t60 -58.43 -43.82 88.88 Favored 'General case' 0 N--CA 1.475 0.786 0 C-N-CA 124.891 1.276 . . . . 0.0 110.26 173.416 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 56.7 mt -68.56 -31.53 70.81 Favored 'General case' 0 N--CA 1.476 0.834 0 CA-C-N 115.389 -0.823 . . . . 0.0 112.076 -174.907 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 79' ' ' VAL . . . . . 0.584 ' HA ' HD13 ' A' ' 34' ' ' LEU . 53.7 t -65.1 -48.45 83.77 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.883 0 O-C-N 124.114 0.884 . . . . 0.0 109.775 177.263 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 56.8 m -62.8 -44.52 95.95 Favored 'General case' 0 N--CA 1.474 0.771 0 CA-C-N 115.193 -0.912 . . . . 0.0 111.58 178.309 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -64.39 -48.24 76.17 Favored 'General case' 0 N--CA 1.476 0.838 0 C-N-CA 123.37 0.668 . . . . 0.0 110.557 -179.137 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 82' ' ' TYR . . . . . 0.535 ' CD2' HD11 ' A' ' 34' ' ' LEU . 74.0 t80 -53.59 -57.44 10.74 Favored 'General case' 0 N--CA 1.471 0.59 0 C-N-CA 124.288 1.035 . . . . 0.0 111.136 -178.133 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 83' ' ' ASN . . . . . . . . . . . . . 46.5 m-80 -66.76 -28.25 68.25 Favored 'General case' 0 N--CA 1.478 0.966 0 CA-C-N 115.359 -0.837 . . . . 0.0 111.913 -172.652 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 10.6 m170 -77.47 -28.47 52.31 Favored 'General case' 0 N--CA 1.482 1.129 0 C-N-CA 123.155 0.582 . . . . 0.0 111.927 177.6 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 34.2 tp -59.89 -53.03 62.69 Favored 'General case' 0 N--CA 1.492 1.657 0 CA-C-O 121.571 0.701 . . . . 0.0 111.21 -177.518 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 86' ' ' PHE . . . . . 0.404 ' HA ' ' HE2' ' A' ' 91' ' ' PHE . 34.5 m-85 -73.9 -29.82 62.26 Favored 'General case' 0 N--CA 1.47 0.556 0 CA-C-N 113.993 -1.458 . . . . 0.0 110.743 -176.074 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 13.9 tp10 -69.19 -36.99 77.9 Favored 'General case' 0 N--CA 1.471 0.616 0 C-N-CA 123.532 0.733 . . . . 0.0 110.957 -176.7 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 60.5 p -106.92 0.49 23.87 Favored 'General case' 0 N--CA 1.478 0.935 0 C-N-CA 123.967 0.907 . . . . 0.0 111.683 -177.561 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 74.4 mmtt 61.88 27.15 16.51 Favored 'General case' 0 N--CA 1.489 1.475 0 C-N-CA 124.49 1.116 . . . . 0.0 112.24 174.919 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 54.2 mtt180 -73.46 4.58 4.62 Favored 'General case' 0 N--CA 1.492 1.628 0 N-CA-C 114.056 1.132 . . . . 0.0 114.056 -172.967 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 91' ' ' PHE . . . . . 0.461 ' HA ' ' HA2' ' A' ' 52' ' ' GLY . 5.8 p90 -70.43 141.92 52.05 Favored 'General case' 0 CA--C 1.551 0.995 0 CA-C-O 121.343 0.592 . . . . 0.0 111.783 169.955 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 13.6 tptp . . . . . 0 C--O 1.25 1.097 0 C-N-CA 127.753 2.421 . . . . 0.0 112.688 -176.856 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 27' ' ' ARG . . . . . 0.441 ' HB3' ' CZ ' ' A' ' 86' ' ' PHE . 0.0 OUTLIER . . . . . 0 CA--C 1.537 0.462 0 CA-C-O 121.54 0.686 . . . . 0.0 109.941 . . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -79.05 -35.08 43.14 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 114.605 -1.18 . . . . 0.0 110.613 -174.14 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 29' ' ' TRP . . . . . 0.519 ' HB3' ' HB2' ' A' ' 33' ' ' GLN . 3.2 m-90 -115.0 145.89 41.8 Favored 'General case' 0 N--CA 1.472 0.666 0 CA-C-N 115.16 -0.927 . . . . 0.0 110.57 -172.618 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 49.2 p -93.07 174.58 7.16 Favored 'General case' 0 CA--C 1.544 0.729 0 C-N-CA 123.68 0.792 . . . . 0.0 108.865 168.438 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 31' ' ' VAL . . . . . 0.515 ' HA ' HD12 ' A' ' 34' ' ' LEU . 7.1 p -58.89 -35.66 57.53 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.277 0 C-N-CA 122.907 0.483 . . . . 0.0 112.19 -174.471 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 9.0 pt-20 -66.07 -42.16 89.77 Favored 'General case' 0 N--CA 1.48 1.051 0 C-N-CA 123.657 0.783 . . . . 0.0 111.262 176.695 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 33' ' ' GLN . . . . . 0.519 ' HB2' ' HB3' ' A' ' 29' ' ' TRP . 12.4 mm100 -63.9 -42.34 97.46 Favored 'General case' 0 N--CA 1.477 0.918 0 C-N-CA 123.021 0.528 . . . . 0.0 110.085 178.209 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.515 HD12 ' HA ' ' A' ' 31' ' ' VAL . 70.2 mt -63.23 -49.57 73.65 Favored 'General case' 0 N--CA 1.472 0.649 0 O-C-N 124.485 1.116 . . . . 0.0 111.17 -176.943 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 11.5 ptp180 -73.07 -16.84 61.47 Favored 'General case' 0 N--CA 1.48 1.052 0 O-C-N 124.046 0.841 . . . . 0.0 111.636 -175.166 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 13.4 t -69.46 122.46 19.04 Favored 'General case' 0 CA--C 1.55 0.965 0 N-CA-C 109.514 -0.55 . . . . 0.0 109.514 -178.825 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 37' ' ' GLU . . . . . 0.407 ' HA ' ' HE2' ' A' ' 75' ' ' LYS . 60.1 mm-40 -63.65 -22.16 66.76 Favored 'General case' 0 N--CA 1.481 1.094 0 C-N-CA 123.903 0.881 . . . . 0.0 113.017 -174.833 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 29.3 pt20 -68.15 -21.69 64.9 Favored 'General case' 0 N--CA 1.482 1.125 0 C-N-CA 123.292 0.637 . . . . 0.0 111.636 179.541 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 2.4 tt -81.26 121.56 80.44 Favored Pre-proline 0 CA--C 1.553 1.091 0 N-CA-C 107.005 -1.48 . . . . 0.0 107.005 174.103 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_exo -56.78 126.1 21.17 Favored 'Trans proline' 0 C--N 1.381 2.254 0 C-N-CA 122.804 2.336 . . . . 0.0 111.972 173.399 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 41' ' ' LYS . . . . . 0.455 ' HB2' HD11 ' A' ' 78' ' ' LEU . 9.6 ptpp? -58.74 -34.24 71.16 Favored 'General case' 0 N--CA 1.48 1.029 0 C-N-CA 123.261 0.624 . . . . 0.0 111.194 179.925 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 21.3 ptmt -66.49 -33.17 75.08 Favored 'General case' 0 N--CA 1.472 0.669 0 C-N-CA 124.183 0.993 . . . . 0.0 111.849 179.538 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 32.5 t70 -68.1 -33.12 73.92 Favored 'General case' 0 N--CA 1.476 0.871 0 C-N-CA 123.599 0.76 . . . . 0.0 110.33 -178.007 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 53.8 mt -70.17 -46.86 70.65 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.079 0 CA-C-N 115.657 -0.701 . . . . 0.0 109.916 175.266 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 74.6 mt -57.86 -35.77 52.88 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.492 0 C-N-CA 123.199 0.599 . . . . 0.0 110.872 176.882 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 88.6 tttt -65.79 -41.85 91.44 Favored 'General case' 0 CA--C 1.546 0.79 0 C-N-CA 123.306 0.642 . . . . 0.0 110.983 178.756 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 27.2 t80 -57.21 -48.43 78.81 Favored 'General case' 0 N--CA 1.489 1.52 0 C-N-CA 123.278 0.631 . . . . 0.0 110.085 172.892 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 48' ' ' LEU . . . . . 0.438 ' HB3' ' HE2' ' A' ' 56' ' ' PHE . 96.4 mt -66.77 -35.4 80.0 Favored 'General case' 0 CA--C 1.539 0.553 0 CA-C-N 114.259 -1.337 . . . . 0.0 112.144 -174.111 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 49' ' ' GLN . . . . . 0.444 ' HA ' ' CD2' ' A' ' 57' ' ' LEU . 3.5 pt20 -82.75 -34.77 27.05 Favored 'General case' 0 N--CA 1.482 1.133 0 CA-C-N 117.903 0.32 . . . . 0.0 111.234 179.25 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 44.5 tt0 -67.47 -37.51 83.01 Favored 'General case' 0 N--CA 1.477 0.895 0 C-N-CA 123.108 0.563 . . . . 0.0 111.247 -177.642 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 97.1 m-70 -108.16 -40.43 5.2 Favored 'General case' 0 N--CA 1.48 1.032 0 CA-C-N 115.679 -0.691 . . . . 0.0 111.822 -171.75 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 52' ' ' GLY . . . . . 0.538 ' HA2' ' HA ' ' A' ' 91' ' ' PHE . . . -63.88 136.54 41.05 Favored Glycine 0 C--N 1.345 1.031 0 O-C-N 123.596 0.56 . . . . 0.0 113.016 175.178 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 53' ' ' SER . . . . . 0.426 ' O ' ' HG ' ' A' ' 57' ' ' LEU . 9.1 t -73.09 172.64 10.67 Favored 'General case' 0 N--CA 1.476 0.851 0 C-N-CA 123.553 0.741 . . . . 0.0 110.309 -177.988 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 4.3 m-20 -55.0 -39.46 69.07 Favored 'General case' 0 N--CA 1.488 1.467 0 C-N-CA 123.845 0.858 . . . . 0.0 111.356 -177.625 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 22.7 t -63.85 -30.72 71.78 Favored 'General case' 0 N--CA 1.479 1.002 0 CA-C-N 114.932 -1.031 . . . . 0.0 111.71 -179.269 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 56' ' ' PHE . . . . . 0.581 ' HB2' ' HB3' ' A' ' 90' ' ' ARG . 46.3 t80 -75.48 -41.9 54.33 Favored 'General case' 0 N--CA 1.473 0.677 0 C-N-CA 123.102 0.561 . . . . 0.0 110.947 176.449 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 57' ' ' LEU . . . . . 0.444 ' CD2' ' HA ' ' A' ' 49' ' ' GLN . 20.8 mt -74.24 -49.09 24.73 Favored 'General case' 0 N--CA 1.472 0.629 0 CA-C-N 115.094 -0.957 . . . . 0.0 112.077 -168.541 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -61.4 -48.15 82.56 Favored 'General case' 0 N--CA 1.478 0.95 0 C-N-CA 123.383 0.673 . . . . 0.0 111.319 -177.346 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 14.1 mm-40 -60.37 -30.15 69.39 Favored 'General case' 0 N--CA 1.484 1.26 0 C-N-CA 123.521 0.728 . . . . 0.0 112.768 -178.997 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 35.3 m80 -113.18 0.9 15.06 Favored 'General case' 0 N--CA 1.488 1.426 0 N-CA-C 112.331 0.493 . . . . 0.0 112.331 -175.802 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 75.4 mmtt 55.71 44.68 25.93 Favored 'General case' 0 N--CA 1.486 1.34 0 C-N-CA 124.591 1.156 . . . . 0.0 111.729 178.761 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 85.2 mt -95.33 -11.23 28.15 Favored 'General case' 0 N--CA 1.481 1.094 0 C-N-CA 123.994 0.918 . . . . 0.0 111.455 179.605 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -79.96 171.97 14.39 Favored 'General case' 0 N--CA 1.482 1.14 0 C-N-CA 123.176 0.59 . . . . 0.0 111.42 176.657 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 85.62 -153.42 27.29 Favored Glycine 0 C--N 1.34 0.796 0 CA-C-N 114.751 -1.113 . . . . 0.0 112.53 178.418 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 12.5 m120 -69.79 118.52 12.75 Favored 'General case' 0 N--CA 1.469 0.483 0 N-CA-C 108.948 -0.76 . . . . 0.0 108.948 175.364 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 59.0 mt -55.43 -39.19 51.92 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.066 0 C-N-CA 123.94 0.896 . . . . 0.0 110.813 -177.883 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 58.2 pttt -53.74 -42.88 68.62 Favored 'General case' 0 N--CA 1.485 1.311 0 C-N-CA 124.145 0.978 . . . . 0.0 112.48 178.175 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 3.8 m-20 -59.64 -41.62 90.91 Favored 'General case' 0 N--CA 1.489 1.477 0 C-N-CA 123.997 0.919 . . . . 0.0 110.404 179.257 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 21.5 t -71.22 -44.86 73.13 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.073 0 CA-C-N 113.893 -1.503 . . . . 0.0 109.996 179.307 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -82.1 7.12 14.27 Favored 'General case' 0 N--CA 1.485 1.317 0 C-N-CA 124.726 1.211 . . . . 0.0 113.441 -168.242 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 21.1 ptmt -95.26 -18.69 20.64 Favored 'General case' 0 N--CA 1.482 1.137 0 O-C-N 121.907 -0.496 . . . . 0.0 111.079 172.109 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 13.0 t -133.05 -14.09 2.71 Favored 'General case' 0 CA--C 1.553 1.077 0 C-N-CA 123.257 0.623 . . . . 0.0 112.53 -173.668 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -84.17 99.85 10.78 Favored 'General case' 0 C--O 1.244 0.796 0 N-CA-C 108.692 -0.855 . . . . 0.0 108.692 176.827 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 32.4 p30 -68.65 163.45 23.76 Favored 'General case' 0 CA--C 1.539 0.53 0 CA-C-N 115.826 -0.624 . . . . 0.0 110.132 178.819 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 75' ' ' LYS . . . . . 0.426 ' HB2' ' NZ ' ' A' ' 75' ' ' LYS . 3.5 ttmp? -67.61 -26.75 66.41 Favored 'General case' 0 CA--C 1.548 0.883 0 C-N-CA 123.053 0.541 . . . . 0.0 110.985 -173.686 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 20.8 t70 -61.9 -41.37 97.82 Favored 'General case' 0 CA--C 1.552 1.037 0 C-N-CA 124.463 1.105 . . . . 0.0 110.966 173.741 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 17.4 t60 -62.84 -36.76 84.28 Favored 'General case' 0 N--CA 1.484 1.249 0 C-N-CA 125.292 1.437 . . . . 0.0 109.653 -179.075 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 78' ' ' LEU . . . . . 0.455 HD11 ' HB2' ' A' ' 41' ' ' LYS . 48.3 mt -75.06 -36.64 61.8 Favored 'General case' 0 N--CA 1.47 0.537 0 CA-C-N 114.584 -1.189 . . . . 0.0 111.922 -172.863 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 61.9 t -67.39 -41.97 86.86 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.899 0 O-C-N 123.82 0.7 . . . . 0.0 109.699 173.182 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 22.9 m -60.22 -43.56 95.92 Favored 'General case' 0 N--CA 1.482 1.132 0 C-N-CA 123.237 0.615 . . . . 0.0 110.936 177.171 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -69.73 -43.94 71.32 Favored 'General case' 0 N--CA 1.473 0.705 0 C-N-CA 123.523 0.729 . . . . 0.0 111.019 179.077 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 82' ' ' TYR . . . . . . . . . . . . . 18.0 t80 -53.62 -55.93 21.54 Favored 'General case' 0 N--CA 1.479 1.017 0 C-N-CA 124.202 1.001 . . . . 0.0 110.598 178.765 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 83' ' ' ASN . . . . . . . . . . . . . 34.2 m-80 -66.28 -41.54 89.71 Favored 'General case' 0 N--CA 1.476 0.849 0 C-N-CA 122.627 0.371 . . . . 0.0 110.822 -175.948 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 84' ' ' HIS . . . . . 0.485 ' HA ' ' HB3' ' A' ' 87' ' ' GLU . 46.1 m170 -64.5 -26.72 68.55 Favored 'General case' 0 N--CA 1.479 0.993 0 C-N-CA 123.169 0.588 . . . . 0.0 111.837 178.779 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 85' ' ' LEU . . . . . 0.403 ' HG ' ' HD2' ' A' ' 91' ' ' PHE . 56.4 tp -58.33 -54.45 46.84 Favored 'General case' 0 N--CA 1.48 1.056 0 CA-C-O 121.711 0.767 . . . . 0.0 110.179 177.796 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 86' ' ' PHE . . . . . 0.441 ' CZ ' ' HB3' ' A' ' 27' ' ' ARG . 27.1 m-85 -75.63 -26.5 57.83 Favored 'General case' 0 CA--C 1.546 0.821 0 CA-C-N 114.273 -1.33 . . . . 0.0 111.308 179.876 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 87' ' ' GLU . . . . . 0.485 ' HB3' ' HA ' ' A' ' 84' ' ' HIS . 14.9 tp10 -69.55 -25.67 64.12 Favored 'General case' 0 N--CA 1.484 1.262 0 C-N-CA 124.204 1.002 . . . . 0.0 111.745 -176.523 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 39.0 p -123.89 0.86 8.65 Favored 'General case' 0 N--CA 1.474 0.75 0 C-N-CA 123.385 0.674 . . . . 0.0 110.837 179.215 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 34.5 mmtp 54.57 40.05 31.58 Favored 'General case' 0 N--CA 1.483 1.213 0 C-N-CA 124.083 0.953 . . . . 0.0 110.606 -177.109 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 90' ' ' ARG . . . . . 0.581 ' HB3' ' HB2' ' A' ' 56' ' ' PHE . 28.5 mtt180 -73.08 -7.69 52.42 Favored 'General case' 0 N--CA 1.487 1.381 0 C-N-CA 125.323 1.449 . . . . 0.0 113.352 -174.544 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 91' ' ' PHE . . . . . 0.538 ' HA ' ' HA2' ' A' ' 52' ' ' GLY . 3.2 p90 -68.75 164.72 21.13 Favored 'General case' 0 N--CA 1.476 0.86 0 C-N-CA 123.398 0.679 . . . . 0.0 111.347 168.377 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 24.2 ttpp . . . . . 0 CA--C 1.556 1.19 0 O-C-N 124.567 1.167 . . . . 0.0 110.451 171.896 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 40.4 ttp180 . . . . . 0 CA--C 1.549 0.935 0 CA-C-O 121.351 0.596 . . . . 0.0 110.779 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -94.99 -19.6 20.07 Favored 'General case' 0 CA--C 1.549 0.925 0 CA-C-N 114.664 -1.153 . . . . 0.0 111.604 178.621 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 29' ' ' TRP . . . . . . . . . . . . . 2.9 m-90 -135.98 135.0 39.18 Favored 'General case' 0 N--CA 1.483 1.182 0 C-N-CA 124.187 0.995 . . . . 0.0 108.949 -172.705 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 82.1 p -75.63 170.34 16.36 Favored 'General case' 0 CA--C 1.545 0.783 0 N-CA-C 109.804 -0.443 . . . . 0.0 109.804 178.161 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 31' ' ' VAL . . . . . 0.406 ' HA ' HD12 ' A' ' 34' ' ' LEU . 91.2 t -59.17 -37.52 68.96 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.273 0 C-N-CA 122.391 0.276 . . . . 0.0 111.186 -177.042 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 10.7 pt-20 -69.09 -34.24 74.79 Favored 'General case' 0 N--CA 1.48 1.072 0 C-N-CA 123.49 0.716 . . . . 0.0 110.918 178.15 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 79.4 mt-30 -70.16 -33.81 72.23 Favored 'General case' 0 N--CA 1.477 0.892 0 C-N-CA 123.005 0.522 . . . . 0.0 110.397 176.233 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.487 HD11 ' CD2' ' A' ' 82' ' ' TYR . 76.2 mt -64.36 -53.7 44.57 Favored 'General case' 0 N--CA 1.477 0.901 0 N-CA-C 109.305 -0.628 . . . . 0.0 109.305 175.651 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 75.9 mtp180 -71.01 -12.02 61.3 Favored 'General case' 0 N--CA 1.477 0.889 0 CA-C-N 114.468 -1.242 . . . . 0.0 111.466 -177.469 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 44.0 t -57.83 143.2 43.2 Favored 'General case' 0 C--N 1.354 0.777 0 C-N-CA 123.482 0.713 . . . . 0.0 111.468 175.496 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 35.7 mt-10 -80.02 -8.31 59.3 Favored 'General case' 0 CA--C 1.55 0.97 0 CA-C-N 114.765 -1.107 . . . . 0.0 111.205 -178.707 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 28.1 mm-40 -86.36 -38.06 17.82 Favored 'General case' 0 N--CA 1.474 0.746 0 C-N-CA 124.038 0.935 . . . . 0.0 110.676 179.509 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 1.3 tt -82.61 112.93 41.07 Favored Pre-proline 0 N--CA 1.476 0.84 0 N-CA-C 108.328 -0.99 . . . . 0.0 108.328 179.096 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 40' ' ' PRO . . . . . 0.522 ' HB2' ' HG2' ' A' ' 42' ' ' LYS . 79.0 Cg_endo -73.81 148.7 41.52 Favored 'Trans proline' 0 C--N 1.372 1.809 0 C-N-CA 121.933 1.755 . . . . 0.0 111.406 -179.638 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 18.8 ptpt -64.52 -28.27 69.54 Favored 'General case' 0 N--CA 1.472 0.669 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.871 -178.429 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 42' ' ' LYS . . . . . 0.522 ' HG2' ' HB2' ' A' ' 40' ' ' PRO . 19.8 ptpt -65.08 -33.89 77.11 Favored 'General case' 0 N--CA 1.472 0.653 0 C-N-CA 123.453 0.701 . . . . 0.0 111.387 179.571 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 43' ' ' ASP . . . . . 0.412 ' HB2' ' HG2' ' A' ' 40' ' ' PRO . 25.1 t70 -75.37 -31.53 60.52 Favored 'General case' 0 N--CA 1.476 0.845 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.642 -177.515 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 49.4 mt -69.06 -50.18 55.69 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.779 0 N-CA-C 109.657 -0.497 . . . . 0.0 109.657 176.068 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 72.9 mt -57.62 -41.89 80.17 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.335 0 C-N-CA 123.497 0.719 . . . . 0.0 110.468 176.521 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 46' ' ' LYS . . . . . 0.42 ' HD3' HD11 ' A' ' 66' ' ' ILE . 23.1 tptm -53.46 -46.92 70.09 Favored 'General case' 0 N--CA 1.485 1.307 0 C-N-CA 124.555 1.142 . . . . 0.0 110.85 176.53 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 11.9 t80 -66.49 -47.58 72.56 Favored 'General case' 0 N--CA 1.473 0.686 0 CA-C-N 114.916 -1.038 . . . . 0.0 110.897 -179.478 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 93.2 mt -68.12 -33.44 74.5 Favored 'General case' 0 CA--C 1.541 0.627 0 C-N-CA 122.922 0.489 . . . . 0.0 111.842 -173.225 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 3.6 pt20 -83.5 -25.5 31.04 Favored 'General case' 0 N--CA 1.484 1.271 0 C-N-CA 122.464 0.306 . . . . 0.0 111.592 177.623 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 4.2 tm-20 -54.21 -42.5 69.83 Favored 'General case' 0 N--CA 1.49 1.526 0 C-N-CA 124.327 1.051 . . . . 0.0 111.846 -178.919 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 4.0 p80 -138.74 -20.73 1.01 Allowed 'General case' 0 N--CA 1.481 1.123 0 CA-C-N 116.28 -0.418 . . . . 0.0 112.09 -172.755 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -60.26 135.2 50.18 Favored Glycine 0 C--N 1.352 1.43 0 CA-C-O 119.714 -0.492 . . . . 0.0 112.006 172.032 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 53' ' ' SER . . . . . 0.423 ' O ' ' HG ' ' A' ' 57' ' ' LEU . 32.4 t -62.98 148.09 48.66 Favored 'General case' 0 N--CA 1.471 0.622 0 C-N-CA 123.349 0.66 . . . . 0.0 111.868 -175.495 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 25.5 t70 -59.12 -36.95 76.08 Favored 'General case' 0 N--CA 1.481 1.125 0 C-N-CA 124.005 0.922 . . . . 0.0 112.197 -176.038 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 38.4 m -64.0 -37.53 87.74 Favored 'General case' 0 CA--C 1.549 0.931 0 C-N-CA 123.516 0.726 . . . . 0.0 111.367 177.591 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 52.4 t80 -66.5 -47.26 73.53 Favored 'General case' 0 N--CA 1.481 1.085 0 C-N-CA 123.498 0.719 . . . . 0.0 109.593 173.253 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 57' ' ' LEU . . . . . 0.423 ' HG ' ' O ' ' A' ' 53' ' ' SER . 76.3 mt -60.16 -33.47 72.22 Favored 'General case' 0 N--CA 1.476 0.874 0 CA-C-N 115.203 -0.908 . . . . 0.0 111.377 -175.427 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -65.03 -48.4 73.98 Favored 'General case' 0 N--CA 1.476 0.839 0 C-N-CA 123.626 0.771 . . . . 0.0 111.538 178.646 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 40.2 mt-10 -62.34 -26.47 68.46 Favored 'General case' 0 N--CA 1.482 1.128 0 CA-C-N 115.222 -0.899 . . . . 0.0 112.039 -178.262 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 72.8 m80 -114.37 1.76 14.51 Favored 'General case' 0 N--CA 1.483 1.197 0 C-N-CA 123.3 0.64 . . . . 0.0 112.241 -176.754 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 49.1 mtmt 62.37 22.82 13.48 Favored 'General case' 0 N--CA 1.497 1.881 0 C-N-CA 125.268 1.427 . . . . 0.0 112.6 178.073 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 89.6 mt -80.1 -10.97 59.8 Favored 'General case' 0 N--CA 1.478 0.926 0 C-N-CA 124.186 0.994 . . . . 0.0 112.312 -177.033 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 1.4 pp -74.4 162.48 28.81 Favored 'General case' 0 N--CA 1.48 1.035 0 CA-C-O 121.322 0.582 . . . . 0.0 111.207 175.298 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 89.23 -159.96 29.09 Favored Glycine 0 C--O 1.242 0.649 0 CA-C-N 115.02 -0.991 . . . . 0.0 112.267 178.683 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 65' ' ' ASN . . . . . 0.46 ' OD1' ' HG2' ' A' ' 67' ' ' LYS . 14.0 t-20 -75.63 139.34 41.96 Favored 'General case' 0 N--CA 1.469 0.481 0 N-CA-C 109.441 -0.578 . . . . 0.0 109.441 -179.447 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 66' ' ' ILE . . . . . 0.42 HD11 ' HD3' ' A' ' 46' ' ' LYS . 59.7 mt -61.0 -46.41 96.71 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.797 0 O-C-N 123.69 0.619 . . . . 0.0 112.568 -171.261 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 67' ' ' LYS . . . . . 0.46 ' HG2' ' OD1' ' A' ' 65' ' ' ASN . 8.9 ptpp? -60.48 -36.29 77.95 Favored 'General case' 0 N--CA 1.491 1.617 0 CA-C-N 118.334 0.515 . . . . 0.0 110.83 -178.344 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 7.0 t30 -61.42 -40.5 94.63 Favored 'General case' 0 N--CA 1.48 1.028 0 C-N-CA 124.543 1.137 . . . . 0.0 110.975 176.692 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 32.8 t -73.13 -40.22 57.9 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.808 0 CA-C-N 115.223 -0.899 . . . . 0.0 110.441 175.984 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -72.82 -5.89 41.21 Favored 'General case' 0 N--CA 1.484 1.229 0 C-N-CA 124.614 1.166 . . . . 0.0 113.221 -170.332 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -90.34 -18.94 24.65 Favored 'General case' 0 CA--C 1.548 0.867 0 C-N-CA 122.209 0.203 . . . . 0.0 110.765 176.278 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 10.1 t -120.08 -15.16 8.78 Favored 'General case' 0 N--CA 1.477 0.876 0 C-N-CA 123.927 0.891 . . . . 0.0 111.354 -178.022 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -90.32 97.37 11.14 Favored 'General case' 0 N--CA 1.475 0.777 0 C-N-CA 123.243 0.617 . . . . 0.0 110.317 179.407 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 74' ' ' ASN . . . . . 0.403 ' ND2' ' HB3' ' A' ' 76' ' ' ASP . 54.4 t30 -66.3 156.7 33.64 Favored 'General case' 0 N--CA 1.477 0.876 0 CA-C-N 115.431 -0.804 . . . . 0.0 109.125 173.077 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 75' ' ' LYS . . . . . 0.442 ' O ' HG23 ' A' ' 79' ' ' VAL . 2.9 tppp? -64.32 -38.76 92.18 Favored 'General case' 0 CA--C 1.548 0.892 0 N-CA-C 110.186 -0.302 . . . . 0.0 110.186 179.734 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 76' ' ' ASP . . . . . 0.403 ' HB3' ' ND2' ' A' ' 74' ' ' ASN . 31.0 t70 -64.53 -34.82 79.12 Favored 'General case' 0 N--CA 1.484 1.253 0 C-N-CA 124.156 0.982 . . . . 0.0 111.28 175.783 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 17.3 t60 -66.45 -38.63 87.77 Favored 'General case' 0 N--CA 1.487 1.386 0 C-N-CA 123.967 0.907 . . . . 0.0 109.376 174.232 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 71.8 mt -74.42 -26.62 60.18 Favored 'General case' 0 N--CA 1.475 0.793 0 C-N-CA 123.401 0.68 . . . . 0.0 112.326 -178.536 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 79' ' ' VAL . . . . . 0.442 HG23 ' O ' ' A' ' 75' ' ' LYS . 88.1 t -68.79 -44.02 82.34 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.018 0 N-CA-C 109.271 -0.64 . . . . 0.0 109.271 172.79 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 59.9 m -58.11 -51.77 68.33 Favored 'General case' 0 CA--C 1.546 0.79 0 CA-C-N 115.041 -0.981 . . . . 0.0 110.783 175.847 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -65.49 -45.88 81.87 Favored 'General case' 0 N--CA 1.475 0.786 0 C-N-CA 123.483 0.713 . . . . 0.0 111.779 -176.864 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 82' ' ' TYR . . . . . 0.487 ' CD2' HD11 ' A' ' 34' ' ' LEU . 79.8 t80 -58.82 -57.34 13.45 Favored 'General case' 0 N--CA 1.474 0.75 0 C-N-CA 124.289 1.036 . . . . 0.0 110.307 -177.712 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 83' ' ' ASN . . . . . . . . . . . . . 6.6 m120 -60.56 -42.1 95.91 Favored 'General case' 0 CA--C 1.549 0.913 0 CA-C-N 115.677 -0.692 . . . . 0.0 111.65 -176.037 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 63.5 m-70 -68.22 -25.24 65.11 Favored 'General case' 0 N--CA 1.481 1.097 0 CA-C-O 118.733 -0.651 . . . . 0.0 112.66 178.78 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 57.1 tp -62.08 -53.5 54.55 Favored 'General case' 0 N--CA 1.49 1.553 0 CA-C-N 118.76 0.709 . . . . 0.0 110.876 178.643 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 24.4 m-85 -75.33 -20.64 58.93 Favored 'General case' 0 N--CA 1.477 0.898 0 CA-C-N 114.613 -1.176 . . . . 0.0 110.868 -177.54 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 34.4 tt0 -69.36 -26.6 64.75 Favored 'General case' 0 N--CA 1.479 1.004 0 C-N-CA 123.316 0.647 . . . . 0.0 111.062 175.988 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 26.3 p -112.26 -21.93 11.18 Favored 'General case' 0 N--CA 1.477 0.92 0 C-N-CA 123.897 0.879 . . . . 0.0 110.914 179.385 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 97.3 mttt 55.1 46.87 23.16 Favored 'General case' 0 N--CA 1.481 1.09 0 C-N-CA 124.985 1.314 . . . . 0.0 112.292 -176.131 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 99.2 mtt180 -71.5 -16.05 62.33 Favored 'General case' 0 N--CA 1.493 1.697 0 C-N-CA 124.144 0.978 . . . . 0.0 112.095 177.973 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 91' ' ' PHE . . . . . . . . . . . . . 54.3 p90 -72.57 161.14 31.17 Favored 'General case' 0 CA--C 1.543 0.681 0 C-N-CA 123.631 0.773 . . . . 0.0 111.904 178.435 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 49.2 pttt . . . . . 0 C--O 1.254 1.294 0 N-CA-C 108.313 -0.995 . . . . 0.0 108.313 165.959 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 CA--C 1.544 0.736 0 CA-C-O 120.837 0.351 . . . . 0.0 110.209 . . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -77.56 -41.76 37.77 Favored 'General case' 0 N--CA 1.47 0.574 0 N-CA-C 109.101 -0.703 . . . . 0.0 109.101 178.192 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 29' ' ' TRP . . . . . 0.4 ' CH2' ' HB3' ' A' ' 43' ' ' ASP . 10.7 m-90 -138.32 159.68 41.44 Favored 'General case' 0 N--CA 1.477 0.9 0 C-N-CA 124.717 1.207 . . . . 0.0 108.236 175.462 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 67.9 p -85.42 168.55 14.5 Favored 'General case' 0 N--CA 1.483 1.218 0 N-CA-C 108.662 -0.866 . . . . 0.0 108.662 176.525 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 7.2 p -61.0 -39.34 81.86 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.197 0 CA-C-N 118.052 0.387 . . . . 0.0 111.425 -174.859 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -64.26 -35.74 81.83 Favored 'General case' 0 N--CA 1.479 1.015 0 C-N-CA 123.836 0.855 . . . . 0.0 111.42 177.775 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 52.2 mt-30 -69.66 -42.37 74.31 Favored 'General case' 0 C--N 1.353 0.746 0 C-N-CA 123.28 0.632 . . . . 0.0 110.757 175.045 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.442 ' HA ' HD13 ' A' ' 39' ' ' LEU . 89.2 mt -63.51 -53.61 49.23 Favored 'General case' 0 N--CA 1.478 0.974 0 C-N-CA 123.237 0.615 . . . . 0.0 111.094 -175.697 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 8.0 ptm180 -65.01 -22.45 67.0 Favored 'General case' 0 N--CA 1.473 0.719 0 O-C-N 124.176 0.923 . . . . 0.0 112.003 -172.718 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 23.3 t -60.2 132.3 53.49 Favored 'General case' 0 CA--C 1.545 0.756 0 C-N-CA 123.552 0.741 . . . . 0.0 110.457 177.917 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 3.1 mp0 -66.72 -21.15 66.08 Favored 'General case' 0 CA--C 1.546 0.819 0 C-N-CA 123.658 0.783 . . . . 0.0 111.718 -173.395 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 13.8 pt20 -69.47 -29.18 66.79 Favored 'General case' 0 N--CA 1.479 1.011 0 C-N-CA 122.823 0.449 . . . . 0.0 111.211 177.456 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 39' ' ' LEU . . . . . 0.442 HD13 ' HA ' ' A' ' 34' ' ' LEU . 4.0 tt -86.33 113.09 50.54 Favored Pre-proline 0 N--CA 1.475 0.775 0 N-CA-C 107.967 -1.123 . . . . 0.0 107.967 177.728 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 40' ' ' PRO . . . . . 0.451 ' HB2' ' HG2' ' A' ' 42' ' ' LYS . 98.6 Cg_endo -73.03 149.26 46.41 Favored 'Trans proline' 0 C--N 1.375 1.963 0 C-N-CA 122.509 2.14 . . . . 0.0 112.015 -178.92 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 46.2 mtmt -68.27 -21.12 64.82 Favored 'General case' 0 N--CA 1.472 0.65 0 CA-C-N 114.868 -1.06 . . . . 0.0 112.043 -175.572 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 42' ' ' LYS . . . . . 0.451 ' HG2' ' HB2' ' A' ' 40' ' ' PRO . 17.3 ptpt -65.08 -34.16 77.76 Favored 'General case' 0 CA--C 1.544 0.747 0 C-N-CA 123.97 0.908 . . . . 0.0 111.149 178.462 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 43' ' ' ASP . . . . . 0.4 ' HB3' ' CH2' ' A' ' 29' ' ' TRP . 0.8 OUTLIER -69.79 -38.79 76.8 Favored 'General case' 0 C--O 1.241 0.616 0 C-N-CA 123.617 0.767 . . . . 0.0 111.161 179.015 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 43.1 mt -68.74 -50.88 51.05 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.596 0 CA-C-N 115.49 -0.777 . . . . 0.0 110.164 -178.457 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 75.7 mt -59.81 -36.09 64.17 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.163 0 C-N-CA 123.277 0.631 . . . . 0.0 110.872 177.471 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 13.4 ttmm -59.48 -48.45 81.62 Favored 'General case' 0 N--CA 1.479 0.996 0 C-N-CA 122.788 0.435 . . . . 0.0 111.023 174.384 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 20.9 t80 -54.88 -45.96 74.71 Favored 'General case' 0 N--CA 1.484 1.254 0 CA-C-O 121.259 0.552 . . . . 0.0 110.73 176.115 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 48' ' ' LEU . . . . . 0.421 ' HB3' ' HE2' ' A' ' 56' ' ' PHE . 90.8 mt -70.58 -37.93 74.01 Favored 'General case' 0 CA--C 1.544 0.73 0 CA-C-N 115.045 -0.98 . . . . 0.0 112.163 -175.152 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 49' ' ' GLN . . . . . 0.418 ' HA ' HD11 ' A' ' 57' ' ' LEU . 3.3 pt20 -85.6 -36.43 20.39 Favored 'General case' 0 N--CA 1.489 1.503 0 N-CA-C 113.121 0.786 . . . . 0.0 113.121 -175.935 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 32.5 tt0 -69.1 -37.42 78.41 Favored 'General case' 0 N--CA 1.479 0.991 0 C-N-CA 123.802 0.841 . . . . 0.0 111.599 -170.303 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -141.04 14.0 2.25 Favored 'General case' 0 N--CA 1.48 1.064 0 N-CA-C 113.107 0.78 . . . . 0.0 113.107 -178.93 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -103.9 150.38 17.45 Favored Glycine 0 N--CA 1.478 1.472 0 N-CA-C 110.639 -0.984 . . . . 0.0 110.639 162.564 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 53' ' ' SER . . . . . 0.485 ' O ' ' HG ' ' A' ' 57' ' ' LEU . 80.1 p -68.09 159.25 31.28 Favored 'General case' 0 N--CA 1.485 1.308 0 N-CA-C 113.353 0.871 . . . . 0.0 113.353 -170.137 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 22.1 t70 -66.21 -38.85 88.96 Favored 'General case' 0 N--CA 1.48 1.062 0 C-N-CA 124.514 1.126 . . . . 0.0 111.409 -177.331 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 13.3 t -67.49 -31.06 70.93 Favored 'General case' 0 N--CA 1.478 0.965 0 C-N-CA 123.544 0.738 . . . . 0.0 110.992 -179.364 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 56' ' ' PHE . . . . . 0.455 ' HD1' HH11 ' A' ' 90' ' ' ARG . 27.2 t80 -65.56 -48.81 71.14 Favored 'General case' 0 CA--C 1.548 0.874 0 CA-C-N 115.435 -0.802 . . . . 0.0 110.246 170.753 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 57' ' ' LEU . . . . . 0.485 ' HG ' ' O ' ' A' ' 53' ' ' SER . 72.1 mt -60.97 -45.4 94.9 Favored 'General case' 0 N--CA 1.481 1.122 0 C-N-CA 122.884 0.473 . . . . 0.0 111.347 -177.674 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -52.74 -26.24 13.53 Favored 'General case' 0 CA--C 1.545 0.752 0 C-N-CA 125.918 1.687 . . . . 0.0 113.734 -175.033 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 57.0 mt-10 -57.08 -49.09 76.93 Favored 'General case' 0 N--CA 1.481 1.118 0 C-N-CA 123.812 0.845 . . . . 0.0 111.789 179.81 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 58.7 t-80 -109.93 -5.2 15.55 Favored 'General case' 0 N--CA 1.485 1.276 0 C-N-CA 123.379 0.672 . . . . 0.0 111.013 177.563 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 24.9 mtpp 64.84 59.43 0.9 Allowed 'General case' 0 CA--C 1.545 0.763 0 C-N-CA 124.578 1.151 . . . . 0.0 109.908 -170.692 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 62' ' ' LEU . . . . . 0.507 ' HA ' HG11 ' A' ' 69' ' ' VAL . 84.6 mt -83.49 -0.34 49.78 Favored 'General case' 0 N--CA 1.489 1.518 0 C-N-CA 124.11 0.964 . . . . 0.0 110.848 175.771 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -82.47 158.83 23.07 Favored 'General case' 0 C--O 1.242 0.672 0 C-N-CA 124.631 1.172 . . . . 0.0 110.751 176.093 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 85.67 -146.92 21.76 Favored Glycine 0 C--N 1.337 0.6 0 CA-C-N 115.038 -0.983 . . . . 0.0 113.466 175.91 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 78.1 m-20 -65.36 111.21 2.93 Favored 'General case' 0 N--CA 1.473 0.698 0 C-N-CA 124.182 0.993 . . . . 0.0 109.83 -175.691 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 55.1 mt -56.1 -51.45 61.95 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.107 0 O-C-N 124.31 1.006 . . . . 0.0 112.678 -169.015 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 67' ' ' LYS . . . . . 0.566 ' H ' ' HD2' ' A' ' 67' ' ' LYS . 0.0 OUTLIER -71.69 -32.07 67.44 Favored 'General case' 0 N--CA 1.485 1.293 0 C-N-CA 123.183 0.593 . . . . 0.0 110.28 -174.634 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 49.0 t30 -62.82 -35.67 80.66 Favored 'General case' 0 N--CA 1.482 1.127 0 CA-C-N 115.277 -0.874 . . . . 0.0 110.846 175.326 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 69' ' ' VAL . . . . . 0.507 HG11 ' HA ' ' A' ' 62' ' ' LEU . 64.6 t -73.85 -41.28 53.76 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.859 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.145 172.058 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 70' ' ' ALA . . . . . 0.526 ' HA ' ' HB3' ' A' ' 73' ' ' ALA . . . -69.94 -1.94 11.04 Favored 'General case' 0 N--CA 1.487 1.393 0 C-N-CA 124.377 1.071 . . . . 0.0 113.417 -174.172 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 64.0 pttt -75.91 -33.71 59.91 Favored 'General case' 0 N--CA 1.478 0.966 0 CA-C-N 118.06 0.391 . . . . 0.0 110.131 174.081 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 10.0 t -115.16 -13.92 11.77 Favored 'General case' 0 N--CA 1.472 0.641 0 C-N-CA 123.988 0.915 . . . . 0.0 110.626 -176.906 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 73' ' ' ALA . . . . . 0.526 ' HB3' ' HA ' ' A' ' 70' ' ' ALA . . . -78.25 94.19 4.75 Favored 'General case' 0 C--N 1.343 0.317 0 N-CA-C 108.976 -0.75 . . . . 0.0 108.976 174.16 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 27.8 p-10 -74.25 155.54 38.17 Favored 'General case' 0 C--O 1.244 0.79 0 N-CA-C 109.372 -0.603 . . . . 0.0 109.372 176.33 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 4.6 tppp? -56.54 -39.05 72.76 Favored 'General case' 0 CA--C 1.549 0.916 0 C-N-CA 123.82 0.848 . . . . 0.0 111.846 -174.476 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 25.9 t70 -59.42 -49.5 77.54 Favored 'General case' 0 N--CA 1.476 0.869 0 C-N-CA 124.055 0.942 . . . . 0.0 112.333 -177.215 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 8.7 t60 -70.76 -28.12 64.45 Favored 'General case' 0 N--CA 1.476 0.869 0 C-N-CA 123.327 0.651 . . . . 0.0 110.696 -176.717 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 78' ' ' LEU . . . . . 0.463 HD21 ' HB1' ' A' ' 73' ' ' ALA . 82.4 mt -68.72 -33.61 74.23 Favored 'General case' 0 N--CA 1.478 0.925 0 C-N-CA 122.824 0.449 . . . . 0.0 111.972 176.266 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 57.1 t -66.03 -45.48 90.63 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.702 0 O-C-N 124.031 0.832 . . . . 0.0 109.653 171.227 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 33.8 m -58.63 -40.1 82.41 Favored 'General case' 0 N--CA 1.479 1.004 0 C-N-CA 123.855 0.862 . . . . 0.0 111.209 177.571 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -69.55 -46.66 65.93 Favored 'General case' 0 N--CA 1.469 0.514 0 C-N-CA 123.858 0.863 . . . . 0.0 110.527 178.142 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 82' ' ' TYR . . . . . . . . . . . . . 10.6 t80 -52.05 -54.8 25.75 Favored 'General case' 0 N--CA 1.475 0.816 0 C-N-CA 124.857 1.263 . . . . 0.0 110.997 179.349 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 83' ' ' ASN . . . . . . . . . . . . . 62.3 m-80 -65.0 -38.16 90.05 Favored 'General case' 0 N--CA 1.478 0.953 0 C-N-CA 122.825 0.45 . . . . 0.0 111.511 -177.609 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 32.1 m170 -66.64 -26.14 66.92 Favored 'General case' 0 N--CA 1.484 1.269 0 C-N-CA 123.729 0.811 . . . . 0.0 112.054 177.993 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 37.9 tp -58.52 -52.67 64.66 Favored 'General case' 0 N--CA 1.478 0.959 0 CA-C-O 121.386 0.613 . . . . 0.0 110.538 176.948 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 28.6 m-85 -75.44 -32.56 60.72 Favored 'General case' 0 N--CA 1.47 0.562 0 CA-C-N 114.261 -1.336 . . . . 0.0 111.771 -179.11 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 35.9 tt0 -55.99 -45.58 78.95 Favored 'General case' 0 N--CA 1.484 1.229 0 C-N-CA 123.941 0.896 . . . . 0.0 112.306 -172.664 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 16.5 p -112.77 3.41 16.46 Favored 'General case' 0 N--CA 1.477 0.908 0 C-N-CA 123.91 0.884 . . . . 0.0 111.393 178.194 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 47.9 mtpt 52.75 64.66 1.77 Allowed 'General case' 0 N--CA 1.479 0.977 0 C-N-CA 124.664 1.186 . . . . 0.0 110.612 179.182 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 90' ' ' ARG . . . . . 0.455 HH11 ' HD1' ' A' ' 56' ' ' PHE . 99.3 mtt180 -78.5 -33.19 48.27 Favored 'General case' 0 N--CA 1.473 0.701 0 CA-C-N 114.561 -1.199 . . . . 0.0 112.099 -172.374 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 91' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -51.41 160.73 0.54 Allowed 'General case' 0 N--CA 1.483 1.188 0 C-N-CA 124.116 0.966 . . . . 0.0 113.436 178.353 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 92' ' ' LYS . . . . . 0.588 ' HA ' ' HE2' ' A' ' 92' ' ' LYS . 11.0 mmpt? . . . . . 0 C--O 1.254 1.305 0 C-N-CA 124.33 1.052 . . . . 0.0 111.825 178.421 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 27' ' ' ARG . . . . . 0.535 ' HB2' ' OH ' ' A' ' 82' ' ' TYR . 0.0 OUTLIER . . . . . 0 N--CA 1.477 0.895 0 CA-C-O 120.889 0.376 . . . . 0.0 111.521 . . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -101.51 -43.3 5.95 Favored 'General case' 0 N--CA 1.475 0.818 0 C-N-CA 123.591 0.756 . . . . 0.0 110.878 -174.489 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 29' ' ' TRP . . . . . . . . . . . . . 3.7 m-90 -101.76 152.64 20.63 Favored 'General case' 0 N--CA 1.474 0.731 0 C-N-CA 124.554 1.142 . . . . 0.0 111.605 -169.43 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 64.9 p -92.09 174.16 7.46 Favored 'General case' 0 CA--C 1.542 0.657 0 C-N-CA 123.511 0.724 . . . . 0.0 109.505 170.963 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 31' ' ' VAL . . . . . 0.428 ' HA ' HD12 ' A' ' 34' ' ' LEU . 12.4 p -56.11 -37.97 51.58 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.36 0 C-N-CA 123.379 0.672 . . . . 0.0 111.973 -177.674 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 32' ' ' GLU . . . . . 0.41 ' HA ' ' HG2' ' A' ' 35' ' ' ARG . 10.0 pt-20 -73.61 -35.92 65.41 Favored 'General case' 0 N--CA 1.474 0.727 0 C-N-CA 123.666 0.787 . . . . 0.0 111.843 -178.994 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 1.1 mp0 -66.64 -33.42 75.61 Favored 'General case' 0 N--CA 1.482 1.149 0 C-N-CA 122.839 0.455 . . . . 0.0 110.652 176.144 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.543 HD13 ' HA ' ' A' ' 79' ' ' VAL . 79.4 mt -65.48 -50.72 64.28 Favored 'General case' 0 N--CA 1.48 1.041 0 CA-C-O 121.302 0.572 . . . . 0.0 111.127 177.131 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 35' ' ' ARG . . . . . 0.41 ' HG2' ' HA ' ' A' ' 32' ' ' GLU . 13.8 ptm180 -74.34 -11.51 60.28 Favored 'General case' 0 CA--C 1.548 0.892 0 CA-C-N 114.727 -1.124 . . . . 0.0 112.073 -175.786 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 48.3 t -64.73 143.98 57.55 Favored 'General case' 0 CA--C 1.553 1.079 0 C-N-CA 123.497 0.719 . . . . 0.0 111.113 173.65 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 13.9 pt-20 -73.71 -27.99 61.49 Favored 'General case' 0 N--CA 1.481 1.078 0 C-N-CA 123.307 0.643 . . . . 0.0 110.489 175.816 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 92.9 mt-30 -63.16 -31.16 72.24 Favored 'General case' 0 N--CA 1.474 0.773 0 C-N-CA 124.982 1.313 . . . . 0.0 110.868 -177.18 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 39' ' ' LEU . . . . . 0.44 HD23 ' HA ' ' A' ' 34' ' ' LEU . 48.7 tp -92.04 109.16 35.54 Favored Pre-proline 0 CA--C 1.549 0.92 0 N-CA-C 108.362 -0.977 . . . . 0.0 108.362 170.713 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 40' ' ' PRO . . . . . 0.498 ' HG2' ' HB2' ' A' ' 43' ' ' ASP . 47.3 Cg_endo -68.61 151.11 75.23 Favored 'Trans proline' 0 C--N 1.378 2.081 0 C-N-CA 122.821 2.347 . . . . 0.0 112.466 -178.587 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 49.7 mtmt -58.21 -42.72 86.84 Favored 'General case' 0 N--CA 1.477 0.883 0 C-N-CA 123.983 0.913 . . . . 0.0 111.325 -179.806 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 17.8 ptpt -63.52 -34.34 77.57 Favored 'General case' 0 CA--C 1.542 0.669 0 CA-C-N 114.442 -1.254 . . . . 0.0 111.763 -176.274 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 43' ' ' ASP . . . . . 0.498 ' HB2' ' HG2' ' A' ' 40' ' ' PRO . 14.0 t70 -73.99 -30.83 62.69 Favored 'General case' 0 N--CA 1.48 1.048 0 O-C-N 123.109 0.256 . . . . 0.0 110.847 -176.941 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 44' ' ' ILE . . . . . 0.605 HD12 HD13 ' A' ' 78' ' ' LEU . 42.8 mt -70.22 -52.16 32.54 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.973 0 C-N-CA 122.827 0.451 . . . . 0.0 110.033 177.036 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 69.5 mt -55.64 -41.84 66.43 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.537 0 C-N-CA 123.612 0.765 . . . . 0.0 110.581 177.008 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 35.1 ttmt -56.25 -48.38 76.64 Favored 'General case' 0 N--CA 1.474 0.763 0 C-N-CA 124.737 1.215 . . . . 0.0 111.241 178.036 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 15.9 t80 -61.37 -46.48 90.02 Favored 'General case' 0 N--CA 1.474 0.74 0 CA-C-N 115.045 -0.979 . . . . 0.0 110.903 178.021 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 88.5 mt -69.42 -32.56 71.61 Favored 'General case' 0 N--CA 1.473 0.705 0 C-N-CA 123.544 0.738 . . . . 0.0 112.14 -174.704 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 3.1 pt20 -82.29 -26.33 33.19 Favored 'General case' 0 N--CA 1.479 0.979 0 CA-C-O 120.779 0.323 . . . . 0.0 110.716 178.788 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 11.3 tp10 -63.43 -26.27 68.66 Favored 'General case' 0 N--CA 1.48 1.046 0 C-N-CA 124.068 0.947 . . . . 0.0 112.07 -176.933 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 51' ' ' HIS . . . . . 0.462 ' O ' ' HG2' ' A' ' 92' ' ' LYS . 0.0 OUTLIER -136.22 -24.94 1.22 Allowed 'General case' 0 N--CA 1.487 1.404 0 N-CA-C 113.428 0.899 . . . . 0.0 113.428 178.764 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -58.04 131.68 52.17 Favored Glycine 0 C--N 1.346 1.089 0 CA-C-N 118.426 0.557 . . . . 0.0 112.761 174.118 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 48.2 t -64.36 160.14 19.63 Favored 'General case' 0 N--CA 1.477 0.914 0 C-N-CA 123.014 0.525 . . . . 0.0 111.34 -177.51 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 4.8 m-20 -56.95 -38.19 72.6 Favored 'General case' 0 N--CA 1.482 1.167 0 C-N-CA 124.111 0.964 . . . . 0.0 111.003 -178.587 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 28.2 t -65.98 -36.45 83.34 Favored 'General case' 0 CA--C 1.548 0.891 0 CA-C-N 114.175 -1.375 . . . . 0.0 110.847 -179.468 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 88.5 t80 -70.75 -51.12 29.23 Favored 'General case' 0 N--CA 1.476 0.862 0 C-N-CA 123.102 0.561 . . . . 0.0 110.099 175.791 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 57' ' ' LEU . . . . . 0.449 HD22 ' HB2' ' A' ' 62' ' ' LEU . 73.1 mt -62.78 -31.8 72.84 Favored 'General case' 0 N--CA 1.474 0.771 0 CA-C-N 115.19 -0.913 . . . . 0.0 111.561 -173.633 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -62.09 -49.5 75.68 Favored 'General case' 0 N--CA 1.476 0.862 0 C-N-CA 123.587 0.755 . . . . 0.0 111.443 177.286 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 36.1 mt-10 -57.4 -48.74 78.29 Favored 'General case' 0 N--CA 1.483 1.224 0 C-N-CA 123.81 0.844 . . . . 0.0 110.555 179.357 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 64.2 m80 -95.67 1.95 53.79 Favored 'General case' 0 N--CA 1.477 0.876 0 CA-C-N 114.86 -1.064 . . . . 0.0 111.974 -170.532 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 39.4 mtmm 57.34 27.46 13.8 Favored 'General case' 0 N--CA 1.492 1.666 0 C-N-CA 124.496 1.118 . . . . 0.0 112.797 176.951 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 62' ' ' LEU . . . . . 0.456 HD11 ' HB1' ' A' ' 81' ' ' ALA . 85.1 mt -82.32 -11.61 58.5 Favored 'General case' 0 N--CA 1.483 1.183 0 C-N-CA 123.298 0.639 . . . . 0.0 111.671 -176.012 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 2.9 pp -79.54 158.45 27.17 Favored 'General case' 0 N--CA 1.475 0.806 0 CA-C-O 121.103 0.478 . . . . 0.0 110.724 175.347 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 93.42 -168.52 29.58 Favored Glycine 0 C--N 1.339 0.74 0 CA-C-N 115.313 -0.858 . . . . 0.0 112.774 179.76 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 65' ' ' ASN . . . . . 0.416 ' O ' HG23 ' A' ' 69' ' ' VAL . 51.5 t-20 -59.7 111.87 1.6 Allowed 'General case' 0 N--CA 1.478 0.974 0 C-N-CA 124.08 0.952 . . . . 0.0 109.593 -177.521 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 39.8 mt -55.36 -42.69 68.18 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.58 0 C-N-CA 123.873 0.869 . . . . 0.0 111.307 -171.652 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 17.5 mtpp -55.96 -45.73 78.8 Favored 'General case' 0 CA--C 1.545 0.781 0 C-N-CA 124.466 1.106 . . . . 0.0 111.156 178.277 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 2.1 m-20 -74.13 -33.09 63.43 Favored 'General case' 0 N--CA 1.481 1.083 0 C-N-CA 123.31 0.644 . . . . 0.0 111.121 -178.909 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 69' ' ' VAL . . . . . 0.416 HG23 ' O ' ' A' ' 65' ' ' ASN . 89.8 t -63.03 -44.06 99.4 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.061 0 C-N-CA 123.367 0.667 . . . . 0.0 109.936 174.393 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -67.04 -5.18 12.01 Favored 'General case' 0 N--CA 1.484 1.268 0 C-N-CA 124.742 1.217 . . . . 0.0 112.709 -176.101 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 85.6 tttt -72.27 -50.68 25.34 Favored 'General case' 0 CA--C 1.545 0.754 0 C-N-CA 122.738 0.415 . . . . 0.0 109.912 173.908 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 14.5 t -91.53 -21.33 20.93 Favored 'General case' 0 N--CA 1.473 0.716 0 C-N-CA 123.374 0.67 . . . . 0.0 110.889 179.56 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -85.44 85.31 7.44 Favored 'General case' 0 C--O 1.241 0.653 0 CA-C-O 121.681 0.753 . . . . 0.0 109.407 178.428 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 74' ' ' ASN . . . . . 0.455 ' O ' ' HG ' ' A' ' 78' ' ' LEU . 28.0 p-10 -74.92 172.83 11.55 Favored 'General case' 0 N--CA 1.474 0.763 0 CA-C-N 114.494 -1.23 . . . . 0.0 109.885 176.854 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 75' ' ' LYS . . . . . 0.501 ' HA ' HD12 ' A' ' 78' ' ' LEU . 1.9 tpmt? -54.27 -40.73 68.1 Favored 'General case' 0 CA--C 1.552 1.05 0 C-N-CA 123.867 0.867 . . . . 0.0 111.519 -176.056 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 34.8 t70 -64.68 -40.38 95.3 Favored 'General case' 0 N--CA 1.478 0.943 0 C-N-CA 124.293 1.037 . . . . 0.0 112.122 179.457 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 34.5 t60 -59.35 -42.89 92.58 Favored 'General case' 0 N--CA 1.485 1.32 0 C-N-CA 124.076 0.951 . . . . 0.0 110.363 178.974 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 78' ' ' LEU . . . . . 0.605 HD13 HD12 ' A' ' 44' ' ' ILE . 34.0 mt -60.32 -46.26 90.51 Favored 'General case' 0 C--O 1.218 -0.578 0 CA-C-N 114.296 -1.32 . . . . 0.0 111.377 -176.174 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 79' ' ' VAL . . . . . 0.543 ' HA ' HD13 ' A' ' 34' ' ' LEU . 60.2 t -63.68 -46.84 93.59 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.631 0 O-C-N 124.367 1.042 . . . . 0.0 110.743 -178.728 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 34.5 m -60.05 -50.51 73.44 Favored 'General case' 0 N--CA 1.478 0.94 0 CA-C-N 115.61 -0.723 . . . . 0.0 111.259 179.392 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 81' ' ' ALA . . . . . 0.456 ' HB1' HD11 ' A' ' 62' ' ' LEU . . . -66.4 -43.55 85.51 Favored 'General case' 0 N--CA 1.474 0.747 0 C-N-CA 123.767 0.827 . . . . 0.0 111.31 -177.286 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 82' ' ' TYR . . . . . 0.535 ' OH ' ' HB2' ' A' ' 27' ' ' ARG . 78.6 t80 -58.22 -58.93 6.3 Favored 'General case' 0 N--CA 1.473 0.721 0 C-N-CA 124.024 0.93 . . . . 0.0 110.379 -178.262 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 83' ' ' ASN . . . . . . . . . . . . . 16.6 m-80 -59.47 -39.69 84.51 Favored 'General case' 0 N--CA 1.48 1.063 0 C-N-CA 123.546 0.738 . . . . 0.0 111.011 -175.042 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 3.7 m-70 -65.07 -33.89 77.11 Favored 'General case' 0 N--CA 1.478 0.943 0 C-N-CA 123.765 0.826 . . . . 0.0 112.605 179.969 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 40.6 tp -59.18 -52.1 67.16 Favored 'General case' 0 N--CA 1.479 1.021 0 CA-C-O 121.519 0.676 . . . . 0.0 110.847 -176.811 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 86' ' ' PHE . . . . . 0.431 ' HA ' ' HE2' ' A' ' 91' ' ' PHE . 21.6 m-85 -76.27 -29.47 57.44 Favored 'General case' 0 N--CA 1.473 0.702 0 CA-C-N 114.106 -1.406 . . . . 0.0 111.165 -177.933 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 11.2 tp10 -61.01 -27.65 68.47 Favored 'General case' 0 N--CA 1.48 1.045 0 C-N-CA 124.734 1.214 . . . . 0.0 111.981 -179.905 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 31.5 p -128.46 -4.37 5.4 Favored 'General case' 0 N--CA 1.484 1.231 0 C-N-CA 123.74 0.816 . . . . 0.0 111.613 -177.761 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 44.7 mtmt 58.05 50.15 10.54 Favored 'General case' 0 N--CA 1.485 1.317 0 C-N-CA 124.614 1.166 . . . . 0.0 112.168 178.687 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 99.5 mtt180 -80.93 -5.43 57.45 Favored 'General case' 0 N--CA 1.481 1.077 0 CA-C-N 115.698 -0.683 . . . . 0.0 111.627 178.208 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 91' ' ' PHE . . . . . 0.431 ' HE2' ' HA ' ' A' ' 86' ' ' PHE . 48.9 p90 -71.98 163.61 27.56 Favored 'General case' 0 N--CA 1.474 0.763 0 C-N-CA 123.53 0.732 . . . . 0.0 110.674 167.416 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 92' ' ' LYS . . . . . 0.462 ' HG2' ' O ' ' A' ' 51' ' ' HIS . 32.2 mmmt . . . . . 0 C--O 1.252 1.194 0 C-N-CA 123.466 0.707 . . . . 0.0 110.674 -176.226 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 CA--C 1.542 0.664 0 CA-C-O 120.845 0.355 . . . . 0.0 111.177 . . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -85.1 -42.4 14.83 Favored 'General case' 0 N--CA 1.474 0.753 0 C-N-CA 123.5 0.72 . . . . 0.0 109.423 178.197 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 29' ' ' TRP . . . . . . . . . . . . . 6.6 m-90 -123.48 153.7 40.14 Favored 'General case' 0 N--CA 1.476 0.835 0 C-N-CA 124.571 1.148 . . . . 0.0 108.935 177.966 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 30' ' ' THR . . . . . 0.426 ' O ' ' HG ' ' A' ' 34' ' ' LEU . 55.9 p -87.49 170.59 11.21 Favored 'General case' 0 N--CA 1.475 0.812 0 C-N-CA 123.007 0.523 . . . . 0.0 110.095 -178.92 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 8.1 p -56.13 -46.23 80.98 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.312 0 C-N-CA 123.909 0.884 . . . . 0.0 113.206 -168.435 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 1.2 pm0 -75.77 -29.85 58.93 Favored 'General case' 0 N--CA 1.48 1.035 0 C-N-CA 123.615 0.766 . . . . 0.0 111.416 178.553 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 43.1 mt-30 -62.63 -29.04 70.33 Favored 'General case' 0 N--CA 1.491 1.605 0 CA-C-N 118.227 0.467 . . . . 0.0 110.705 172.538 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.43 ' HA ' HD23 ' A' ' 39' ' ' LEU . 42.1 mt -72.85 -39.61 66.38 Favored 'General case' 0 N--CA 1.472 0.662 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.49 174.798 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 47.5 mtm105 -71.68 -20.23 61.96 Favored 'General case' 0 N--CA 1.478 0.945 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.967 176.444 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 46.9 t -64.23 123.25 18.63 Favored 'General case' 0 C--O 1.238 0.494 0 C-N-CA 123.455 0.702 . . . . 0.0 110.334 179.819 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 33.4 mt-10 -62.58 -19.22 63.48 Favored 'General case' 0 CA--C 1.547 0.836 0 C-N-CA 124.484 1.114 . . . . 0.0 111.512 178.909 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 82.9 mt-30 -61.8 -50.29 72.91 Favored 'General case' 0 N--CA 1.472 0.633 0 C-N-CA 124.37 1.068 . . . . 0.0 110.341 176.487 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 39' ' ' LEU . . . . . 0.43 HD23 ' HA ' ' A' ' 34' ' ' LEU . 62.1 tp -72.62 123.67 89.83 Favored Pre-proline 0 CA--C 1.55 0.948 0 CA-C-N 115.396 -0.82 . . . . 0.0 109.783 -178.917 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 39.9 Cg_exo -61.7 149.43 89.97 Favored 'Trans proline' 0 C--N 1.378 2.095 0 C-N-CA 123.157 2.571 . . . . 0.0 113.532 175.105 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 41' ' ' LYS . . . . . 0.633 ' HG2' ' HD3' ' A' ' 75' ' ' LYS . 42.4 mtpt -67.01 -43.51 82.68 Favored 'General case' 0 N--CA 1.477 0.897 0 C-N-CA 124.321 1.048 . . . . 0.0 110.211 179.05 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 11.9 ptmm? -56.18 -36.63 68.57 Favored 'General case' 0 N--CA 1.476 0.859 0 C-N-CA 125.193 1.397 . . . . 0.0 112.864 179.458 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -64.87 -41.08 95.94 Favored 'General case' 0 N--CA 1.476 0.871 0 O-C-N 123.753 0.658 . . . . 0.0 111.281 179.888 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 43.8 mt -67.35 -48.23 78.46 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.961 0 C-N-CA 122.927 0.491 . . . . 0.0 110.085 179.206 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 82.1 mt -59.5 -43.96 91.86 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.05 0 CA-C-N 115.529 -0.76 . . . . 0.0 110.795 -179.875 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 88.3 tttt -63.81 -37.61 88.03 Favored 'General case' 0 N--CA 1.476 0.864 0 O-C-N 123.972 0.795 . . . . 0.0 111.159 -179.859 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 37.8 t80 -63.51 -54.03 42.76 Favored 'General case' 0 N--CA 1.477 0.901 0 CA-C-N 115.266 -0.879 . . . . 0.0 110.638 176.185 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 86.6 mt -68.65 -30.74 69.5 Favored 'General case' 0 N--CA 1.478 0.94 0 C-N-CA 123.642 0.777 . . . . 0.0 111.892 -173.108 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 49' ' ' GLN . . . . . 0.578 ' HA ' HD21 ' A' ' 57' ' ' LEU . 3.5 pt20 -81.62 -26.6 34.72 Favored 'General case' 0 N--CA 1.483 1.185 0 N-CA-C 111.62 0.23 . . . . 0.0 111.62 -179.085 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 12.1 tp10 -62.07 -38.7 89.8 Favored 'General case' 0 N--CA 1.479 1.014 0 C-N-CA 123.7 0.8 . . . . 0.0 111.815 -179.118 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 16.5 p80 -122.09 -25.67 4.88 Favored 'General case' 0 N--CA 1.493 1.71 0 N-CA-C 112.814 0.672 . . . . 0.0 112.814 -175.832 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 52' ' ' GLY . . . . . 0.493 ' HA2' ' HA ' ' A' ' 91' ' ' PHE . . . -61.54 139.58 47.12 Favored Glycine 0 C--N 1.347 1.145 0 CA-C-O 119.628 -0.54 . . . . 0.0 112.374 173.761 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 53' ' ' SER . . . . . 0.476 ' O ' ' HG ' ' A' ' 57' ' ' LEU . 28.7 t -63.57 151.88 40.26 Favored 'General case' 0 N--CA 1.481 1.084 0 C-N-CA 123.523 0.729 . . . . 0.0 111.476 -179.008 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 26.9 t70 -55.45 -37.04 67.2 Favored 'General case' 0 N--CA 1.483 1.189 0 O-C-N 124.309 1.006 . . . . 0.0 111.727 178.046 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 46.0 m -66.13 -42.19 89.45 Favored 'General case' 0 CA--C 1.543 0.71 0 O-C-N 123.84 0.712 . . . . 0.0 111.142 177.312 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 56' ' ' PHE . . . . . 0.43 ' HB2' ' HB3' ' A' ' 90' ' ' ARG . 27.6 t80 -60.57 -41.86 95.48 Favored 'General case' 0 N--CA 1.482 1.174 0 C-N-CA 123.714 0.805 . . . . 0.0 110.365 174.497 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 57' ' ' LEU . . . . . 0.578 HD21 ' HA ' ' A' ' 49' ' ' GLN . 65.0 mt -69.95 -37.73 75.92 Favored 'General case' 0 N--CA 1.47 0.539 0 CA-C-N 115.514 -0.767 . . . . 0.0 111.079 -176.815 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -67.38 -49.2 64.91 Favored 'General case' 0 N--CA 1.482 1.142 0 C-N-CA 123.332 0.653 . . . . 0.0 110.865 -179.74 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 47.1 mt-10 -59.87 -32.04 70.34 Favored 'General case' 0 N--CA 1.477 0.885 0 CA-C-N 115.318 -0.855 . . . . 0.0 111.96 178.183 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 41.1 m80 -116.13 14.39 15.95 Favored 'General case' 0 N--CA 1.485 1.278 0 N-CA-C 112.881 0.697 . . . . 0.0 112.881 -174.805 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 57.6 mttp 57.07 20.6 5.62 Favored 'General case' 0 N--CA 1.498 1.962 0 N-CA-C 114.167 1.173 . . . . 0.0 114.167 172.995 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 94.9 mt -83.64 -10.7 58.04 Favored 'General case' 0 N--CA 1.482 1.172 0 C-N-CA 122.822 0.449 . . . . 0.0 111.951 -174.847 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 2.5 pp -81.96 176.33 9.64 Favored 'General case' 0 N--CA 1.481 1.112 0 CA-C-O 121.31 0.576 . . . . 0.0 111.144 175.481 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 90.17 -148.9 19.97 Favored Glycine 0 C--N 1.336 0.583 0 CA-C-N 114.686 -1.143 . . . . 0.0 111.823 177.973 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 9.8 m120 -77.03 119.77 21.22 Favored 'General case' 0 N--CA 1.468 0.441 0 N-CA-C 108.68 -0.859 . . . . 0.0 108.68 176.283 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 64.1 mt -54.08 -48.06 65.49 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.051 0 C-N-CA 123.709 0.804 . . . . 0.0 110.157 178.698 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 61.3 pttt -54.12 -38.75 65.75 Favored 'General case' 0 N--CA 1.485 1.293 0 C-N-CA 124.022 0.929 . . . . 0.0 112.461 178.563 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 8.1 t30 -68.32 -45.64 72.41 Favored 'General case' 0 N--CA 1.478 0.941 0 C-N-CA 123.319 0.647 . . . . 0.0 110.692 179.524 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 69' ' ' VAL . . . . . 0.445 ' HA ' HG22 ' A' ' 72' ' ' THR . 44.9 t -71.94 -31.88 42.22 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.974 0 CA-C-N 115.58 -0.737 . . . . 0.0 110.714 -178.075 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -73.09 -14.94 61.49 Favored 'General case' 0 N--CA 1.479 1.007 0 C-N-CA 123.697 0.799 . . . . 0.0 112.212 -177.413 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 16.8 ptpt -99.3 -48.78 4.69 Favored 'General case' 0 CA--C 1.547 0.851 0 CA-C-N 118.11 0.414 . . . . 0.0 111.41 170.605 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 72' ' ' THR . . . . . 0.445 HG22 ' HA ' ' A' ' 69' ' ' VAL . 7.6 t -73.39 -35.34 65.89 Favored 'General case' 0 N--CA 1.487 1.419 0 C-N-CA 122.937 0.495 . . . . 0.0 112.027 -171.157 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -100.92 130.55 46.94 Favored 'General case' 0 N--CA 1.472 0.669 0 C-N-CA 123.699 0.799 . . . . 0.0 109.425 177.485 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 74' ' ' ASN . . . . . 0.401 ' O ' ' HG ' ' A' ' 78' ' ' LEU . 29.1 p-10 -82.98 173.81 11.46 Favored 'General case' 0 N--CA 1.484 1.27 0 C-N-CA 123.491 0.716 . . . . 0.0 111.216 -174.45 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 75' ' ' LYS . . . . . 0.633 ' HD3' ' HG2' ' A' ' 41' ' ' LYS . 15.7 tptm -64.25 -39.8 94.7 Favored 'General case' 0 N--CA 1.477 0.898 0 C-N-CA 123.676 0.79 . . . . 0.0 111.176 -174.403 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 22.3 t70 -64.41 -38.41 90.93 Favored 'General case' 0 N--CA 1.482 1.142 0 C-N-CA 124.009 0.924 . . . . 0.0 111.053 -177.212 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 77' ' ' HIS . . . . . 0.424 ' HD2' HD23 ' A' ' 78' ' ' LEU . 33.0 t60 -55.39 -43.58 75.31 Favored 'General case' 0 N--CA 1.481 1.076 0 C-N-CA 124.696 1.198 . . . . 0.0 110.56 173.902 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 78' ' ' LEU . . . . . 0.424 HD23 ' HD2' ' A' ' 77' ' ' HIS . 25.5 mt -67.74 -40.26 84.15 Favored 'General case' 0 N--CA 1.477 0.894 0 C-N-CA 123.882 0.873 . . . . 0.0 111.103 -175.663 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 79' ' ' VAL . . . . . 0.414 HG23 ' O ' ' A' ' 75' ' ' LYS . 45.2 t -66.55 -45.01 89.79 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.821 0 C-N-CA 123.801 0.841 . . . . 0.0 110.118 179.276 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 33.1 m -60.72 -42.91 98.23 Favored 'General case' 0 N--CA 1.482 1.171 0 C-N-CA 123.599 0.76 . . . . 0.0 111.117 179.08 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -66.87 -39.9 87.69 Favored 'General case' 0 N--CA 1.476 0.868 0 C-N-CA 123.705 0.802 . . . . 0.0 110.992 178.87 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 82' ' ' TYR . . . . . 0.444 ' O ' ' HB3' ' A' ' 85' ' ' LEU . 5.5 t80 -56.67 -55.64 31.47 Favored 'General case' 0 C--O 1.218 -0.557 0 C-N-CA 124.663 1.185 . . . . 0.0 110.908 177.035 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 83' ' ' ASN . . . . . . . . . . . . . 59.7 m-80 -67.33 -40.51 85.91 Favored 'General case' 0 N--CA 1.486 1.352 0 C-N-CA 122.52 0.328 . . . . 0.0 111.143 -174.58 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 55.4 m170 -66.51 -24.3 66.37 Favored 'General case' 0 N--CA 1.483 1.222 0 C-N-CA 123.771 0.829 . . . . 0.0 111.612 177.415 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 85' ' ' LEU . . . . . 0.444 ' HB3' ' O ' ' A' ' 82' ' ' TYR . 53.9 tp -59.3 -54.73 43.44 Favored 'General case' 0 N--CA 1.479 0.982 0 CA-C-O 121.327 0.584 . . . . 0.0 110.822 175.16 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 45.0 m-85 -73.77 -30.4 62.75 Favored 'General case' 0 N--CA 1.475 0.777 0 CA-C-N 114.515 -1.22 . . . . 0.0 110.798 -176.627 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 44.3 tt0 -65.29 -24.6 67.34 Favored 'General case' 0 N--CA 1.482 1.137 0 C-N-CA 124.076 0.95 . . . . 0.0 112.48 -175.95 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 10.1 p -125.16 -4.2 7.44 Favored 'General case' 0 N--CA 1.478 0.949 0 C-N-CA 123.731 0.812 . . . . 0.0 110.921 177.765 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 94.3 mttt 56.23 49.75 14.73 Favored 'General case' 0 N--CA 1.485 1.293 0 C-N-CA 124.364 1.066 . . . . 0.0 111.48 -175.806 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 90' ' ' ARG . . . . . 0.43 ' HB3' ' HB2' ' A' ' 56' ' ' PHE . 54.4 mtt85 -68.95 -13.27 62.34 Favored 'General case' 0 N--CA 1.488 1.44 0 C-N-CA 124.791 1.237 . . . . 0.0 112.891 178.018 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 91' ' ' PHE . . . . . 0.493 ' HA ' ' HA2' ' A' ' 52' ' ' GLY . 4.2 p90 -68.14 139.96 56.16 Favored 'General case' 0 N--CA 1.475 0.816 0 C-N-CA 122.442 0.297 . . . . 0.0 110.787 175.295 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 C--O 1.256 1.406 0 C-N-CA 124.441 1.097 . . . . 0.0 108.286 172.357 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 27.7 ptt180 . . . . . 0 CA--C 1.543 0.683 0 CA-C-O 121.518 0.675 . . . . 0.0 110.457 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -74.84 -22.38 58.72 Favored 'General case' 0 CA--C 1.54 0.575 0 CA-C-N 114.912 -1.04 . . . . 0.0 112.668 -167.047 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 29' ' ' TRP . . . . . 0.421 ' HB3' ' HB2' ' A' ' 33' ' ' GLN . 3.9 m-90 -138.89 150.71 46.27 Favored 'General case' 0 N--CA 1.478 0.945 0 C-N-CA 123.829 0.852 . . . . 0.0 110.902 -168.529 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 37.7 p -90.4 173.78 7.92 Favored 'General case' 0 N--CA 1.471 0.593 0 CA-C-N 115.37 -0.832 . . . . 0.0 109.05 170.404 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 31' ' ' VAL . . . . . 0.524 ' HA ' HD12 ' A' ' 34' ' ' LEU . 10.5 p -59.29 -34.3 53.57 Favored 'Isoleucine or valine' 0 CA--C 1.557 1.248 0 C-N-CA 123.741 0.816 . . . . 0.0 112.362 -174.689 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 12.5 pt-20 -70.48 -35.67 73.41 Favored 'General case' 0 N--CA 1.481 1.098 0 C-N-CA 123.589 0.756 . . . . 0.0 111.028 176.816 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 33' ' ' GLN . . . . . 0.421 ' HB2' ' HB3' ' A' ' 29' ' ' TRP . 22.5 mm-40 -72.64 -30.4 64.27 Favored 'General case' 0 CA--C 1.546 0.803 0 C-N-CA 123.103 0.561 . . . . 0.0 110.798 176.184 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.54 ' HB3' HG22 ' A' ' 79' ' ' VAL . 93.1 mt -72.27 -37.78 68.98 Favored 'General case' 0 N--CA 1.476 0.839 0 C-N-CA 123.674 0.79 . . . . 0.0 112.287 -179.0 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 12.0 ptt180 -76.43 -22.56 54.5 Favored 'General case' 0 N--CA 1.479 1.019 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.275 176.508 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 41.5 t -58.39 109.91 0.87 Allowed 'General case' 0 C--N 1.356 0.859 0 O-C-N 124.017 0.823 . . . . 0.0 111.829 -173.593 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 9.9 pt-20 -62.27 -21.08 64.93 Favored 'General case' 0 N--CA 1.484 1.261 0 C-N-CA 124.771 1.228 . . . . 0.0 112.541 179.453 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 12.0 mm100 -67.85 -32.82 73.61 Favored 'General case' 0 N--CA 1.473 0.715 0 C-N-CA 123.941 0.896 . . . . 0.0 110.356 176.437 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 3.5 tt -73.38 127.59 88.71 Favored Pre-proline 0 CA--C 1.547 0.861 0 N-CA-C 108.024 -1.102 . . . . 0.0 108.024 175.866 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 53.0 Cg_exo -55.41 126.35 22.21 Favored 'Trans proline' 0 C--N 1.378 2.088 0 C-N-CA 122.546 2.164 . . . . 0.0 112.365 174.015 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 41' ' ' LYS . . . . . 0.756 ' HG2' ' HD3' ' A' ' 75' ' ' LYS . 35.9 mtmm -58.08 -37.78 75.13 Favored 'General case' 0 N--CA 1.48 1.069 0 C-N-CA 124.348 1.059 . . . . 0.0 110.483 177.58 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 18.8 ptpt -62.19 -35.9 80.25 Favored 'General case' 0 N--CA 1.472 0.626 0 CA-C-N 114.777 -1.101 . . . . 0.0 111.9 175.498 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 30.2 t70 -69.82 -32.72 71.3 Favored 'General case' 0 CA--C 1.545 0.757 0 C-N-CA 122.444 0.298 . . . . 0.0 110.82 -174.338 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 56.2 mt -66.57 -52.4 46.45 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.148 0 N-CA-C 109.575 -0.528 . . . . 0.0 109.575 174.217 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 45' ' ' ILE . . . . . 0.48 HD13 HG12 ' A' ' 69' ' ' VAL . 76.4 mt -58.49 -33.38 48.0 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.333 0 C-N-CA 124.451 1.1 . . . . 0.0 111.654 178.95 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 33.0 ttmt -61.68 -41.94 98.24 Favored 'General case' 0 N--CA 1.48 1.028 0 C-N-CA 124.394 1.078 . . . . 0.0 110.796 179.233 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 2.0 t80 -70.89 -37.66 73.01 Favored 'General case' 0 CA--C 1.548 0.884 0 CA-C-N 114.488 -1.233 . . . . 0.0 109.858 177.698 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 48' ' ' LEU . . . . . 0.483 HD21 ' HA ' ' A' ' 82' ' ' TYR . 93.1 mt -68.89 -31.84 71.05 Favored 'General case' 0 N--CA 1.476 0.862 0 C-N-CA 123.481 0.712 . . . . 0.0 112.488 -178.73 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 49' ' ' GLN . . . . . 0.568 ' HA ' HD21 ' A' ' 57' ' ' LEU . 3.8 pt20 -85.07 -28.03 25.91 Favored 'General case' 0 N--CA 1.479 1.012 0 C-N-CA 122.103 0.161 . . . . 0.0 111.393 176.081 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 42.7 tt0 -61.22 -35.17 76.48 Favored 'General case' 0 N--CA 1.479 1.007 0 O-C-N 123.767 0.667 . . . . 0.0 111.26 -178.176 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 59.7 m-70 -112.86 -44.68 3.27 Favored 'General case' 0 N--CA 1.469 0.524 0 CA-C-N 115.798 -0.637 . . . . 0.0 110.022 -179.066 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 52' ' ' GLY . . . . . 0.422 ' HA2' ' HA ' ' A' ' 91' ' ' PHE . . . -57.07 131.28 51.97 Favored Glycine 0 C--N 1.354 1.564 0 O-C-N 123.912 0.757 . . . . 0.0 114.318 -175.328 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 44.1 m -72.58 166.12 23.34 Favored 'General case' 0 CA--C 1.54 0.57 0 C-N-CA 124.07 0.948 . . . . 0.0 111.736 -177.159 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 23.3 t70 -54.17 -38.77 65.93 Favored 'General case' 0 N--CA 1.481 1.083 0 CA-C-N 115.001 -0.999 . . . . 0.0 112.574 -175.233 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 20.2 t -67.05 -37.98 85.04 Favored 'General case' 0 CA--C 1.55 0.966 0 O-C-N 123.55 0.531 . . . . 0.0 111.098 -179.532 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 56' ' ' PHE . . . . . 0.501 ' HD1' HH11 ' A' ' 90' ' ' ARG . 53.4 t80 -67.02 -41.04 87.3 Favored 'General case' 0 N--CA 1.486 1.332 0 C-N-CA 123.632 0.773 . . . . 0.0 110.109 176.049 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 57' ' ' LEU . . . . . 0.568 HD21 ' HA ' ' A' ' 49' ' ' GLN . 39.0 mt -69.56 -55.25 10.68 Favored 'General case' 0 N--CA 1.471 0.595 0 CA-C-N 115.829 -0.623 . . . . 0.0 110.666 -175.802 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -61.55 -29.1 69.79 Favored 'General case' 0 N--CA 1.487 1.386 0 C-N-CA 124.394 1.078 . . . . 0.0 112.742 -174.109 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 50.6 mt-10 -54.39 -45.64 72.94 Favored 'General case' 0 N--CA 1.484 1.246 0 C-N-CA 122.798 0.439 . . . . 0.0 111.497 174.508 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 37.5 t-80 -114.07 4.14 15.54 Favored 'General case' 0 N--CA 1.48 1.042 0 C-N-CA 122.845 0.458 . . . . 0.0 111.345 -176.104 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 32.5 mmtp 49.29 60.5 3.72 Favored 'General case' 0 N--CA 1.476 0.831 0 C-N-CA 124.672 1.189 . . . . 0.0 111.301 -171.867 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 62' ' ' LEU . . . . . 0.52 ' HA ' HG11 ' A' ' 69' ' ' VAL . 95.2 mt -85.17 -14.77 45.89 Favored 'General case' 0 N--CA 1.481 1.11 0 CA-C-N 115.013 -0.994 . . . . 0.0 110.214 174.417 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 1.1 pp -76.66 171.11 15.22 Favored 'General case' 0 CA--C 1.545 0.769 0 C-N-CA 124.098 0.959 . . . . 0.0 110.739 173.556 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 88.4 -146.62 19.62 Favored Glycine 0 C--N 1.341 0.821 0 CA-C-N 115.61 -0.723 . . . . 0.0 111.921 -179.922 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 65' ' ' ASN . . . . . 0.414 ' O ' HG23 ' A' ' 69' ' ' VAL . 38.8 m-80 -72.73 113.12 9.41 Favored 'General case' 0 N--CA 1.478 0.947 0 N-CA-C 108.578 -0.897 . . . . 0.0 108.578 175.228 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 17.9 mt -55.9 -39.63 57.98 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.208 0 O-C-N 124.266 0.979 . . . . 0.0 110.335 -177.5 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 60.9 pttt -60.9 -39.76 90.54 Favored 'General case' 0 N--CA 1.478 0.961 0 C-N-CA 124.928 1.291 . . . . 0.0 112.246 178.302 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 28.3 t-20 -73.86 -36.47 64.86 Favored 'General case' 0 N--CA 1.477 0.899 0 C-N-CA 123.704 0.802 . . . . 0.0 109.984 -177.061 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 69' ' ' VAL . . . . . 0.52 HG11 ' HA ' ' A' ' 62' ' ' LEU . 58.7 t -63.53 -45.55 97.46 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.622 0 CA-C-N 114.984 -1.007 . . . . 0.0 109.522 172.17 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -67.59 -17.95 64.81 Favored 'General case' 0 N--CA 1.477 0.925 0 C-N-CA 124.582 1.153 . . . . 0.0 112.363 -177.068 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 25.3 ttpp -76.43 -43.66 39.19 Favored 'General case' 0 CA--C 1.539 0.55 0 C-N-CA 123.122 0.569 . . . . 0.0 110.469 175.524 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 15.1 t -99.94 -9.6 22.61 Favored 'General case' 0 CA--C 1.558 1.286 0 C-N-CA 123.848 0.859 . . . . 0.0 113.092 -171.304 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -87.79 160.02 18.2 Favored 'General case' 0 N--CA 1.484 1.25 0 C-N-CA 123.257 0.623 . . . . 0.0 110.553 179.544 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 50.4 t30 -110.16 129.99 55.62 Favored 'General case' 0 N--CA 1.48 1.066 0 C-N-CA 124.3 1.04 . . . . 0.0 109.321 -175.822 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 75' ' ' LYS . . . . . 0.756 ' HD3' ' HG2' ' A' ' 41' ' ' LYS . 22.7 tptp -59.48 -40.23 86.29 Favored 'General case' 0 N--CA 1.492 1.652 0 C-N-CA 123.977 0.911 . . . . 0.0 112.165 -169.932 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 3.5 p30 -74.74 -29.02 61.02 Favored 'General case' 0 N--CA 1.484 1.257 0 O-C-N 123.227 0.329 . . . . 0.0 111.05 -177.347 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 27.7 t60 -73.47 -28.74 62.11 Favored 'General case' 0 CA--C 1.549 0.935 0 C-N-CA 123.005 0.522 . . . . 0.0 110.062 173.341 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 83.1 mt -65.47 -32.84 74.67 Favored 'General case' 0 N--CA 1.49 1.547 0 C-N-CA 122.918 0.487 . . . . 0.0 110.596 175.147 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 79' ' ' VAL . . . . . 0.54 HG22 ' HB3' ' A' ' 34' ' ' LEU . 40.8 t -62.18 -47.94 90.75 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.139 0 C-N-CA 124.193 0.997 . . . . 0.0 109.658 172.718 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 16.0 m -64.53 -48.13 76.22 Favored 'General case' 0 N--CA 1.47 0.548 0 CA-C-N 114.176 -1.374 . . . . 0.0 111.841 -175.785 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -67.55 -34.02 76.22 Favored 'General case' 0 N--CA 1.477 0.923 0 C-N-CA 123.766 0.826 . . . . 0.0 111.176 -177.601 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 82' ' ' TYR . . . . . 0.483 ' HA ' HD21 ' A' ' 48' ' ' LEU . 81.4 t80 -60.19 -54.95 39.72 Favored 'General case' 0 N--CA 1.469 0.519 0 C-N-CA 124.487 1.115 . . . . 0.0 110.669 177.788 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 83' ' ' ASN . . . . . . . . . . . . . 90.6 m-20 -69.77 -31.11 68.88 Favored 'General case' 0 CA--C 1.54 0.565 0 CA-C-N 114.847 -1.069 . . . . 0.0 110.574 -178.021 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 2.8 m-70 -70.32 -28.44 65.16 Favored 'General case' 0 N--CA 1.485 1.282 0 C-N-CA 123.576 0.75 . . . . 0.0 111.607 174.734 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 44.9 tp -60.29 -53.26 59.72 Favored 'General case' 0 N--CA 1.478 0.968 0 CA-C-O 121.739 0.781 . . . . 0.0 109.911 -178.724 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 86' ' ' PHE . . . . . 0.46 ' HA ' ' HE2' ' A' ' 91' ' ' PHE . 6.3 m-85 -75.48 -31.4 60.22 Favored 'General case' 0 CA--C 1.549 0.935 0 CA-C-N 113.771 -1.559 . . . . 0.0 111.079 -175.42 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 10.4 tp10 -69.16 -40.49 78.15 Favored 'General case' 0 N--CA 1.482 1.158 0 C-N-CA 124.103 0.961 . . . . 0.0 111.719 -173.436 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 37.0 p -109.56 2.8 20.61 Favored 'General case' 0 N--CA 1.484 1.256 0 C-N-CA 123.28 0.632 . . . . 0.0 111.689 -178.622 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 89' ' ' LYS . . . . . 0.453 ' HA ' ' CE2' ' A' ' 91' ' ' PHE . 48.7 mtpt 59.34 44.7 14.94 Favored 'General case' 0 N--CA 1.478 0.949 0 C-N-CA 124.391 1.076 . . . . 0.0 112.225 179.843 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 90' ' ' ARG . . . . . 0.501 HH11 ' HD1' ' A' ' 56' ' ' PHE . 20.5 mtt180 -67.94 -7.39 28.16 Favored 'General case' 0 N--CA 1.486 1.355 0 C-N-CA 124.426 1.09 . . . . 0.0 113.266 178.547 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 91' ' ' PHE . . . . . 0.46 ' HE2' ' HA ' ' A' ' 86' ' ' PHE . 36.7 p90 -77.67 161.91 27.41 Favored 'General case' 0 CA--C 1.541 0.603 0 C-N-CA 124.118 0.967 . . . . 0.0 111.651 171.622 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 61.7 tttm . . . . . 0 C--O 1.25 1.112 0 C-N-CA 124.177 0.991 . . . . 0.0 109.581 178.178 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 9.8 ptp85 . . . . . 0 CA--C 1.544 0.75 0 CA-C-O 120.944 0.402 . . . . 0.0 111.132 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -95.78 -15.85 22.29 Favored 'General case' 0 N--CA 1.476 0.871 0 C-N-CA 123.185 0.594 . . . . 0.0 110.936 -176.237 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 29' ' ' TRP . . . . . . . . . . . . . 8.5 m-90 -142.94 157.78 44.24 Favored 'General case' 0 N--CA 1.482 1.155 0 C-N-CA 123.983 0.913 . . . . 0.0 109.879 -174.623 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 11.9 m -82.49 161.71 22.29 Favored 'General case' 0 CA--C 1.549 0.928 0 N-CA-C 108.065 -1.087 . . . . 0.0 108.065 168.495 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 31' ' ' VAL . . . . . 0.553 ' HA ' HD12 ' A' ' 34' ' ' LEU . 4.6 p -52.92 -39.64 32.91 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.399 0 C-N-CA 123.924 0.89 . . . . 0.0 111.796 -179.757 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 11.4 pt-20 -66.39 -43.21 86.49 Favored 'General case' 0 N--CA 1.479 1.022 0 C-N-CA 124.716 1.206 . . . . 0.0 111.263 177.483 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 44.8 mt-30 -64.7 -32.68 74.46 Favored 'General case' 0 N--CA 1.477 0.923 0 C-N-CA 123.525 0.73 . . . . 0.0 110.935 -179.038 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.553 HD12 ' HA ' ' A' ' 31' ' ' VAL . 51.6 mt -66.36 -50.35 63.83 Favored 'General case' 0 N--CA 1.47 0.548 0 O-C-N 124.112 0.883 . . . . 0.0 110.965 176.012 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 29.8 mtp180 -68.72 -18.99 64.34 Favored 'General case' 0 N--CA 1.475 0.795 0 C-N-CA 124.38 1.072 . . . . 0.0 111.665 -178.139 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 46.6 t -60.34 123.85 18.52 Favored 'General case' 0 CA--C 1.544 0.742 0 O-C-N 123.657 0.598 . . . . 0.0 110.251 176.162 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -55.53 -28.94 57.76 Favored 'General case' 0 CA--C 1.549 0.935 0 C-N-CA 125.057 1.343 . . . . 0.0 112.981 -177.056 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 91.3 mt-30 -65.17 -34.97 79.66 Favored 'General case' 0 N--CA 1.48 1.041 0 C-N-CA 123.927 0.891 . . . . 0.0 112.362 -177.774 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 39' ' ' LEU . . . . . 0.432 HD23 ' HD2' ' A' ' 40' ' ' PRO . 1.2 tt -69.2 123.09 87.53 Favored Pre-proline 0 N--CA 1.488 1.433 0 N-CA-C 109.154 -0.684 . . . . 0.0 109.154 -178.904 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 40' ' ' PRO . . . . . 0.468 ' HB2' ' HG2' ' A' ' 42' ' ' LYS . 35.1 Cg_endo -62.82 128.95 24.57 Favored 'Trans proline' 0 C--N 1.37 1.709 0 C-N-CA 122.149 1.899 . . . . 0.0 112.02 173.278 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 35.9 mtmm -56.71 -36.7 69.98 Favored 'General case' 0 N--CA 1.483 1.186 0 C-N-CA 123.922 0.889 . . . . 0.0 111.671 178.603 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 42' ' ' LYS . . . . . 0.468 ' HG2' ' HB2' ' A' ' 40' ' ' PRO . 19.2 ptpt -58.9 -34.39 71.62 Favored 'General case' 0 N--CA 1.474 0.772 0 C-N-CA 124.015 0.926 . . . . 0.0 111.6 -177.856 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 3.4 t70 -73.47 -36.22 65.81 Favored 'General case' 0 CA--C 1.54 0.594 0 CA-C-N 115.457 -0.792 . . . . 0.0 109.707 -176.415 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 44' ' ' ILE . . . . . 0.437 ' HB ' HD13 ' A' ' 78' ' ' LEU . 38.1 mt -68.61 -46.79 79.4 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.927 0 CA-C-N 115.742 -0.663 . . . . 0.0 110.023 177.702 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 74.7 mt -55.52 -42.82 69.92 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.593 0 C-N-CA 123.754 0.821 . . . . 0.0 110.495 174.88 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 38.2 ttpt -59.24 -36.43 75.44 Favored 'General case' 0 CA--C 1.55 0.945 0 C-N-CA 124.516 1.126 . . . . 0.0 111.178 179.154 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 18.7 t80 -69.69 -47.72 62.2 Favored 'General case' 0 N--CA 1.48 1.057 0 CA-C-N 115.634 -0.712 . . . . 0.0 111.027 176.272 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 90.5 mt -71.82 -32.79 67.92 Favored 'General case' 0 N--CA 1.476 0.851 0 C-N-CA 123.935 0.894 . . . . 0.0 112.885 -171.588 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 49' ' ' GLN . . . . . 0.446 ' HA ' HD21 ' A' ' 57' ' ' LEU . 3.5 pt20 -82.44 -27.95 31.61 Favored 'General case' 0 N--CA 1.484 1.264 0 CA-C-N 117.747 0.249 . . . . 0.0 111.231 -179.989 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 9.9 tp10 -69.69 -33.66 72.86 Favored 'General case' 0 N--CA 1.475 0.79 0 C-N-CA 123.353 0.661 . . . . 0.0 110.797 -179.402 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 66.2 m80 -112.06 -43.15 3.61 Favored 'General case' 0 N--CA 1.474 0.756 0 CA-C-N 115.309 -0.86 . . . . 0.0 112.381 -171.182 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 52' ' ' GLY . . . . . 0.418 ' HA2' ' HA ' ' A' ' 91' ' ' PHE . . . -65.41 132.74 35.64 Favored Glycine 0 N--CA 1.47 0.923 0 CA-C-O 119.346 -0.696 . . . . 0.0 111.899 171.976 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 20.1 t -80.28 168.52 18.95 Favored 'General case' 0 N--CA 1.48 1.073 0 CA-C-N 117.342 0.571 . . . . 0.0 110.165 -178.074 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 6.2 p-10 -58.87 -34.61 71.8 Favored 'General case' 0 N--CA 1.488 1.463 0 C-N-CA 124.345 1.058 . . . . 0.0 113.661 -169.313 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 23.1 m -72.93 -24.99 60.88 Favored 'General case' 0 N--CA 1.484 1.249 0 C-N-CA 122.748 0.419 . . . . 0.0 111.733 -179.421 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 56' ' ' PHE . . . . . 0.479 ' HB2' ' HB3' ' A' ' 90' ' ' ARG . 63.9 t80 -75.68 -49.93 16.89 Favored 'General case' 0 C--O 1.241 0.641 0 C-N-CA 123.445 0.698 . . . . 0.0 109.264 169.002 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 57' ' ' LEU . . . . . 0.446 HD21 ' HA ' ' A' ' 49' ' ' GLN . 62.0 mt -59.72 -50.64 73.04 Favored 'General case' 0 C--O 1.211 -0.938 0 CA-C-N 114.879 -1.055 . . . . 0.0 112.068 -168.892 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -60.42 -38.64 84.7 Favored 'General case' 0 N--CA 1.482 1.169 0 C-N-CA 123.497 0.719 . . . . 0.0 112.215 -175.403 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 12.3 mm-40 -67.27 -23.25 65.66 Favored 'General case' 0 N--CA 1.478 0.939 0 C-N-CA 123.176 0.59 . . . . 0.0 112.114 179.297 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 88.1 m-70 -115.99 7.28 14.31 Favored 'General case' 0 N--CA 1.484 1.274 0 C-N-CA 123.554 0.742 . . . . 0.0 111.332 176.275 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 48.3 mtpt 47.33 44.81 16.49 Favored 'General case' 0 N--CA 1.488 1.472 0 C-N-CA 125.119 1.368 . . . . 0.0 112.948 -178.934 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 66.8 mt -94.04 -11.42 30.76 Favored 'General case' 0 N--CA 1.478 0.951 0 C-N-CA 124.04 0.936 . . . . 0.0 111.931 -179.07 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 1.4 pp -79.44 -178.06 6.09 Favored 'General case' 0 N--CA 1.484 1.254 0 CA-C-O 121.357 0.598 . . . . 0.0 111.793 178.762 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 77.35 -142.44 27.14 Favored Glycine 0 C--N 1.341 0.828 0 CA-C-N 114.827 -1.078 . . . . 0.0 112.17 177.557 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 79.3 m-20 -82.04 131.06 35.24 Favored 'General case' 0 N--CA 1.469 0.481 0 N-CA-C 109.173 -0.677 . . . . 0.0 109.173 177.866 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 69.8 mt -57.49 -40.47 74.85 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.055 0 C-N-CA 123.478 0.711 . . . . 0.0 110.568 179.519 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 38.8 mtmm -55.19 -48.22 74.14 Favored 'General case' 0 N--CA 1.485 1.285 0 C-N-CA 123.332 0.653 . . . . 0.0 111.69 177.01 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 68' ' ' ASN . . . . . 0.415 ' O ' HG22 ' A' ' 72' ' ' THR . 3.3 m-20 -54.46 -41.71 69.79 Favored 'General case' 0 N--CA 1.49 1.558 0 C-N-CA 123.742 0.817 . . . . 0.0 111.606 177.905 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 22.3 t -73.07 -38.77 56.16 Favored 'Isoleucine or valine' 0 CA--C 1.551 0.996 0 CA-C-N 115.648 -0.705 . . . . 0.0 110.454 179.396 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -73.78 -26.46 60.65 Favored 'General case' 0 N--CA 1.488 1.432 0 C-N-CA 123.485 0.714 . . . . 0.0 112.592 -173.254 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 22.4 ptmt -81.88 -18.66 43.0 Favored 'General case' 0 N--CA 1.485 1.293 0 C-N-CA 122.704 0.402 . . . . 0.0 111.817 -176.232 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 72' ' ' THR . . . . . 0.415 HG22 ' O ' ' A' ' 68' ' ' ASN . 9.5 t -118.42 -34.8 3.94 Favored 'General case' 0 N--CA 1.484 1.234 0 C-N-CA 123.146 0.578 . . . . 0.0 111.754 -174.56 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 73' ' ' ALA . . . . . 0.444 ' HB1' ' ND1' ' A' ' 77' ' ' HIS . . . -98.35 141.25 31.47 Favored 'General case' 0 N--CA 1.471 0.586 0 C-N-CA 123.455 0.702 . . . . 0.0 110.219 -174.332 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 74' ' ' ASN . . . . . 0.441 ' ND2' ' HB3' ' A' ' 76' ' ' ASP . 26.9 p-10 -97.25 175.5 6.25 Favored 'General case' 0 N--CA 1.474 0.761 0 C-N-CA 123.603 0.761 . . . . 0.0 111.014 -176.043 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 75' ' ' LYS . . . . . 0.461 ' O ' HG23 ' A' ' 79' ' ' VAL . 32.0 ttmt -70.06 -38.82 75.88 Favored 'General case' 0 CA--C 1.541 0.602 0 C-N-CA 123.958 0.903 . . . . 0.0 111.269 -177.357 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 76' ' ' ASP . . . . . 0.441 ' HB3' ' ND2' ' A' ' 74' ' ' ASN . 24.0 t70 -58.77 -37.14 75.63 Favored 'General case' 0 N--CA 1.488 1.467 0 C-N-CA 123.577 0.751 . . . . 0.0 110.929 179.022 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 77' ' ' HIS . . . . . 0.444 ' ND1' ' HB1' ' A' ' 73' ' ' ALA . 4.1 t-80 -59.09 -47.56 84.81 Favored 'General case' 0 N--CA 1.476 0.86 0 C-N-CA 124.543 1.137 . . . . 0.0 110.818 173.262 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 78' ' ' LEU . . . . . 0.437 HD13 ' HB ' ' A' ' 44' ' ' ILE . 70.7 mt -65.68 -41.33 92.56 Favored 'General case' 0 N--CA 1.477 0.898 0 C-N-CA 123.372 0.669 . . . . 0.0 111.58 -172.268 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 79' ' ' VAL . . . . . 0.539 HG22 ' HB3' ' A' ' 34' ' ' LEU . 45.7 t -67.14 -44.71 87.75 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.697 0 C-N-CA 123.985 0.914 . . . . 0.0 110.552 -179.243 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 99.6 m -59.33 -50.01 75.62 Favored 'General case' 0 N--CA 1.477 0.876 0 C-N-CA 123.535 0.734 . . . . 0.0 110.924 176.185 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -62.35 -38.02 87.91 Favored 'General case' 0 N--CA 1.477 0.895 0 C-N-CA 123.545 0.738 . . . . 0.0 111.028 179.618 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 82' ' ' TYR . . . . . 0.422 ' O ' ' HB3' ' A' ' 85' ' ' LEU . 7.6 t80 -56.31 -54.16 48.75 Favored 'General case' 0 N--CA 1.476 0.854 0 C-N-CA 124.867 1.267 . . . . 0.0 111.614 177.67 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 83' ' ' ASN . . . . . . . . . . . . . 64.7 m-80 -66.14 -45.71 80.07 Favored 'General case' 0 N--CA 1.483 1.182 0 C-N-CA 122.849 0.46 . . . . 0.0 110.524 -176.953 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 15.2 m-70 -64.58 -26.16 68.29 Favored 'General case' 0 N--CA 1.481 1.097 0 C-N-CA 124.096 0.958 . . . . 0.0 111.295 -179.35 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 85' ' ' LEU . . . . . 0.429 HD11 ' HB3' ' A' ' 91' ' ' PHE . 25.2 tp -58.18 -54.28 48.72 Favored 'General case' 0 N--CA 1.481 1.109 0 C-N-CA 123.679 0.792 . . . . 0.0 110.724 176.59 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 86' ' ' PHE . . . . . 0.402 ' HA ' ' HE2' ' A' ' 91' ' ' PHE . 8.8 m-85 -74.87 -30.59 61.37 Favored 'General case' 0 CA--C 1.544 0.713 0 CA-C-N 113.539 -1.664 . . . . 0.0 111.0 -176.873 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 10.9 tp10 -67.69 -32.5 73.2 Favored 'General case' 0 N--CA 1.475 0.811 0 C-N-CA 124.144 0.978 . . . . 0.0 111.476 -174.436 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 43.3 p -113.94 -9.07 13.07 Favored 'General case' 0 N--CA 1.477 0.923 0 C-N-CA 123.972 0.909 . . . . 0.0 110.982 179.806 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 52.6 mtpt 62.93 41.1 8.82 Favored 'General case' 0 N--CA 1.481 1.081 0 C-N-CA 124.492 1.117 . . . . 0.0 112.415 174.338 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 90' ' ' ARG . . . . . 0.479 ' HB3' ' HB2' ' A' ' 56' ' ' PHE . 54.2 mtt180 -76.82 -5.81 49.79 Favored 'General case' 0 N--CA 1.487 1.423 0 C-N-CA 124.189 0.996 . . . . 0.0 112.735 -178.893 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 91' ' ' PHE . . . . . 0.429 ' HB3' HD11 ' A' ' 85' ' ' LEU . 5.5 p90 -61.9 150.8 36.52 Favored 'General case' 0 N--CA 1.472 0.664 0 C-N-CA 123.041 0.536 . . . . 0.0 112.309 175.475 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 86.2 tttt . . . . . 0 CA--C 1.549 0.914 0 CA-C-N 114.819 -1.082 . . . . 0.0 109.631 -179.155 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.475 0.785 0 N-CA-C 112.566 0.58 . . . . 0.0 112.566 . . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -89.68 -29.51 18.73 Favored 'General case' 0 CA--C 1.544 0.748 0 CA-C-N 115.888 -0.597 . . . . 0.0 109.423 174.125 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 29' ' ' TRP . . . . . . . . . . . . . 6.8 m-90 -141.12 160.59 39.76 Favored 'General case' 0 N--CA 1.487 1.418 0 C-N-CA 124.301 1.041 . . . . 0.0 110.018 -177.925 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 74.5 p -88.44 170.23 11.09 Favored 'General case' 0 N--CA 1.472 0.643 0 C-N-CA 123.172 0.589 . . . . 0.0 109.463 175.261 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 31' ' ' VAL . . . . . 0.5 ' HA ' HD12 ' A' ' 34' ' ' LEU . 14.5 p -62.22 -37.15 77.84 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.416 0 C-N-CA 123.154 0.582 . . . . 0.0 111.817 -173.143 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 9.9 pt-20 -70.32 -34.04 72.22 Favored 'General case' 0 N--CA 1.479 0.98 0 C-N-CA 124.167 0.987 . . . . 0.0 111.304 177.682 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 16.0 mm100 -70.82 -36.17 72.82 Favored 'General case' 0 N--CA 1.475 0.785 0 C-N-CA 122.809 0.444 . . . . 0.0 110.701 173.385 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.56 ' HA ' HD23 ' A' ' 39' ' ' LEU . 92.1 mt -66.07 -53.58 36.53 Favored 'General case' 0 N--CA 1.475 0.792 0 C-N-CA 123.195 0.598 . . . . 0.0 110.614 -177.383 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 9.7 ptp180 -66.35 -21.19 66.24 Favored 'General case' 0 N--CA 1.477 0.879 0 CA-C-N 115.071 -0.968 . . . . 0.0 111.742 -174.323 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 42.0 t -57.11 126.78 28.76 Favored 'General case' 0 C--N 1.354 0.766 0 C-N-CA 123.941 0.897 . . . . 0.0 110.84 176.372 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 16.4 mp0 -63.91 -32.92 74.61 Favored 'General case' 0 CA--C 1.544 0.741 0 C-N-CA 123.339 0.655 . . . . 0.0 110.864 -179.616 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 1.8 mp0 -78.2 0.65 24.26 Favored 'General case' 0 N--CA 1.478 0.959 0 C-N-CA 123.597 0.759 . . . . 0.0 112.318 179.237 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 39' ' ' LEU . . . . . 0.56 HD23 ' HA ' ' A' ' 34' ' ' LEU . 62.4 tp -97.96 111.22 58.64 Favored Pre-proline 0 C--O 1.248 0.996 0 N-CA-C 106.5 -1.667 . . . . 0.0 106.5 158.58 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 32.5 Cg_exo -58.02 135.48 68.92 Favored 'Trans proline' 0 C--N 1.382 2.303 0 C-N-CA 122.662 2.241 . . . . 0.0 112.459 -178.981 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 41' ' ' LYS . . . . . 0.577 ' HG2' ' HE3' ' A' ' 75' ' ' LYS . 53.7 mtpt -56.71 -37.57 71.12 Favored 'General case' 0 N--CA 1.476 0.861 0 C-N-CA 124.885 1.274 . . . . 0.0 111.372 179.675 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 18.1 ptpt -63.31 -32.16 73.5 Favored 'General case' 0 C--O 1.217 -0.622 0 O-C-N 124.117 0.886 . . . . 0.0 112.08 -178.2 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 2.5 m-20 -65.32 -41.17 94.26 Favored 'General case' 0 N--CA 1.487 1.376 0 CA-C-O 120.782 0.325 . . . . 0.0 110.868 176.187 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 57.7 mt -69.16 -50.48 52.5 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.887 0 C-N-CA 123.468 0.707 . . . . 0.0 110.34 -178.835 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 75.8 mt -62.02 -38.5 80.93 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.062 0 C-N-CA 123.513 0.725 . . . . 0.0 110.867 179.495 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -58.09 -50.34 73.8 Favored 'General case' 0 N--CA 1.482 1.141 0 N-CA-C 108.86 -0.793 . . . . 0.0 108.86 175.63 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 27.7 t80 -58.65 -51.92 67.86 Favored 'General case' 0 CA--C 1.548 0.866 0 O-C-N 124.515 1.135 . . . . 0.0 111.069 -178.813 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 92.6 mt -69.62 -30.55 68.3 Favored 'General case' 0 N--CA 1.475 0.803 0 C-N-CA 123.822 0.849 . . . . 0.0 112.203 -173.826 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 2.9 pt20 -82.07 -26.11 33.96 Favored 'General case' 0 N--CA 1.484 1.258 0 C-N-CA 122.384 0.273 . . . . 0.0 110.629 177.174 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 43.1 tt0 -68.71 -22.47 64.34 Favored 'General case' 0 N--CA 1.484 1.243 0 C-N-CA 124.07 0.948 . . . . 0.0 111.811 -177.69 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 56.5 p-80 -127.79 -26.53 2.93 Favored 'General case' 0 N--CA 1.487 1.406 0 N-CA-C 112.635 0.606 . . . . 0.0 112.635 178.013 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -66.57 138.82 36.26 Favored Glycine 0 C--N 1.344 1.007 0 CA-C-O 119.506 -0.608 . . . . 0.0 112.715 178.924 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 53' ' ' SER . . . . . 0.448 ' O ' ' HG ' ' A' ' 57' ' ' LEU . 47.4 t -65.77 147.25 53.68 Favored 'General case' 0 N--CA 1.478 0.933 0 N-CA-C 109.677 -0.49 . . . . 0.0 109.677 178.515 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 8.8 p-10 -61.58 -28.18 69.16 Favored 'General case' 0 N--CA 1.485 1.303 0 C-N-CA 123.529 0.732 . . . . 0.0 111.937 -174.872 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 42.0 p -62.85 -44.13 96.96 Favored 'General case' 0 CA--C 1.552 1.05 0 C-N-CA 124.371 1.068 . . . . 0.0 111.141 174.836 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 67.2 t80 -64.27 -45.78 86.58 Favored 'General case' 0 N--CA 1.482 1.146 0 C-N-CA 124.277 1.031 . . . . 0.0 109.733 174.185 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 57' ' ' LEU . . . . . 0.448 ' HG ' ' O ' ' A' ' 53' ' ' SER . 75.7 mt -63.6 -29.7 70.91 Favored 'General case' 0 C--O 1.214 -0.775 0 CA-C-N 114.415 -1.266 . . . . 0.0 111.161 -176.073 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -71.34 -47.96 53.27 Favored 'General case' 0 N--CA 1.475 0.788 0 C-N-CA 123.237 0.615 . . . . 0.0 110.884 176.189 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 41.0 mt-10 -58.35 -36.12 72.97 Favored 'General case' 0 N--CA 1.491 1.583 0 C-N-CA 123.907 0.883 . . . . 0.0 111.661 178.082 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 54.0 m80 -107.42 -2.05 20.9 Favored 'General case' 0 N--CA 1.486 1.339 0 C-N-CA 123.465 0.706 . . . . 0.0 112.062 -174.454 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 95.8 mttt 54.33 38.61 29.77 Favored 'General case' 0 N--CA 1.492 1.648 0 C-N-CA 124.678 1.191 . . . . 0.0 112.775 -179.935 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 85.9 mt -88.26 -8.89 54.53 Favored 'General case' 0 N--CA 1.479 0.986 0 C-N-CA 123.15 0.58 . . . . 0.0 111.164 176.653 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -80.17 166.78 21.12 Favored 'General case' 0 N--CA 1.485 1.318 0 CA-C-O 120.917 0.389 . . . . 0.0 111.168 174.632 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 92.63 -168.76 30.8 Favored Glycine 0 C--N 1.34 0.799 0 CA-C-N 115.22 -0.9 . . . . 0.0 112.155 -179.477 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 88.5 m-20 -60.79 120.43 10.11 Favored 'General case' 0 N--CA 1.472 0.626 0 C-N-CA 123.232 0.613 . . . . 0.0 109.668 179.306 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 26.9 mt -61.33 -47.9 91.36 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.766 0 C-N-CA 124.039 0.936 . . . . 0.0 111.65 -167.069 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.66 -31.85 72.8 Favored 'General case' 0 N--CA 1.487 1.4 0 C-N-CA 123.748 0.819 . . . . 0.0 111.369 177.615 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 6.0 t30 -69.89 -36.43 75.43 Favored 'General case' 0 N--CA 1.483 1.22 0 C-N-CA 124.429 1.092 . . . . 0.0 110.609 178.396 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 47.7 t -73.06 -34.98 46.97 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.925 0 CA-C-N 115.83 -0.623 . . . . 0.0 109.502 172.274 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -73.44 -6.7 47.99 Favored 'General case' 0 N--CA 1.477 0.922 0 C-N-CA 124.207 1.003 . . . . 0.0 113.062 -174.538 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 22.3 ptmt -97.5 -26.66 14.75 Favored 'General case' 0 N--CA 1.48 1.052 0 CA-C-N 118.507 0.594 . . . . 0.0 112.271 173.454 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 8.8 t -112.08 -36.72 5.27 Favored 'General case' 0 N--CA 1.484 1.236 0 N-CA-C 112.787 0.662 . . . . 0.0 112.787 -166.734 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -91.2 102.46 15.18 Favored 'General case' 0 N--CA 1.472 0.661 0 N-CA-C 107.927 -1.138 . . . . 0.0 107.927 177.558 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 74' ' ' ASN . . . . . 0.449 ' O ' ' HG ' ' A' ' 78' ' ' LEU . 9.4 p30 -65.96 167.67 9.35 Favored 'General case' 0 N--CA 1.486 1.35 0 C-N-CA 123.863 0.865 . . . . 0.0 112.093 -169.687 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 75' ' ' LYS . . . . . 0.577 ' HE3' ' HG2' ' A' ' 41' ' ' LYS . 4.7 tppp? -63.08 -41.32 99.39 Favored 'General case' 0 CA--C 1.55 0.965 0 C-N-CA 122.9 0.48 . . . . 0.0 112.257 -174.014 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 19.1 t70 -60.38 -36.92 79.18 Favored 'General case' 0 N--CA 1.492 1.674 0 C-N-CA 123.52 0.728 . . . . 0.0 110.817 178.561 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 77' ' ' HIS . . . . . 0.415 ' HB3' ' O ' ' A' ' 74' ' ' ASN . 29.9 t60 -63.78 -39.73 94.95 Favored 'General case' 0 N--CA 1.479 0.983 0 C-N-CA 125.257 1.423 . . . . 0.0 110.466 175.206 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 78' ' ' LEU . . . . . 0.449 ' HG ' ' O ' ' A' ' 74' ' ' ASN . 40.9 mt -70.42 -38.89 74.66 Favored 'General case' 0 N--CA 1.487 1.417 0 C-N-CA 123.427 0.691 . . . . 0.0 111.91 -177.742 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 69.1 t -64.52 -46.09 93.7 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.904 0 C-N-CA 123.994 0.918 . . . . 0.0 110.27 179.526 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 51.1 m -62.14 -42.63 99.43 Favored 'General case' 0 N--CA 1.479 0.986 0 C-N-CA 123.418 0.687 . . . . 0.0 111.259 177.497 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -62.74 -43.4 98.9 Favored 'General case' 0 N--CA 1.477 0.882 0 C-N-CA 123.585 0.754 . . . . 0.0 110.837 177.676 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 82' ' ' TYR . . . . . . . . . . . . . 17.4 t80 -52.92 -57.9 8.74 Favored 'General case' 0 N--CA 1.473 0.691 0 C-N-CA 124.754 1.221 . . . . 0.0 110.519 178.751 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 83' ' ' ASN . . . . . . . . . . . . . 52.9 m-80 -64.9 -43.9 91.33 Favored 'General case' 0 N--CA 1.481 1.092 0 N-CA-C 112.429 0.529 . . . . 0.0 112.429 -171.067 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 88.6 m-70 -70.88 -24.42 62.49 Favored 'General case' 0 N--CA 1.48 1.062 0 C-N-CA 123.687 0.795 . . . . 0.0 112.083 -178.397 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 17.3 tp -58.76 -53.45 58.19 Favored 'General case' 0 N--CA 1.485 1.279 0 CA-C-O 121.903 0.858 . . . . 0.0 110.888 175.859 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 86' ' ' PHE . . . . . 0.417 ' HA ' ' HE2' ' A' ' 91' ' ' PHE . 56.7 m-85 -72.81 -36.35 67.52 Favored 'General case' 0 C--O 1.234 0.261 0 CA-C-N 113.937 -1.483 . . . . 0.0 110.87 -178.419 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 40.2 tt0 -59.33 -48.85 80.09 Favored 'General case' 0 N--CA 1.473 0.692 0 O-C-N 124.008 0.817 . . . . 0.0 112.202 -171.835 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 19.0 p -109.99 16.32 21.98 Favored 'General case' 0 N--CA 1.475 0.808 0 C-N-CA 123.241 0.616 . . . . 0.0 111.542 -178.897 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 47.3 mmtm 57.61 37.66 27.55 Favored 'General case' 0 N--CA 1.488 1.447 0 C-N-CA 123.95 0.9 . . . . 0.0 111.98 170.743 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 52.6 mtt-85 -70.79 -8.32 51.54 Favored 'General case' 0 N--CA 1.482 1.136 0 C-N-CA 124.126 0.97 . . . . 0.0 112.78 -176.621 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 91' ' ' PHE . . . . . 0.417 ' HE2' ' HA ' ' A' ' 86' ' ' PHE . 13.9 p90 -76.98 157.19 31.39 Favored 'General case' 0 N--CA 1.469 0.491 0 C-N-CA 123.139 0.576 . . . . 0.0 111.499 173.747 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 11.7 tmtt? . . . . . 0 CA--C 1.544 0.733 0 N-CA-C 107.062 -1.458 . . . . 0.0 107.062 -179.502 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.475 0.804 0 CA-C-O 120.607 0.241 . . . . 0.0 111.572 . . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -108.98 -39.47 5.29 Favored 'General case' 0 N--CA 1.476 0.839 0 C-N-CA 123.23 0.612 . . . . 0.0 110.551 179.941 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 29' ' ' TRP . . . . . . . . . . . . . 3.6 m-90 -128.92 144.98 51.34 Favored 'General case' 0 N--CA 1.481 1.079 0 C-N-CA 123.972 0.909 . . . . 0.0 109.023 -176.495 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 20.2 p -83.53 169.6 15.27 Favored 'General case' 0 N--CA 1.474 0.77 0 C-N-CA 122.947 0.499 . . . . 0.0 109.789 -178.519 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 31' ' ' VAL . . . . . 0.584 ' HA ' HD12 ' A' ' 34' ' ' LEU . 7.4 p -56.98 -34.9 45.76 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.378 0 C-N-CA 122.887 0.475 . . . . 0.0 111.737 -173.844 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 12.9 pt-20 -67.19 -41.18 86.3 Favored 'General case' 0 N--CA 1.474 0.742 0 C-N-CA 123.814 0.846 . . . . 0.0 111.457 177.251 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 12.9 mm-40 -68.9 -35.24 76.62 Favored 'General case' 0 N--CA 1.477 0.902 0 C-N-CA 123.328 0.651 . . . . 0.0 111.266 178.792 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.584 HD12 ' HA ' ' A' ' 31' ' ' VAL . 66.3 mt -65.73 -45.64 81.88 Favored 'General case' 0 N--CA 1.472 0.643 0 O-C-N 123.618 0.573 . . . . 0.0 111.0 -179.693 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 35' ' ' ARG . . . . . 0.404 ' HG2' HG21 ' A' ' 79' ' ' VAL . 93.0 mtt-85 -79.01 -15.86 57.67 Favored 'General case' 0 CA--C 1.546 0.815 0 CA-C-N 115.419 -0.81 . . . . 0.0 111.352 179.637 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 40.0 t -63.83 138.65 58.57 Favored 'General case' 0 N--CA 1.48 1.057 0 C-N-CA 123.235 0.614 . . . . 0.0 111.414 -179.597 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 12.4 pt-20 -65.65 -18.86 65.63 Favored 'General case' 0 CA--C 1.551 1.014 0 C-N-CA 124.563 1.145 . . . . 0.0 111.97 179.989 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 76.3 mt-30 -73.42 -51.36 17.53 Favored 'General case' 0 CA--C 1.54 0.568 0 C-N-CA 124.116 0.966 . . . . 0.0 111.072 -177.984 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 46.7 tp -70.62 120.43 78.8 Favored Pre-proline 0 N--CA 1.478 0.941 0 CA-C-O 118.702 -0.666 . . . . 0.0 110.399 -176.189 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 24.6 Cg_exo -63.61 138.83 66.65 Favored 'Trans proline' 0 C--N 1.385 2.451 0 C-N-CA 122.747 2.298 . . . . 0.0 112.059 -179.19 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 21.5 ptmt -69.84 -32.36 70.72 Favored 'General case' 0 CA--C 1.537 0.444 0 C-N-CA 123.585 0.754 . . . . 0.0 110.825 -177.335 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 21.6 pttp -70.61 -28.83 65.15 Favored 'General case' 0 N--CA 1.474 0.753 0 C-N-CA 123.527 0.731 . . . . 0.0 110.915 175.994 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 28.0 t70 -69.24 -36.5 77.25 Favored 'General case' 0 N--CA 1.477 0.896 0 C-N-CA 122.543 0.337 . . . . 0.0 110.298 176.194 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 47.8 mt -66.34 -53.57 35.02 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.988 0 C-N-CA 122.878 0.471 . . . . 0.0 109.979 176.551 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 86.7 mt -55.91 -39.98 59.97 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.388 0 C-N-CA 123.959 0.903 . . . . 0.0 111.162 179.746 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 40.1 ttmt -57.49 -45.53 84.78 Favored 'General case' 0 N--CA 1.473 0.694 0 C-N-CA 123.703 0.801 . . . . 0.0 110.891 178.591 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 11.8 t80 -63.73 -48.29 77.63 Favored 'General case' 0 N--CA 1.471 0.606 0 O-C-N 123.897 0.748 . . . . 0.0 110.357 177.843 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 85.3 mt -68.86 -31.19 69.96 Favored 'General case' 0 CA--C 1.544 0.746 0 C-N-CA 123.201 0.6 . . . . 0.0 112.314 -172.742 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 49' ' ' GLN . . . . . 0.413 ' HA ' HD21 ' A' ' 57' ' ' LEU . 3.2 pt20 -84.61 -36.36 22.07 Favored 'General case' 0 N--CA 1.484 1.25 0 N-CA-C 111.674 0.25 . . . . 0.0 111.674 179.79 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 12.6 tp10 -69.14 -39.17 78.99 Favored 'General case' 0 N--CA 1.481 1.125 0 CA-C-O 121.587 0.708 . . . . 0.0 110.252 179.781 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 3.0 t60 -93.43 -49.85 5.72 Favored 'General case' 0 N--CA 1.47 0.548 0 CA-C-N 114.63 -1.168 . . . . 0.0 110.467 -173.349 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 52' ' ' GLY . . . . . 0.473 ' HA2' ' HA ' ' A' ' 91' ' ' PHE . . . -65.0 144.9 48.76 Favored Glycine 0 C--N 1.349 1.262 0 O-C-N 123.527 0.517 . . . . 0.0 113.185 173.253 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 34.5 t -89.67 166.45 13.59 Favored 'General case' 0 CA--C 1.55 0.971 0 C-N-CA 123.744 0.817 . . . . 0.0 110.669 -178.494 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 48.7 m-20 -58.0 -36.16 72.26 Favored 'General case' 0 N--CA 1.494 1.757 0 C-N-CA 123.912 0.885 . . . . 0.0 112.978 -169.175 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 40.2 t -64.0 -31.59 72.83 Favored 'General case' 0 N--CA 1.476 0.847 0 C-N-CA 123.605 0.762 . . . . 0.0 111.493 -178.299 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 85.4 t80 -76.21 -45.7 31.85 Favored 'General case' 0 CA--C 1.546 0.825 0 C-N-CA 123.497 0.719 . . . . 0.0 110.282 171.285 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 57' ' ' LEU . . . . . 0.413 HD21 ' HA ' ' A' ' 49' ' ' GLN . 45.7 mt -65.03 -33.44 76.04 Favored 'General case' 0 N--CA 1.478 0.935 0 CA-C-N 115.175 -0.921 . . . . 0.0 112.845 -169.701 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -68.4 -48.53 64.46 Favored 'General case' 0 N--CA 1.475 0.784 0 C-N-CA 122.62 0.368 . . . . 0.0 110.475 178.739 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 10.0 mm-40 -62.31 -33.5 74.8 Favored 'General case' 0 N--CA 1.476 0.87 0 CA-C-N 115.771 -0.649 . . . . 0.0 111.045 -178.484 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 34.5 m-70 -105.99 4.33 29.29 Favored 'General case' 0 N--CA 1.479 0.99 0 C-N-CA 123.223 0.609 . . . . 0.0 112.297 -178.214 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 46.0 mmtm 56.14 28.2 12.67 Favored 'General case' 0 N--CA 1.498 1.933 0 C-N-CA 124.377 1.071 . . . . 0.0 113.164 174.855 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 62' ' ' LEU . . . . . 0.487 HD11 ' HB1' ' A' ' 81' ' ' ALA . 92.2 mt -88.43 -8.85 54.3 Favored 'General case' 0 N--CA 1.481 1.094 0 C-N-CA 123.609 0.763 . . . . 0.0 112.061 -178.214 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 1.4 pp -67.48 167.34 12.94 Favored 'General case' 0 N--CA 1.477 0.913 0 C-N-CA 122.92 0.488 . . . . 0.0 111.44 177.727 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 77.01 -154.81 43.62 Favored Glycine 0 C--N 1.338 0.674 0 CA-C-N 115.653 -0.703 . . . . 0.0 113.623 174.695 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 65' ' ' ASN . . . . . 0.414 ' O ' HG23 ' A' ' 69' ' ' VAL . 15.9 m120 -64.57 124.66 22.44 Favored 'General case' 0 N--CA 1.472 0.658 0 C-N-CA 123.698 0.799 . . . . 0.0 110.609 -176.952 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 49.7 mt -58.03 -45.83 88.1 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.974 0 C-N-CA 124.127 0.971 . . . . 0.0 110.546 -179.327 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 17.7 mtpp -51.46 -46.02 62.94 Favored 'General case' 0 N--CA 1.482 1.175 0 C-N-CA 124.642 1.177 . . . . 0.0 111.714 174.714 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 68' ' ' ASN . . . . . 0.447 ' O ' ' HG2' ' A' ' 71' ' ' LYS . 7.8 t30 -64.57 -40.77 96.16 Favored 'General case' 0 N--CA 1.478 0.943 0 C-N-CA 123.484 0.714 . . . . 0.0 111.02 -179.169 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 69' ' ' VAL . . . . . 0.414 HG23 ' O ' ' A' ' 65' ' ' ASN . 18.4 t -71.4 -32.14 45.59 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.094 0 CA-C-O 121.018 0.437 . . . . 0.0 110.038 178.074 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -76.55 -16.33 59.64 Favored 'General case' 0 N--CA 1.485 1.288 0 C-N-CA 123.635 0.774 . . . . 0.0 112.229 -177.122 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 71' ' ' LYS . . . . . 0.447 ' HG2' ' O ' ' A' ' 68' ' ' ASN . 20.0 ptmt -94.76 -17.35 22.25 Favored 'General case' 0 N--CA 1.479 1.003 0 C-N-CA 122.367 0.267 . . . . 0.0 111.521 178.925 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 13.1 t -114.29 -35.32 5.02 Favored 'General case' 0 N--CA 1.479 1.006 0 C-N-CA 122.89 0.476 . . . . 0.0 111.777 -172.087 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -99.59 119.66 38.42 Favored 'General case' 0 N--CA 1.47 0.544 0 C-N-CA 124.048 0.939 . . . . 0.0 109.702 -176.082 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 74' ' ' ASN . . . . . 0.401 ' O ' ' HG ' ' A' ' 78' ' ' LEU . 27.8 p-10 -74.67 169.7 17.29 Favored 'General case' 0 N--CA 1.481 1.096 0 C-N-CA 123.563 0.745 . . . . 0.0 111.226 -177.171 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 15.0 tptm -60.23 -39.05 85.29 Favored 'General case' 0 N--CA 1.481 1.081 0 C-N-CA 124.029 0.932 . . . . 0.0 110.929 -174.122 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 29.7 t70 -64.4 -38.46 91.11 Favored 'General case' 0 N--CA 1.475 0.793 0 C-N-CA 124.125 0.97 . . . . 0.0 111.338 -179.099 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 31.1 t60 -59.8 -37.43 79.11 Favored 'General case' 0 N--CA 1.481 1.084 0 C-N-CA 124.213 1.005 . . . . 0.0 110.446 176.492 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 78' ' ' LEU . . . . . 0.401 ' HG ' ' O ' ' A' ' 74' ' ' ASN . 27.2 mt -72.72 -35.36 67.56 Favored 'General case' 0 N--CA 1.478 0.931 0 CA-C-N 115.78 -0.645 . . . . 0.0 111.278 -174.954 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 79' ' ' VAL . . . . . 0.404 HG21 ' HG2' ' A' ' 35' ' ' ARG . 21.5 t -69.86 -40.72 79.23 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.69 0 C-N-CA 123.306 0.642 . . . . 0.0 109.712 175.11 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 43.3 m -57.73 -45.1 86.26 Favored 'General case' 0 N--CA 1.478 0.928 0 C-N-CA 123.783 0.833 . . . . 0.0 110.489 175.118 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 81' ' ' ALA . . . . . 0.487 ' HB1' HD11 ' A' ' 62' ' ' LEU . . . -66.48 -43.53 85.18 Favored 'General case' 0 CA--C 1.534 0.335 0 CA-C-N 115.719 -0.673 . . . . 0.0 110.927 -179.592 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 82' ' ' TYR . . . . . 0.438 ' CD2' ' HE2' ' A' ' 86' ' ' PHE . 18.4 t80 -53.67 -56.39 17.69 Favored 'General case' 0 CA--C 1.543 0.676 0 C-N-CA 124.079 0.952 . . . . 0.0 110.409 176.816 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 83' ' ' ASN . . . . . . . . . . . . . 3.4 m-20 -55.68 -51.24 67.94 Favored 'General case' 0 N--CA 1.489 1.493 0 C-N-CA 123.46 0.704 . . . . 0.0 111.081 -175.824 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 72.4 m80 -70.43 -22.83 62.67 Favored 'General case' 0 CA--C 1.543 0.707 0 C-N-CA 124.553 1.141 . . . . 0.0 112.567 -175.771 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 42.4 tp -63.19 -55.32 26.08 Favored 'General case' 0 N--CA 1.483 1.212 0 CA-C-O 121.603 0.716 . . . . 0.0 110.986 177.96 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 86' ' ' PHE . . . . . 0.49 ' HA ' ' HE1' ' A' ' 91' ' ' PHE . 37.2 m-85 -75.86 -28.78 58.31 Favored 'General case' 0 N--CA 1.474 0.735 0 CA-C-N 114.101 -1.409 . . . . 0.0 111.83 -175.744 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 11.6 tp10 -68.61 -18.49 64.32 Favored 'General case' 0 N--CA 1.479 1.017 0 C-N-CA 123.12 0.568 . . . . 0.0 112.063 -176.343 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 18.1 p -129.04 -1.42 5.21 Favored 'General case' 0 N--CA 1.479 0.985 0 C-N-CA 123.761 0.824 . . . . 0.0 111.811 -179.722 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 73.1 mmtt 59.57 38.78 22.1 Favored 'General case' 0 N--CA 1.487 1.397 0 C-N-CA 124.558 1.143 . . . . 0.0 111.71 177.301 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 62.2 mtt180 -73.23 -11.04 60.37 Favored 'General case' 0 N--CA 1.49 1.556 0 C-N-CA 123.625 0.77 . . . . 0.0 112.765 -178.232 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 91' ' ' PHE . . . . . 0.49 ' HE1' ' HA ' ' A' ' 86' ' ' PHE . 50.3 p90 -81.88 156.24 24.91 Favored 'General case' 0 C--O 1.242 0.666 0 C-N-CA 123.244 0.618 . . . . 0.0 110.946 171.872 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 33.2 ttpt . . . . . 0 C--O 1.253 1.272 0 N-CA-C 107.425 -1.324 . . . . 0.0 107.425 170.671 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 CA--C 1.539 0.529 0 CA-C-O 120.904 0.383 . . . . 0.0 110.734 . . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -78.82 -31.96 46.02 Favored 'General case' 0 N--CA 1.467 0.412 0 CA-C-N 115.452 -0.795 . . . . 0.0 109.643 176.243 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 29' ' ' TRP . . . . . . . . . . . . . 3.4 m-90 -129.25 142.67 50.78 Favored 'General case' 0 N--CA 1.463 0.192 0 C-N-CA 124.439 1.096 . . . . 0.0 109.043 -175.456 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 42.7 p -82.03 174.75 10.95 Favored 'General case' 0 N--CA 1.473 0.691 0 C-N-CA 123.085 0.554 . . . . 0.0 109.597 173.648 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 7.5 p -58.62 -39.01 74.61 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.328 0 C-N-CA 122.732 0.413 . . . . 0.0 111.423 -176.799 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 11.4 pt-20 -69.32 -39.43 78.21 Favored 'General case' 0 N--CA 1.48 1.074 0 C-N-CA 123.58 0.752 . . . . 0.0 111.53 178.311 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 52.9 mt-30 -63.56 -36.76 84.85 Favored 'General case' 0 N--CA 1.481 1.083 0 C-N-CA 122.888 0.475 . . . . 0.0 110.807 177.963 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 89.7 mt -60.94 -51.48 69.09 Favored 'General case' 0 N--CA 1.48 1.045 0 O-C-N 123.473 0.483 . . . . 0.0 109.866 176.878 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 43.7 mtm105 -65.36 -18.87 65.66 Favored 'General case' 0 C--N 1.353 0.74 0 CA-C-N 114.43 -1.259 . . . . 0.0 111.865 -175.718 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 44.8 t -56.47 123.91 16.38 Favored 'General case' 0 C--N 1.354 0.789 0 N-CA-C 109.649 -0.5 . . . . 0.0 109.649 173.316 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 28.9 mt-10 -57.98 -37.1 73.58 Favored 'General case' 0 N--CA 1.474 0.749 0 C-N-CA 124.452 1.101 . . . . 0.0 111.278 -177.854 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 74.7 mt-30 -64.25 -30.21 71.27 Favored 'General case' 0 N--CA 1.475 0.794 0 C-N-CA 123.79 0.836 . . . . 0.0 111.484 -178.14 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 4.1 tt -81.05 113.0 37.39 Favored Pre-proline 0 CA--C 1.549 0.935 0 N-CA-C 107.553 -1.277 . . . . 0.0 107.553 172.692 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 40' ' ' PRO . . . . . 0.546 ' HB2' ' HG2' ' A' ' 42' ' ' LYS . 11.3 Cg_exo -70.55 147.34 57.59 Favored 'Trans proline' 0 C--N 1.371 1.717 0 C-N-CA 122.906 2.404 . . . . 0.0 112.81 -179.222 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 52.4 mtmt -56.83 -29.11 62.49 Favored 'General case' 0 N--CA 1.478 0.951 0 C-N-CA 124.602 1.161 . . . . 0.0 112.23 177.026 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 42' ' ' LYS . . . . . 0.546 ' HG2' ' HB2' ' A' ' 40' ' ' PRO . 17.4 ptpt -66.3 -36.91 84.16 Favored 'General case' 0 N--CA 1.47 0.533 0 C-N-CA 123.342 0.657 . . . . 0.0 111.71 -179.754 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 43' ' ' ASP . . . . . 0.474 ' HA ' ' HE2' ' A' ' 46' ' ' LYS . 2.3 m-20 -67.16 -35.36 79.52 Favored 'General case' 0 N--CA 1.479 1.009 0 O-C-N 123.293 0.37 . . . . 0.0 111.229 178.948 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 44' ' ' ILE . . . . . 0.4 ' O ' ' HG ' ' A' ' 48' ' ' LEU . 37.6 mt -65.65 -54.12 31.43 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.748 0 O-C-N 123.708 0.63 . . . . 0.0 109.635 177.949 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 68.0 mt -58.02 -39.52 72.62 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.253 0 C-N-CA 123.489 0.716 . . . . 0.0 111.096 177.945 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 46' ' ' LYS . . . . . 0.474 ' HE2' ' HA ' ' A' ' 43' ' ' ASP . 36.5 ttpt -59.92 -43.24 95.0 Favored 'General case' 0 N--CA 1.478 0.956 0 C-N-CA 124.086 0.955 . . . . 0.0 110.88 179.301 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 22.5 t80 -64.4 -47.13 80.36 Favored 'General case' 0 CA--C 1.548 0.889 0 CA-C-N 114.962 -1.017 . . . . 0.0 110.947 176.874 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 48' ' ' LEU . . . . . 0.4 ' HG ' ' O ' ' A' ' 44' ' ' ILE . 87.3 mt -70.82 -30.53 66.99 Favored 'General case' 0 N--CA 1.472 0.665 0 CA-C-N 115.326 -0.852 . . . . 0.0 111.741 -174.723 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 49' ' ' GLN . . . . . 0.507 ' HA ' HD21 ' A' ' 57' ' ' LEU . 3.4 pt20 -84.15 -27.5 28.08 Favored 'General case' 0 N--CA 1.482 1.13 0 C-N-CA 122.639 0.375 . . . . 0.0 110.909 177.748 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 14.4 tp10 -56.72 -37.26 70.71 Favored 'General case' 0 N--CA 1.475 0.816 0 C-N-CA 124.167 0.987 . . . . 0.0 111.505 179.699 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 31.9 m80 -129.99 -21.59 2.98 Favored 'General case' 0 N--CA 1.476 0.83 0 N-CA-C 113.032 0.753 . . . . 0.0 113.032 -177.46 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -60.18 136.34 49.73 Favored Glycine 0 N--CA 1.474 1.204 0 CA-C-N 118.694 0.679 . . . . 0.0 112.818 176.27 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 53' ' ' SER . . . . . 0.425 ' O ' ' HG ' ' A' ' 57' ' ' LEU . 39.7 t -64.08 158.71 22.03 Favored 'General case' 0 N--CA 1.481 1.089 0 C-N-CA 123.618 0.767 . . . . 0.0 110.752 179.133 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 7.2 p-10 -66.14 -29.58 69.9 Favored 'General case' 0 N--CA 1.483 1.181 0 C-N-CA 123.37 0.668 . . . . 0.0 111.396 -171.853 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 42.1 t -71.85 -38.43 70.09 Favored 'General case' 0 N--CA 1.473 0.694 0 C-N-CA 123.555 0.742 . . . . 0.0 110.722 175.397 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 57.4 t80 -63.44 -44.35 94.79 Favored 'General case' 0 N--CA 1.479 0.995 0 N-CA-C 109.14 -0.689 . . . . 0.0 109.14 174.771 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 57' ' ' LEU . . . . . 0.507 HD21 ' HA ' ' A' ' 49' ' ' GLN . 62.0 mt -68.05 -31.65 71.45 Favored 'General case' 0 C--O 1.222 -0.345 0 CA-C-N 115.243 -0.889 . . . . 0.0 111.081 -178.599 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -71.19 -50.06 37.16 Favored 'General case' 0 N--CA 1.472 0.65 0 C-N-CA 123.001 0.52 . . . . 0.0 111.212 177.632 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 27.1 mm-40 -73.79 -16.41 61.16 Favored 'General case' 0 N--CA 1.477 0.912 0 N-CA-C 112.335 0.495 . . . . 0.0 112.335 -176.851 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 44.6 m-70 -114.19 1.18 14.46 Favored 'General case' 0 N--CA 1.489 1.48 0 C-N-CA 123.176 0.59 . . . . 0.0 111.74 176.8 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 74.6 mmtt 58.09 30.51 19.4 Favored 'General case' 0 N--CA 1.493 1.708 0 C-N-CA 124.613 1.165 . . . . 0.0 113.103 174.499 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 62' ' ' LEU . . . . . 0.444 HD11 ' HB1' ' A' ' 81' ' ' ALA . 65.6 mt -90.41 -6.96 54.32 Favored 'General case' 0 N--CA 1.487 1.394 0 C-N-CA 123.755 0.822 . . . . 0.0 111.988 -176.415 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -74.57 173.73 10.0 Favored 'General case' 0 N--CA 1.477 0.923 0 C-N-CA 123.06 0.544 . . . . 0.0 111.699 177.196 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 82.6 -165.84 44.75 Favored Glycine 0 C--O 1.246 0.868 0 CA-C-N 115.353 -0.839 . . . . 0.0 112.919 178.278 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 45.5 t-20 -68.2 125.09 25.28 Favored 'General case' 0 C--O 1.241 0.646 0 N-CA-C 109.014 -0.735 . . . . 0.0 109.014 176.884 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 66' ' ' ILE . . . . . 0.437 HD13 ' HB2' ' A' ' 46' ' ' LYS . 32.5 mt -58.5 -53.22 49.71 Favored 'Isoleucine or valine' 0 C--O 1.214 -0.811 0 O-C-N 124.317 1.01 . . . . 0.0 111.707 -169.885 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 22.9 pttp -59.41 -34.92 73.06 Favored 'General case' 0 N--CA 1.489 1.489 0 C-N-CA 123.886 0.875 . . . . 0.0 112.99 -172.051 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 47.9 t30 -65.4 -45.29 84.55 Favored 'General case' 0 N--CA 1.473 0.692 0 C-N-CA 123.452 0.701 . . . . 0.0 110.115 178.86 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 97.3 t -70.61 -43.44 77.63 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.787 0 CA-C-N 115.162 -0.926 . . . . 0.0 110.91 178.167 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -59.22 -50.56 73.54 Favored 'General case' 0 N--CA 1.479 1.009 0 C-N-CA 124.875 1.27 . . . . 0.0 112.603 -167.121 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 19.4 ptpt -55.53 -45.41 77.19 Favored 'General case' 0 CA--C 1.558 1.26 0 O-C-N 123.863 0.727 . . . . 0.0 112.063 -179.545 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 13.3 t -93.0 -9.72 38.83 Favored 'General case' 0 N--CA 1.479 1.01 0 C-N-CA 123.662 0.785 . . . . 0.0 111.874 -173.981 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -93.41 118.03 30.81 Favored 'General case' 0 N--CA 1.472 0.662 0 N-CA-C 108.62 -0.881 . . . . 0.0 108.62 173.306 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 29.2 p-10 -73.98 148.54 42.0 Favored 'General case' 0 C--O 1.239 0.535 0 N-CA-C 109.78 -0.452 . . . . 0.0 109.78 176.9 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 39.2 ttmt -63.94 -26.71 68.71 Favored 'General case' 0 CA--C 1.541 0.602 0 C-N-CA 123.559 0.744 . . . . 0.0 111.124 -174.435 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 28.3 t70 -59.74 -40.66 88.83 Favored 'General case' 0 CA--C 1.544 0.739 0 C-N-CA 124.272 1.029 . . . . 0.0 111.28 177.758 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 75.0 t60 -66.37 -39.34 89.05 Favored 'General case' 0 N--CA 1.474 0.77 0 C-N-CA 123.955 0.902 . . . . 0.0 110.086 175.66 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 29.7 mt -69.87 -36.46 75.5 Favored 'General case' 0 N--CA 1.481 1.1 0 C-N-CA 123.348 0.659 . . . . 0.0 112.009 -174.693 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 77.2 t -67.83 -42.83 86.3 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.668 0 C-N-CA 123.849 0.859 . . . . 0.0 109.659 177.295 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 51.5 m -61.09 -40.38 93.5 Favored 'General case' 0 CA--C 1.549 0.91 0 C-N-CA 122.882 0.473 . . . . 0.0 110.725 175.046 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 81' ' ' ALA . . . . . 0.444 ' HB1' HD11 ' A' ' 62' ' ' LEU . . . -65.82 -40.64 92.01 Favored 'General case' 0 N--CA 1.474 0.745 0 C-N-CA 123.497 0.719 . . . . 0.0 111.011 177.414 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 82' ' ' TYR . . . . . . . . . . . . . 13.9 t80 -58.59 -55.34 36.32 Favored 'General case' 0 CA--C 1.541 0.629 0 CA-C-N 114.532 -1.213 . . . . 0.0 110.989 179.206 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 83' ' ' ASN . . . . . . . . . . . . . 67.3 m-80 -64.7 -44.08 91.41 Favored 'General case' 0 N--CA 1.483 1.176 0 C-N-CA 122.454 0.302 . . . . 0.0 111.161 -174.129 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 25.2 m-70 -64.3 -26.63 68.57 Favored 'General case' 0 N--CA 1.485 1.315 0 C-N-CA 123.708 0.803 . . . . 0.0 111.845 179.155 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 85' ' ' LEU . . . . . 0.491 HD12 ' HB2' ' A' ' 90' ' ' ARG . 53.6 tp -58.34 -52.95 63.43 Favored 'General case' 0 N--CA 1.482 1.13 0 CA-C-O 121.219 0.533 . . . . 0.0 111.163 177.327 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 45.3 m-85 -75.61 -35.68 60.47 Favored 'General case' 0 N--CA 1.475 0.807 0 CA-C-N 115.041 -0.981 . . . . 0.0 111.65 -178.65 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 17.4 tp10 -60.29 -47.05 87.65 Favored 'General case' 0 N--CA 1.473 0.68 0 C-N-CA 124.162 0.985 . . . . 0.0 111.613 -172.516 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 7.6 p -117.04 11.84 14.38 Favored 'General case' 0 CA--C 1.548 0.87 0 C-N-CA 123.999 0.919 . . . . 0.0 111.236 -179.583 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 27.2 mtpp 55.14 56.8 6.11 Favored 'General case' 0 N--CA 1.486 1.336 0 C-N-CA 125.241 1.416 . . . . 0.0 112.251 168.604 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 90' ' ' ARG . . . . . 0.491 ' HB2' HD12 ' A' ' 85' ' ' LEU . 11.7 mmm180 -73.26 -16.81 61.38 Favored 'General case' 0 N--CA 1.484 1.266 0 CA-C-N 115.163 -0.926 . . . . 0.0 111.864 -176.971 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 91' ' ' PHE . . . . . . . . . . . . . 3.4 p90 -69.08 144.26 53.99 Favored 'General case' 0 CA--C 1.544 0.747 0 CA-C-O 121.631 0.729 . . . . 0.0 111.865 -179.533 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 6.7 mtpm? . . . . . 0 C--O 1.247 0.941 0 C-N-CA 125.379 1.472 . . . . 0.0 108.78 170.675 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.544 0.737 0 CA-C-O 120.867 0.365 . . . . 0.0 110.515 . . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -85.72 -38.86 17.82 Favored 'General case' 0 N--CA 1.472 0.638 0 CA-C-N 115.841 -0.618 . . . . 0.0 109.372 179.127 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 29' ' ' TRP . . . . . . . . . . . . . 5.1 m-90 -137.34 154.54 50.02 Favored 'General case' 0 N--CA 1.476 0.828 0 C-N-CA 124.669 1.188 . . . . 0.0 108.636 178.649 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 77.2 p -85.82 173.16 10.22 Favored 'General case' 0 N--CA 1.477 0.901 0 N-CA-C 109.683 -0.488 . . . . 0.0 109.683 174.266 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 8.0 p -56.96 -40.8 74.8 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.139 0 C-N-CA 123.762 0.825 . . . . 0.0 111.766 -177.396 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 10.2 pt-20 -71.43 -37.51 71.43 Favored 'General case' 0 N--CA 1.476 0.835 0 C-N-CA 123.782 0.833 . . . . 0.0 111.563 179.377 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 50.9 mt-30 -66.33 -36.06 81.95 Favored 'General case' 0 N--CA 1.474 0.736 0 C-N-CA 123.023 0.529 . . . . 0.0 110.99 175.915 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.459 ' HB3' HG22 ' A' ' 79' ' ' VAL . 84.2 mt -65.05 -50.06 67.69 Favored 'General case' 0 N--CA 1.475 0.812 0 C-N-CA 123.21 0.604 . . . . 0.0 110.941 -179.788 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 35' ' ' ARG . . . . . 0.585 ' HA ' ' HD3' ' A' ' 75' ' ' LYS . 17.8 ptm180 -73.87 -14.89 61.15 Favored 'General case' 0 N--CA 1.477 0.923 0 CA-C-N 115.699 -0.682 . . . . 0.0 111.707 -178.325 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 47.7 t -56.56 129.46 40.96 Favored 'General case' 0 N--CA 1.478 0.944 0 C-N-CA 123.389 0.676 . . . . 0.0 111.043 179.242 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 33.5 mt-10 -67.67 -18.83 65.07 Favored 'General case' 0 N--CA 1.479 1.012 0 C-N-CA 124.353 1.061 . . . . 0.0 111.883 -177.659 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 13.7 mm100 -70.8 -28.29 64.54 Favored 'General case' 0 CA--C 1.542 0.645 0 C-N-CA 123.52 0.728 . . . . 0.0 111.309 175.406 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 4.6 tt -91.99 127.24 50.35 Favored Pre-proline 0 CA--C 1.561 1.38 0 N-CA-C 108.229 -1.026 . . . . 0.0 108.229 178.5 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 24.5 Cg_exo -68.8 -149.06 0.02 OUTLIER 'Trans proline' 0 C--N 1.378 2.117 0 C-N-CA 123.571 2.847 . . . . 0.0 113.524 171.512 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -122.83 -30.65 3.8 Favored 'General case' 0 N--CA 1.482 1.134 0 C-N-CA 123.526 0.731 . . . . 0.0 111.169 177.559 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 42' ' ' LYS . . . . . 0.526 ' HA ' HD12 ' A' ' 45' ' ' ILE . 19.3 pttp -61.03 -39.27 89.15 Favored 'General case' 0 N--CA 1.486 1.335 0 C-N-CA 123.899 0.88 . . . . 0.0 112.776 -171.799 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 15.4 p-10 -69.7 -32.75 71.52 Favored 'General case' 0 CA--C 1.544 0.735 0 C-N-CA 122.697 0.399 . . . . 0.0 111.372 176.678 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 42.3 mt -67.18 -44.1 88.02 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.357 0 C-N-CA 122.315 0.246 . . . . 0.0 110.343 176.378 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 45' ' ' ILE . . . . . 0.526 HD12 ' HA ' ' A' ' 42' ' ' LYS . 67.3 mt -55.33 -44.27 74.74 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.325 0 C-N-CA 123.506 0.722 . . . . 0.0 110.011 175.21 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 46' ' ' LYS . . . . . 0.429 ' O ' ' HB2' ' A' ' 50' ' ' GLU . 55.0 tttp -58.37 -44.63 88.94 Favored 'General case' 0 CA--C 1.542 0.67 0 O-C-N 124.213 0.946 . . . . 0.0 110.845 178.414 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 23.7 t80 -59.63 -49.47 77.63 Favored 'General case' 0 N--CA 1.483 1.218 0 O-C-N 123.773 0.671 . . . . 0.0 111.219 177.318 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 97.7 mt -70.0 -31.8 69.67 Favored 'General case' 0 CA--C 1.544 0.731 0 C-N-CA 123.579 0.752 . . . . 0.0 112.115 -174.472 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 49' ' ' GLN . . . . . 0.418 ' HA ' HD21 ' A' ' 57' ' ' LEU . 3.4 pt20 -84.23 -31.1 25.2 Favored 'General case' 0 N--CA 1.488 1.458 0 CA-C-N 117.711 0.232 . . . . 0.0 111.556 179.004 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 50' ' ' GLU . . . . . 0.429 ' HB2' ' O ' ' A' ' 46' ' ' LYS . 7.1 tp10 -63.9 -27.41 69.13 Favored 'General case' 0 N--CA 1.486 1.363 0 C-N-CA 124.168 0.987 . . . . 0.0 111.539 -175.576 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 52.0 m80 -120.95 -33.02 3.83 Favored 'General case' 0 N--CA 1.469 0.519 0 CA-C-N 115.072 -0.967 . . . . 0.0 111.422 -173.624 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -75.97 156.5 47.55 Favored Glycine 0 C--N 1.352 1.418 0 O-C-N 123.314 0.384 . . . . 0.0 113.597 -174.746 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 20.7 t -87.79 172.06 9.93 Favored 'General case' 0 N--CA 1.476 0.841 0 C-N-CA 123.583 0.753 . . . . 0.0 110.898 177.715 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 14.9 m-20 -60.27 -42.19 94.86 Favored 'General case' 0 N--CA 1.479 0.993 0 C-N-CA 124.436 1.094 . . . . 0.0 112.811 -171.206 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 32.9 t -70.42 -27.92 64.65 Favored 'General case' 0 N--CA 1.477 0.911 0 C-N-CA 123.299 0.64 . . . . 0.0 111.25 -176.545 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 56' ' ' PHE . . . . . 0.475 ' HD1' HH11 ' A' ' 90' ' ' ARG . 32.3 t80 -67.73 -46.22 72.79 Favored 'General case' 0 N--CA 1.482 1.155 0 CA-C-O 121.443 0.64 . . . . 0.0 110.085 174.149 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 57' ' ' LEU . . . . . 0.418 HD21 ' HA ' ' A' ' 49' ' ' GLN . 66.0 mt -69.97 -44.87 68.57 Favored 'General case' 0 CA--C 1.538 0.492 0 CA-C-N 114.81 -1.086 . . . . 0.0 110.577 -175.854 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -54.65 -24.44 21.62 Favored 'General case' 0 N--CA 1.484 1.26 0 C-N-CA 125.674 1.59 . . . . 0.0 113.399 -176.815 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 53.8 mt-10 -54.37 -51.35 65.08 Favored 'General case' 0 N--CA 1.482 1.144 0 C-N-CA 123.512 0.725 . . . . 0.0 111.354 -179.459 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 15.9 t60 -119.03 13.79 13.05 Favored 'General case' 0 N--CA 1.487 1.384 0 C-N-CA 122.697 0.399 . . . . 0.0 111.241 175.778 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 61.7 mttp 56.82 65.29 1.43 Allowed 'General case' 0 N--CA 1.478 0.931 0 C-N-CA 124.417 1.087 . . . . 0.0 111.175 -176.184 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 62' ' ' LEU . . . . . 0.55 ' HA ' HG11 ' A' ' 69' ' ' VAL . 77.9 mt -86.24 -9.5 56.38 Favored 'General case' 0 N--CA 1.477 0.921 0 C-N-CA 123.972 0.909 . . . . 0.0 110.042 176.767 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 1.5 pp -80.43 156.06 26.8 Favored 'General case' 0 CA--C 1.545 0.783 0 C-N-CA 124.303 1.041 . . . . 0.0 110.781 177.201 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 90.03 -149.69 20.51 Favored Glycine 0 C--N 1.34 0.79 0 CA-C-N 115.696 -0.684 . . . . 0.0 112.732 178.327 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 65' ' ' ASN . . . . . 0.451 ' O ' HG23 ' A' ' 69' ' ' VAL . 82.3 m-20 -65.05 113.45 3.92 Favored 'General case' 0 N--CA 1.48 1.025 0 C-N-CA 123.927 0.891 . . . . 0.0 110.427 -177.001 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 70.4 mt -59.44 -42.92 89.24 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.125 0 C-N-CA 123.928 0.891 . . . . 0.0 110.605 -176.591 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 17.9 mtpp -55.61 -47.62 76.24 Favored 'General case' 0 CA--C 1.545 0.757 0 C-N-CA 124.063 0.945 . . . . 0.0 111.208 177.643 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 68' ' ' ASN . . . . . 0.52 ' O ' ' HG2' ' A' ' 71' ' ' LYS . 7.0 t30 -61.8 -42.83 99.5 Favored 'General case' 0 N--CA 1.479 0.984 0 C-N-CA 123.599 0.759 . . . . 0.0 111.336 176.068 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 69' ' ' VAL . . . . . 0.55 HG11 ' HA ' ' A' ' 62' ' ' LEU . 87.9 t -68.93 -30.13 45.76 Favored 'Isoleucine or valine' 0 CA--C 1.554 1.109 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.856 -178.988 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -65.82 -8.12 19.91 Favored 'General case' 0 N--CA 1.492 1.652 0 N-CA-C 114.363 1.246 . . . . 0.0 114.363 -173.929 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 71' ' ' LYS . . . . . 0.52 ' HG2' ' O ' ' A' ' 68' ' ' ASN . 64.7 pttt -91.54 -24.47 19.61 Favored 'General case' 0 N--CA 1.483 1.198 0 C-N-CA 122.88 0.472 . . . . 0.0 111.328 178.593 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 6.9 t -111.9 -27.94 8.25 Favored 'General case' 0 N--CA 1.474 0.772 0 C-N-CA 123.584 0.754 . . . . 0.0 110.996 -176.465 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 73' ' ' ALA . . . . . 0.467 ' HB1' HD21 ' A' ' 78' ' ' LEU . . . -73.39 85.28 1.48 Allowed 'General case' 0 C--O 1.243 0.756 0 N-CA-C 108.586 -0.894 . . . . 0.0 108.586 178.435 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 7.6 p30 -73.92 142.93 45.93 Favored 'General case' 0 C--O 1.239 0.529 0 CA-C-N 113.559 -1.655 . . . . 0.0 109.023 179.347 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 75' ' ' LYS . . . . . 0.585 ' HD3' ' HA ' ' A' ' 35' ' ' ARG . 40.4 ttmt -60.49 -34.16 73.65 Favored 'General case' 0 CA--C 1.538 0.492 0 C-N-CA 124.383 1.073 . . . . 0.0 111.419 -174.294 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 27.8 t70 -58.04 -39.91 79.58 Favored 'General case' 0 N--CA 1.472 0.671 0 C-N-CA 123.626 0.77 . . . . 0.0 111.175 177.922 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 73.6 t60 -71.21 -42.42 68.97 Favored 'General case' 0 C--O 1.213 -0.856 0 C-N-CA 123.633 0.773 . . . . 0.0 110.253 176.186 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 78' ' ' LEU . . . . . 0.467 HD21 ' HB1' ' A' ' 73' ' ' ALA . 98.2 mt -67.36 -31.21 71.3 Favored 'General case' 0 N--CA 1.483 1.187 0 N-CA-C 113.051 0.76 . . . . 0.0 113.051 -170.893 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 79' ' ' VAL . . . . . 0.459 HG22 ' HB3' ' A' ' 34' ' ' LEU . 60.0 t -71.58 -46.55 62.41 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.782 0 C-N-CA 123.407 0.683 . . . . 0.0 109.66 174.335 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 34.9 m -63.73 -32.38 73.86 Favored 'General case' 0 N--CA 1.477 0.877 0 CA-C-N 115.431 -0.804 . . . . 0.0 110.921 176.775 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -74.96 -37.52 61.93 Favored 'General case' 0 N--CA 1.473 0.713 0 C-N-CA 124.183 0.993 . . . . 0.0 110.358 179.639 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 82' ' ' TYR . . . . . . . . . . . . . 35.7 t80 -55.25 -55.22 33.87 Favored 'General case' 0 N--CA 1.472 0.673 0 C-N-CA 124.428 1.091 . . . . 0.0 109.954 173.676 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 83' ' ' ASN . . . . . . . . . . . . . 68.5 m-80 -64.59 -41.68 96.09 Favored 'General case' 0 N--CA 1.482 1.133 0 C-N-CA 122.639 0.376 . . . . 0.0 110.842 -178.396 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 16.6 t-160 -67.47 -27.45 67.03 Favored 'General case' 0 N--CA 1.485 1.28 0 C-N-CA 124.037 0.935 . . . . 0.0 110.787 -178.684 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -59.72 -53.05 62.53 Favored 'General case' 0 N--CA 1.48 1.075 0 C-N-CA 124.182 0.993 . . . . 0.0 109.822 -179.448 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 32.2 m-85 -74.08 -28.28 61.31 Favored 'General case' 0 CA--C 1.547 0.849 0 CA-C-N 114.22 -1.354 . . . . 0.0 111.462 -179.963 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 9.4 tm-20 -73.19 -26.76 61.29 Favored 'General case' 0 N--CA 1.48 1.058 0 C-N-CA 124.149 0.979 . . . . 0.0 111.498 -174.345 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 23.0 p -116.79 -7.16 11.51 Favored 'General case' 0 N--CA 1.479 0.98 0 C-N-CA 123.315 0.646 . . . . 0.0 111.403 178.05 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 41.5 mtmt 59.79 35.29 22.03 Favored 'General case' 0 N--CA 1.487 1.387 0 C-N-CA 124.197 0.999 . . . . 0.0 111.901 175.212 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 90' ' ' ARG . . . . . 0.475 HH11 ' HD1' ' A' ' 56' ' ' PHE . 99.4 mtt180 -62.91 -15.74 56.39 Favored 'General case' 0 N--CA 1.49 1.569 0 N-CA-C 113.562 0.949 . . . . 0.0 113.562 -173.26 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 91' ' ' PHE . . . . . . . . . . . . . 21.9 p90 -71.37 162.08 30.02 Favored 'General case' 0 C--N 1.321 -0.654 0 C-N-CA 123.722 0.809 . . . . 0.0 111.904 172.645 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 1.4 tmtp? . . . . . 0 C--O 1.243 0.734 0 N-CA-C 105.668 -1.975 . . . . 0.0 105.668 167.294 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 36.0 ttp180 . . . . . 0 CA--C 1.534 0.334 0 N-CA-C 108.542 -0.91 . . . . 0.0 108.542 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -89.64 -18.02 27.29 Favored 'General case' 0 CA--C 1.543 0.703 0 CA-C-N 114.324 -1.307 . . . . 0.0 111.751 -172.498 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 29' ' ' TRP . . . . . . . . . . . . . 5.7 m-90 -130.51 139.25 50.51 Favored 'General case' 0 N--CA 1.473 0.718 0 C-N-CA 123.856 0.863 . . . . 0.0 109.792 -174.221 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 73.8 p -80.27 167.31 20.44 Favored 'General case' 0 C--O 1.242 0.702 0 N-CA-C 108.329 -0.989 . . . . 0.0 108.329 171.796 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 31' ' ' VAL . . . . . 0.579 ' HA ' HD12 ' A' ' 34' ' ' LEU . 9.5 p -62.81 -30.04 48.51 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.89 0 CA-C-N 117.572 0.169 . . . . 0.0 111.376 -174.946 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 9.9 pt-20 -68.76 -40.49 79.72 Favored 'General case' 0 C--N 1.359 0.981 0 C-N-CA 123.067 0.547 . . . . 0.0 110.706 175.185 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 52.6 mt-30 -64.14 -41.71 97.09 Favored 'General case' 0 N--CA 1.482 1.148 0 C-N-CA 123.002 0.521 . . . . 0.0 110.599 178.151 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.579 HD12 ' HA ' ' A' ' 31' ' ' VAL . 84.3 mt -60.29 -52.99 62.91 Favored 'General case' 0 N--CA 1.47 0.555 0 O-C-N 124.361 1.038 . . . . 0.0 111.219 -178.539 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 16.6 ptm180 -72.74 -23.19 60.81 Favored 'General case' 0 N--CA 1.475 0.818 0 O-C-N 124.418 1.074 . . . . 0.0 110.768 -175.876 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 24.7 t -63.19 123.3 18.28 Favored 'General case' 0 C--N 1.356 0.853 0 C-N-CA 123.032 0.533 . . . . 0.0 110.291 -177.788 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 12.0 pt-20 -65.01 -21.01 66.78 Favored 'General case' 0 N--CA 1.474 0.754 0 C-N-CA 123.858 0.863 . . . . 0.0 112.521 -177.653 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 94.8 mt-30 -68.56 -26.91 65.65 Favored 'General case' 0 CA--C 1.542 0.655 0 C-N-CA 123.749 0.82 . . . . 0.0 110.905 177.265 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 60.5 tp -83.14 117.97 70.23 Favored Pre-proline 0 N--CA 1.478 0.942 0 N-CA-C 108.363 -0.976 . . . . 0.0 108.363 169.511 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 40' ' ' PRO . . . . . 0.603 ' HB2' ' HG2' ' A' ' 42' ' ' LYS . 30.1 Cg_endo -64.01 141.23 76.21 Favored 'Trans proline' 0 C--N 1.376 2.004 0 C-N-CA 122.175 1.916 . . . . 0.0 112.254 176.414 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 50.5 mtmt -61.24 -32.68 72.47 Favored 'General case' 0 N--CA 1.474 0.748 0 C-N-CA 124.203 1.001 . . . . 0.0 111.026 178.832 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 42' ' ' LYS . . . . . 0.603 ' HG2' ' HB2' ' A' ' 40' ' ' PRO . 17.8 ptpt -65.99 -31.52 72.46 Favored 'General case' 0 N--CA 1.469 0.517 0 C-N-CA 123.858 0.863 . . . . 0.0 111.021 -179.568 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 43' ' ' ASP . . . . . 0.603 ' HB2' ' HG2' ' A' ' 40' ' ' PRO . 2.4 t70 -67.05 -38.05 85.13 Favored 'General case' 0 N--CA 1.481 1.089 0 N-CA-C 109.391 -0.596 . . . . 0.0 109.391 -178.246 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 44' ' ' ILE . . . . . 0.518 ' O ' ' HG ' ' A' ' 48' ' ' LEU . 23.6 mt -67.34 -53.93 28.3 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.765 0 CA-C-N 115.17 -0.923 . . . . 0.0 109.705 177.411 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 73.8 mt -60.09 -36.18 66.03 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.733 0 C-N-CA 123.655 0.782 . . . . 0.0 111.955 -178.453 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 33.8 ttpt -53.86 -45.19 70.91 Favored 'General case' 0 N--CA 1.48 1.052 0 C-N-CA 124.364 1.066 . . . . 0.0 110.479 174.314 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 31.9 t80 -67.51 -45.62 75.26 Favored 'General case' 0 CA--C 1.551 1.0 0 CA-C-N 114.353 -1.294 . . . . 0.0 111.442 177.384 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 48' ' ' LEU . . . . . 0.518 ' HG ' ' O ' ' A' ' 44' ' ' ILE . 73.9 mt -65.55 -34.25 77.81 Favored 'General case' 0 N--CA 1.477 0.923 0 C-N-CA 123.857 0.863 . . . . 0.0 111.673 -172.903 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 49' ' ' GLN . . . . . 0.464 ' HA ' HD21 ' A' ' 57' ' ' LEU . 3.4 pt20 -83.92 -28.03 28.16 Favored 'General case' 0 N--CA 1.481 1.081 0 C-N-CA 122.637 0.375 . . . . 0.0 110.766 176.004 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 11.5 tp10 -61.83 -48.91 78.47 Favored 'General case' 0 N--CA 1.482 1.134 0 C-N-CA 123.699 0.8 . . . . 0.0 110.73 179.1 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 1.1 m80 -140.59 22.86 2.32 Favored 'General case' 0 N--CA 1.482 1.135 0 N-CA-C 113.203 0.816 . . . . 0.0 113.203 -171.23 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -84.99 -144.18 6.76 Favored Glycine 0 CA--C 1.534 1.243 0 N-CA-C 109.375 -1.49 . . . . 0.0 109.375 157.467 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 53' ' ' SER . . . . . 0.461 ' O ' ' HG ' ' A' ' 57' ' ' LEU . 28.1 t -149.67 162.68 39.75 Favored 'General case' 0 N--CA 1.478 0.932 0 CA-C-N 117.59 0.695 . . . . 0.0 109.847 174.77 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 4.0 p30 -52.48 -36.04 54.07 Favored 'General case' 0 N--CA 1.487 1.377 0 C-N-CA 124.485 1.114 . . . . 0.0 112.988 -174.424 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 20.4 m -70.69 -43.43 69.04 Favored 'General case' 0 CA--C 1.546 0.791 0 C-N-CA 123.706 0.802 . . . . 0.0 110.762 179.623 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 56' ' ' PHE . . . . . 0.42 ' HE2' ' HB3' ' A' ' 48' ' ' LEU . 66.2 t80 -60.41 -38.92 85.56 Favored 'General case' 0 N--CA 1.483 1.196 0 C-N-CA 124.16 0.984 . . . . 0.0 110.348 174.474 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 57' ' ' LEU . . . . . 0.464 HD21 ' HA ' ' A' ' 49' ' ' GLN . 51.6 mt -73.9 -32.49 63.6 Favored 'General case' 0 C--O 1.211 -0.936 0 CA-C-N 115.012 -0.994 . . . . 0.0 110.485 -178.983 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -69.92 -47.15 63.55 Favored 'General case' 0 N--CA 1.483 1.18 0 C-N-CA 123.334 0.654 . . . . 0.0 111.391 179.024 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 42.2 mt-10 -55.15 -47.11 75.58 Favored 'General case' 0 N--CA 1.486 1.364 0 C-N-CA 123.631 0.773 . . . . 0.0 111.003 179.196 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 28.6 m80 -107.76 4.68 25.88 Favored 'General case' 0 CA--C 1.543 0.705 0 CA-C-N 115.583 -0.735 . . . . 0.0 111.871 -170.088 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 48.9 mtmt 55.73 39.24 30.81 Favored 'General case' 0 N--CA 1.492 1.639 0 C-N-CA 123.91 0.884 . . . . 0.0 111.824 176.754 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 62' ' ' LEU . . . . . 0.558 ' HA ' HG11 ' A' ' 69' ' ' VAL . 73.2 mt -88.12 -6.48 57.87 Favored 'General case' 0 N--CA 1.479 0.998 0 C-N-CA 123.93 0.892 . . . . 0.0 111.099 -179.723 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 63' ' ' LEU . . . . . 0.417 ' H ' ' HG ' ' A' ' 63' ' ' LEU . 1.8 pp -73.04 159.99 32.75 Favored 'General case' 0 N--CA 1.474 0.771 0 C-N-CA 124.011 0.924 . . . . 0.0 111.513 174.34 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 92.22 -168.46 31.1 Favored Glycine 0 CA--C 1.524 0.621 0 CA-C-N 115.518 -0.764 . . . . 0.0 112.682 179.729 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 16.1 m120 -62.37 126.15 26.35 Favored 'General case' 0 N--CA 1.478 0.948 0 C-N-CA 123.635 0.774 . . . . 0.0 109.831 -179.58 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 54.8 mt -57.09 -48.12 82.53 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.86 0 O-C-N 124.268 0.98 . . . . 0.0 112.434 -168.543 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 22.4 pttp -65.38 -31.55 72.72 Favored 'General case' 0 N--CA 1.482 1.159 0 C-N-CA 123.688 0.795 . . . . 0.0 111.575 -178.137 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 48.9 t30 -66.75 -41.77 87.26 Favored 'General case' 0 N--CA 1.481 1.121 0 C-N-CA 123.372 0.669 . . . . 0.0 109.862 176.458 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 69' ' ' VAL . . . . . 0.558 HG11 ' HA ' ' A' ' 62' ' ' LEU . 38.4 t -69.04 -34.57 64.56 Favored 'Isoleucine or valine' 0 C--O 1.212 -0.889 0 CA-C-N 115.03 -0.986 . . . . 0.0 109.644 175.31 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -75.37 -2.14 27.11 Favored 'General case' 0 N--CA 1.484 1.23 0 C-N-CA 123.683 0.793 . . . . 0.0 111.341 179.372 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 40.2 ttmt -95.06 -49.63 5.44 Favored 'General case' 0 CA--C 1.547 0.83 0 C-N-CA 123.554 0.742 . . . . 0.0 110.347 172.313 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 15.1 t -83.03 -33.63 26.44 Favored 'General case' 0 CA--C 1.555 1.167 0 C-N-CA 123.435 0.694 . . . . 0.0 111.955 -172.679 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -92.41 118.16 30.66 Favored 'General case' 0 N--CA 1.47 0.563 0 C-N-CA 123.972 0.909 . . . . 0.0 109.735 -179.452 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 74' ' ' ASN . . . . . 0.437 ' O ' ' HB3' ' A' ' 77' ' ' HIS . 24.0 p-10 -76.73 168.41 20.13 Favored 'General case' 0 N--CA 1.476 0.835 0 C-N-CA 123.173 0.589 . . . . 0.0 110.042 173.328 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 75' ' ' LYS . . . . . 0.416 ' HD3' ' O ' ' A' ' 34' ' ' LEU . 32.3 ttmt -71.99 -32.3 67.08 Favored 'General case' 0 CA--C 1.543 0.703 0 C-N-CA 122.78 0.432 . . . . 0.0 111.709 -175.184 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 33.9 t70 -60.74 -28.58 68.8 Favored 'General case' 0 N--CA 1.487 1.409 0 C-N-CA 123.283 0.633 . . . . 0.0 111.527 177.354 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 77' ' ' HIS . . . . . 0.474 ' HD2' HD23 ' A' ' 78' ' ' LEU . 42.1 t60 -71.2 -48.91 48.68 Favored 'General case' 0 CA--C 1.552 1.045 0 C-N-CA 125.055 1.342 . . . . 0.0 109.978 172.211 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 78' ' ' LEU . . . . . 0.474 HD23 ' HD2' ' A' ' 77' ' ' HIS . 77.6 mt -67.22 -45.79 75.76 Favored 'General case' 0 N--CA 1.487 1.408 0 N-CA-C 113.454 0.909 . . . . 0.0 113.454 -169.132 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 79' ' ' VAL . . . . . 0.524 HG22 ' HB3' ' A' ' 34' ' ' LEU . 61.9 t -59.53 -42.06 86.83 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.218 0 O-C-N 123.941 0.775 . . . . 0.0 110.207 -177.812 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 24.8 m -62.54 -44.41 96.4 Favored 'General case' 0 N--CA 1.476 0.847 0 CA-C-N 115.203 -0.908 . . . . 0.0 111.496 177.815 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -66.42 -39.35 88.89 Favored 'General case' 0 N--CA 1.48 1.041 0 C-N-CA 123.55 0.74 . . . . 0.0 110.7 -179.803 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 82' ' ' TYR . . . . . 0.455 ' CD2' HD11 ' A' ' 34' ' ' LEU . 86.6 t80 -63.13 -54.56 35.87 Favored 'General case' 0 N--CA 1.471 0.621 0 C-N-CA 124.387 1.075 . . . . 0.0 111.105 -177.328 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 83' ' ' ASN . . . . . . . . . . . . . 67.8 m-80 -68.71 -35.76 77.57 Favored 'General case' 0 N--CA 1.481 1.115 0 C-N-CA 123.055 0.542 . . . . 0.0 110.96 -177.492 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 37.9 t60 -63.97 -30.54 71.61 Favored 'General case' 0 N--CA 1.483 1.218 0 C-N-CA 123.859 0.863 . . . . 0.0 110.647 174.292 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 85' ' ' LEU . . . . . 0.408 ' HA ' ' HG2' ' A' ' 90' ' ' ARG . 1.5 tt -60.1 -51.93 67.53 Favored 'General case' 0 N--CA 1.479 1.018 0 C-N-CA 123.467 0.707 . . . . 0.0 109.522 -176.842 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 35.0 m-85 -73.11 -31.89 64.61 Favored 'General case' 0 N--CA 1.48 1.055 0 CA-C-N 115.499 -0.773 . . . . 0.0 110.991 -179.108 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 9.7 tp10 -60.68 -41.61 95.42 Favored 'General case' 0 N--CA 1.477 0.911 0 C-N-CA 124.345 1.058 . . . . 0.0 111.699 -177.114 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 12.2 p -120.32 3.73 10.81 Favored 'General case' 0 N--CA 1.477 0.916 0 C-N-CA 124.152 0.981 . . . . 0.0 111.779 -175.602 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 56.2 mtpt 53.85 70.17 0.63 Allowed 'General case' 0 N--CA 1.48 1.038 0 C-N-CA 124.673 1.189 . . . . 0.0 111.787 178.634 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 90' ' ' ARG . . . . . 0.408 ' HG2' ' HA ' ' A' ' 85' ' ' LEU . 26.3 mmm180 -80.12 14.33 1.93 Allowed 'General case' 0 N--CA 1.493 1.693 0 C-N-CA 124.241 1.016 . . . . 0.0 112.369 -179.722 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 91' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -65.15 163.25 15.4 Favored 'General case' 0 N--CA 1.479 1.012 0 C-N-CA 123.671 0.788 . . . . 0.0 110.839 -177.854 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 23.1 ttmm . . . . . 0 C--O 1.254 1.338 0 CA-C-N 115.256 -0.884 . . . . 0.0 109.287 174.952 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.545 0.786 0 CA-C-O 121.128 0.49 . . . . 0.0 111.3 . . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -78.97 -34.56 44.13 Favored 'General case' 0 CA--C 1.535 0.39 0 N-CA-C 108.697 -0.853 . . . . 0.0 108.697 173.348 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 29' ' ' TRP . . . . . . . . . . . . . 4.7 m-90 -134.13 149.83 51.1 Favored 'General case' 0 N--CA 1.476 0.835 0 C-N-CA 124.679 1.192 . . . . 0.0 108.344 178.782 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 21.6 p -91.72 178.1 6.01 Favored 'General case' 0 N--CA 1.478 0.929 0 C-N-CA 122.814 0.446 . . . . 0.0 110.916 -178.482 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 7.2 p -54.34 -45.78 68.96 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.608 0 N-CA-C 113.441 0.904 . . . . 0.0 113.441 -169.873 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 1.3 pm0 -71.42 -31.3 67.07 Favored 'General case' 0 N--CA 1.476 0.843 0 C-N-CA 123.133 0.573 . . . . 0.0 111.447 179.305 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 23.4 mm-40 -71.28 -32.98 69.33 Favored 'General case' 0 N--CA 1.476 0.844 0 C-N-CA 123.139 0.576 . . . . 0.0 110.613 175.69 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 70.3 mt -81.34 -27.3 35.0 Favored 'General case' 0 N--CA 1.475 0.797 0 C-N-CA 123.79 0.836 . . . . 0.0 111.827 -176.25 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 3.6 ptm180 -82.68 -25.26 33.2 Favored 'General case' 0 N--CA 1.479 0.983 0 CA-C-O 119.669 -0.205 . . . . 0.0 110.829 169.715 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 37.1 t -59.94 125.33 23.23 Favored 'General case' 0 N--CA 1.486 1.36 0 C-N-CA 124.093 0.957 . . . . 0.0 112.111 -172.974 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 10.9 tp10 -65.46 -17.16 64.34 Favored 'General case' 0 CA--C 1.555 1.161 0 C-N-CA 124.487 1.115 . . . . 0.0 111.558 178.534 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 71.3 mt-30 -62.89 -38.59 91.51 Favored 'General case' 0 N--CA 1.476 0.869 0 C-N-CA 123.852 0.861 . . . . 0.0 110.418 173.377 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 39' ' ' LEU . . . . . 0.512 HD12 ' HD2' ' A' ' 40' ' ' PRO . 51.4 tp -86.52 128.09 58.22 Favored Pre-proline 0 N--CA 1.482 1.134 0 C-N-CA 123.777 0.831 . . . . 0.0 110.016 177.573 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 40' ' ' PRO . . . . . 0.512 ' HD2' HD12 ' A' ' 39' ' ' LEU . 39.0 Cg_endo -70.14 134.26 26.78 Favored 'Trans proline' 0 C--N 1.379 2.144 0 C-N-CA 122.363 2.042 . . . . 0.0 112.318 173.168 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 41' ' ' LYS . . . . . 0.517 ' HB3' ' HD3' ' A' ' 75' ' ' LYS . 21.5 pttp -76.95 -20.01 56.65 Favored 'General case' 0 N--CA 1.48 1.051 0 N-CA-C 113.235 0.828 . . . . 0.0 113.235 -173.213 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 42' ' ' LYS . . . . . 0.567 ' HA ' HD12 ' A' ' 45' ' ' ILE . 60.1 pttt -63.77 -30.76 71.82 Favored 'General case' 0 N--CA 1.478 0.941 0 C-N-CA 122.966 0.507 . . . . 0.0 110.706 171.256 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -73.94 -26.25 60.4 Favored 'General case' 0 N--CA 1.479 0.996 0 C-N-CA 122.967 0.507 . . . . 0.0 111.596 177.692 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 39.3 mt -74.55 -43.99 47.75 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.971 0 N-CA-C 109.438 -0.578 . . . . 0.0 109.438 174.846 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 45' ' ' ILE . . . . . 0.567 HD12 ' HA ' ' A' ' 42' ' ' LYS . 77.9 mt -53.89 -46.85 64.57 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.165 0 C-N-CA 123.358 0.663 . . . . 0.0 109.314 172.119 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 29.0 ttpp -63.79 -39.37 94.1 Favored 'General case' 0 CA--C 1.538 0.519 0 CA-C-N 114.467 -1.242 . . . . 0.0 110.893 -177.948 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 26.5 t80 -64.64 -54.31 33.77 Favored 'General case' 0 N--CA 1.473 0.693 0 O-C-N 123.969 0.793 . . . . 0.0 110.623 177.13 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 95.8 mt -69.03 -29.69 67.91 Favored 'General case' 0 N--CA 1.474 0.726 0 C-N-CA 123.656 0.782 . . . . 0.0 111.846 -173.03 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 3.0 pt20 -79.45 -26.21 41.81 Favored 'General case' 0 N--CA 1.48 1.039 0 C-N-CA 122.222 0.209 . . . . 0.0 110.621 176.646 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 10.7 tp10 -61.23 -37.71 84.03 Favored 'General case' 0 N--CA 1.482 1.159 0 C-N-CA 123.679 0.791 . . . . 0.0 111.269 -179.477 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 31.2 p-80 -124.34 -32.21 3.2 Favored 'General case' 0 N--CA 1.485 1.32 0 N-CA-C 113.253 0.834 . . . . 0.0 113.253 -174.24 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -61.83 139.84 46.78 Favored Glycine 0 C--N 1.348 1.198 0 CA-C-N 118.221 0.464 . . . . 0.0 113.6 178.115 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 53' ' ' SER . . . . . 0.472 ' O ' ' HG ' ' A' ' 57' ' ' LEU . 44.1 t -60.14 148.36 36.33 Favored 'General case' 0 N--CA 1.48 1.057 0 C-N-CA 123.582 0.753 . . . . 0.0 111.597 179.556 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 14.2 m-20 -61.52 -32.9 72.96 Favored 'General case' 0 N--CA 1.487 1.419 0 C-N-CA 123.65 0.78 . . . . 0.0 112.489 -174.181 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 21.5 m -67.42 -41.93 84.05 Favored 'General case' 0 CA--C 1.544 0.716 0 O-C-N 123.607 0.567 . . . . 0.0 110.402 177.827 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 56' ' ' PHE . . . . . 0.52 ' HB2' ' HD3' ' A' ' 90' ' ' ARG . 62.4 t80 -60.98 -43.9 98.14 Favored 'General case' 0 N--CA 1.477 0.882 0 C-N-CA 123.849 0.86 . . . . 0.0 109.934 174.027 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 57' ' ' LEU . . . . . 0.472 ' HG ' ' O ' ' A' ' 53' ' ' SER . 73.1 mt -64.53 -44.49 90.67 Favored 'General case' 0 C--O 1.209 -1.068 0 CA-C-N 115.097 -0.956 . . . . 0.0 110.491 -177.506 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -61.72 -45.28 94.64 Favored 'General case' 0 N--CA 1.482 1.138 0 C-N-CA 123.655 0.782 . . . . 0.0 111.393 -177.39 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 46.7 mt-10 -60.38 -36.58 78.39 Favored 'General case' 0 N--CA 1.482 1.168 0 C-N-CA 123.666 0.787 . . . . 0.0 112.006 177.668 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 53.2 m80 -105.11 6.82 33.51 Favored 'General case' 0 N--CA 1.487 1.393 0 C-N-CA 122.967 0.507 . . . . 0.0 112.132 -177.59 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 68.8 mmtt 59.96 27.22 16.57 Favored 'General case' 0 N--CA 1.488 1.436 0 C-N-CA 125.094 1.358 . . . . 0.0 112.981 175.65 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 70.1 mt -81.92 -21.51 37.3 Favored 'General case' 0 N--CA 1.483 1.198 0 C-N-CA 124.157 0.983 . . . . 0.0 112.669 -174.703 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -78.09 170.04 17.27 Favored 'General case' 0 N--CA 1.485 1.283 0 CA-C-O 120.809 0.337 . . . . 0.0 111.683 179.818 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 90.96 -157.55 25.23 Favored Glycine 0 C--N 1.341 0.848 0 CA-C-N 115.391 -0.822 . . . . 0.0 112.367 177.303 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 65' ' ' ASN . . . . . 0.402 ' O ' HG23 ' A' ' 69' ' ' VAL . 17.8 m120 -69.41 115.93 9.25 Favored 'General case' 0 N--CA 1.47 0.567 0 C-N-CA 123.62 0.768 . . . . 0.0 110.205 -179.437 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 65.7 mt -54.29 -50.35 57.11 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.967 0 C-N-CA 124.515 1.126 . . . . 0.0 112.187 -173.758 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 67' ' ' LYS . . . . . 0.501 ' H ' ' HD2' ' A' ' 67' ' ' LYS . 0.0 OUTLIER -60.92 -41.64 96.59 Favored 'General case' 0 N--CA 1.48 1.049 0 O-C-N 123.774 0.671 . . . . 0.0 109.661 -175.898 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 49.5 t30 -61.35 -47.82 84.11 Favored 'General case' 0 N--CA 1.479 1.008 0 CA-C-N 115.075 -0.966 . . . . 0.0 110.975 176.959 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 69' ' ' VAL . . . . . 0.402 HG23 ' O ' ' A' ' 65' ' ' ASN . 85.8 t -62.28 -32.35 54.57 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.099 0 C-N-CA 123.585 0.754 . . . . 0.0 110.732 178.676 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -70.69 8.02 0.97 Allowed 'General case' 0 CA--C 1.554 1.134 0 C-N-CA 123.738 0.815 . . . . 0.0 112.976 -178.453 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 16.5 ptpt -94.81 -27.4 15.78 Favored 'General case' 0 N--CA 1.484 1.255 0 CA-C-N 119.179 0.9 . . . . 0.0 110.824 169.69 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 10.2 t -109.23 -28.94 8.74 Favored 'General case' 0 N--CA 1.482 1.155 0 C-N-CA 123.732 0.813 . . . . 0.0 111.045 -175.207 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -80.62 86.36 5.89 Favored 'General case' 0 C--O 1.237 0.447 0 C-N-CA 123.511 0.724 . . . . 0.0 109.656 -178.66 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 3.9 p-10 -70.27 160.95 31.26 Favored 'General case' 0 C--O 1.239 0.538 0 CA-C-N 114.489 -1.232 . . . . 0.0 110.389 174.877 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 75' ' ' LYS . . . . . 0.517 ' HD3' ' HB3' ' A' ' 41' ' ' LYS . 13.3 tptm -61.19 -47.73 84.79 Favored 'General case' 0 N--CA 1.471 0.59 0 CA-C-N 115.712 -0.676 . . . . 0.0 111.3 -166.923 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 4.4 p30 -69.43 -29.94 67.76 Favored 'General case' 0 N--CA 1.485 1.3 0 CA-C-N 115.975 -0.557 . . . . 0.0 111.649 -176.304 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 74.5 t60 -59.83 -41.53 91.53 Favored 'General case' 0 N--CA 1.481 1.099 0 C-N-CA 123.883 0.873 . . . . 0.0 110.128 173.094 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 78' ' ' LEU . . . . . 0.452 ' CD1' ' HB2' ' A' ' 41' ' ' LYS . 83.5 mt -74.1 -28.95 61.6 Favored 'General case' 0 N--CA 1.47 0.533 0 CA-C-N 115.242 -0.89 . . . . 0.0 112.24 -176.92 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 79' ' ' VAL . . . . . 0.414 HG23 ' O ' ' A' ' 75' ' ' LYS . 21.3 t -73.73 -39.1 52.49 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.914 0 N-CA-C 109.732 -0.47 . . . . 0.0 109.732 173.553 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 29.2 m -67.5 -36.62 81.44 Favored 'General case' 0 N--CA 1.48 1.061 0 C-N-CA 122.895 0.478 . . . . 0.0 111.098 176.094 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -68.34 -39.65 81.84 Favored 'General case' 0 N--CA 1.473 0.688 0 C-N-CA 123.378 0.671 . . . . 0.0 109.955 175.663 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 82' ' ' TYR . . . . . . . . . . . . . 15.2 t80 -53.57 -58.86 5.67 Favored 'General case' 0 CA--C 1.542 0.65 0 CA-C-N 115.084 -0.962 . . . . 0.0 110.217 174.859 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 83' ' ' ASN . . . . . . . . . . . . . 49.4 m-80 -64.72 -31.19 72.3 Favored 'General case' 0 N--CA 1.481 1.112 0 C-N-CA 122.749 0.42 . . . . 0.0 111.501 -175.513 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 6.4 t60 -65.7 -45.66 81.91 Favored 'General case' 0 CA--C 1.549 0.938 0 C-N-CA 123.471 0.708 . . . . 0.0 110.267 178.218 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 85' ' ' LEU . . . . . 0.418 HD12 ' HB2' ' A' ' 90' ' ' ARG . 20.2 tp -57.13 -54.72 43.57 Favored 'General case' 0 N--CA 1.49 1.531 0 C-N-CA 123.701 0.8 . . . . 0.0 112.34 -172.691 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 83.0 m-85 -74.6 -21.73 59.32 Favored 'General case' 0 CA--C 1.543 0.697 0 CA-C-N 113.625 -1.625 . . . . 0.0 111.409 -174.519 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 7.9 tp10 -82.91 -10.84 58.62 Favored 'General case' 0 N--CA 1.478 0.96 0 C-N-CA 123.165 0.586 . . . . 0.0 111.601 178.524 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 31.4 p -125.5 -3.17 7.34 Favored 'General case' 0 N--CA 1.483 1.211 0 C-N-CA 123.617 0.767 . . . . 0.0 110.94 178.691 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 74.4 mmtt 61.04 23.84 13.99 Favored 'General case' 0 N--CA 1.486 1.359 0 C-N-CA 125.033 1.333 . . . . 0.0 113.125 174.052 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 90' ' ' ARG . . . . . 0.52 ' HD3' ' HB2' ' A' ' 56' ' ' PHE . 51.1 mtt180 -65.15 -18.87 65.67 Favored 'General case' 0 N--CA 1.491 1.605 0 N-CA-C 113.812 1.041 . . . . 0.0 113.812 -170.296 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 91' ' ' PHE . . . . . . . . . . . . . 24.6 p90 -59.68 145.65 44.08 Favored 'General case' 0 N--CA 1.476 0.841 0 C-N-CA 122.688 0.395 . . . . 0.0 111.571 177.56 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 14.1 mmmm . . . . . 0 CA--C 1.554 1.107 0 C-N-CA 124.736 1.214 . . . . 0.0 111.561 -167.27 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 CA--C 1.547 0.858 0 N-CA-C 108.341 -0.985 . . . . 0.0 108.341 . . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -128.9 -17.57 3.94 Favored 'General case' 0 N--CA 1.482 1.169 0 N-CA-C 112.543 0.572 . . . . 0.0 112.543 -167.537 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 29' ' ' TRP . . . . . . . . . . . . . 2.1 m-90 -126.27 138.1 53.57 Favored 'General case' 0 N--CA 1.481 1.101 0 C-N-CA 122.606 0.362 . . . . 0.0 110.143 -167.765 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 8.4 m -81.83 161.95 23.02 Favored 'General case' 0 CA--C 1.549 0.935 0 N-CA-C 108.191 -1.04 . . . . 0.0 108.191 171.353 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 31' ' ' VAL . . . . . 0.556 ' HA ' HD12 ' A' ' 34' ' ' LEU . 60.1 t -57.48 -33.3 43.95 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.485 0 C-N-CA 123.003 0.521 . . . . 0.0 110.74 -177.483 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 12.0 pt-20 -68.07 -38.56 82.53 Favored 'General case' 0 N--CA 1.478 0.97 0 C-N-CA 124.558 1.143 . . . . 0.0 111.83 176.026 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 43.2 mt-30 -65.49 -37.76 87.76 Favored 'General case' 0 N--CA 1.48 1.044 0 C-N-CA 122.54 0.336 . . . . 0.0 110.467 176.552 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.556 HD12 ' HA ' ' A' ' 31' ' ' VAL . 72.9 mt -65.15 -56.45 12.83 Favored 'General case' 0 C--N 1.347 0.492 0 O-C-N 123.969 0.793 . . . . 0.0 110.233 -178.516 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 40.2 ptt180 -65.01 -24.47 67.51 Favored 'General case' 0 N--CA 1.481 1.1 0 CA-C-N 115.331 -0.85 . . . . 0.0 111.194 -173.517 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 33.6 t -65.39 116.09 6.33 Favored 'General case' 0 C--O 1.24 0.582 0 N-CA-C 108.599 -0.889 . . . . 0.0 108.599 173.408 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 5.2 tp10 -73.76 -7.01 50.48 Favored 'General case' 0 CA--C 1.553 1.065 0 C-N-CA 123.189 0.596 . . . . 0.0 110.844 -174.668 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 70.8 mt-30 -55.28 -39.29 69.66 Favored 'General case' 0 N--CA 1.479 0.986 0 C-N-CA 124.417 1.087 . . . . 0.0 110.049 167.801 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 3.6 tt -78.88 124.8 84.82 Favored Pre-proline 0 CA--C 1.557 1.221 0 N-CA-C 107.926 -1.139 . . . . 0.0 107.926 173.961 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 40.9 Cg_exo -59.49 -178.54 0.16 Allowed 'Trans proline' 0 C--N 1.379 2.167 0 C-N-CA 123.475 2.783 . . . . 0.0 113.98 171.36 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 52.0 mtmt -106.16 -20.15 13.49 Favored 'General case' 0 N--CA 1.473 0.697 0 CA-C-N 115.901 -0.591 . . . . 0.0 110.808 178.686 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 18.9 ptpt -62.08 -47.21 85.66 Favored 'General case' 0 N--CA 1.474 0.769 0 C-N-CA 123.726 0.811 . . . . 0.0 112.089 -174.764 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 43' ' ' ASP . . . . . 0.525 ' HA ' ' HE2' ' A' ' 46' ' ' LYS . 9.4 p-10 -73.86 -27.95 61.34 Favored 'General case' 0 N--CA 1.472 0.625 0 CA-C-N 116.07 -0.514 . . . . 0.0 111.907 -174.256 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 32.6 mt -68.66 -56.08 13.58 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.944 0 N-CA-C 109.735 -0.469 . . . . 0.0 109.735 175.88 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 79.9 mt -54.77 -38.47 43.96 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.544 0 C-N-CA 123.558 0.743 . . . . 0.0 110.654 175.812 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 46' ' ' LYS . . . . . 0.525 ' HE2' ' HA ' ' A' ' 43' ' ' ASP . 38.6 ttpt -62.63 -45.56 92.28 Favored 'General case' 0 N--CA 1.48 1.054 0 C-N-CA 124.092 0.957 . . . . 0.0 111.721 179.602 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 47' ' ' PHE . . . . . 0.465 ' HE2' ' HZ ' ' A' ' 86' ' ' PHE . 24.3 t80 -66.72 -44.51 81.39 Favored 'General case' 0 N--CA 1.476 0.852 0 CA-C-N 115.719 -0.673 . . . . 0.0 111.295 179.808 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 83.6 mt -71.04 -30.3 66.45 Favored 'General case' 0 CA--C 1.539 0.526 0 CA-C-N 115.516 -0.765 . . . . 0.0 111.2 -175.435 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 49' ' ' GLN . . . . . 0.498 ' HA ' HD21 ' A' ' 57' ' ' LEU . 2.9 pt20 -81.44 -26.76 35.05 Favored 'General case' 0 N--CA 1.479 1.014 0 O-C-N 123.245 0.34 . . . . 0.0 110.764 175.638 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 10.8 tp10 -62.29 -43.4 98.92 Favored 'General case' 0 N--CA 1.477 0.878 0 C-N-CA 123.611 0.764 . . . . 0.0 110.95 179.196 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 0.7 OUTLIER -107.66 -36.17 6.51 Favored 'General case' 0 N--CA 1.476 0.836 0 CA-C-N 115.94 -0.573 . . . . 0.0 111.682 -171.167 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 52' ' ' GLY . . . . . 0.557 ' HA2' ' HA ' ' A' ' 91' ' ' PHE . . . -61.85 143.62 48.71 Favored Glycine 0 C--N 1.353 1.508 0 N-CA-C 114.431 0.532 . . . . 0.0 114.431 -177.757 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 53' ' ' SER . . . . . 0.403 ' O ' ' HG ' ' A' ' 57' ' ' LEU . 92.4 p -78.74 174.7 11.17 Favored 'General case' 0 N--CA 1.485 1.321 0 C-N-CA 123.908 0.883 . . . . 0.0 111.217 -179.081 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 6.8 m-20 -57.24 -44.44 83.85 Favored 'General case' 0 N--CA 1.491 1.585 0 C-N-CA 123.494 0.718 . . . . 0.0 110.95 179.815 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 39.5 t -63.48 -32.68 74.19 Favored 'General case' 0 CA--C 1.548 0.896 0 CA-C-N 115.13 -0.941 . . . . 0.0 111.579 -179.119 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 56' ' ' PHE . . . . . 0.401 ' HB2' ' HB3' ' A' ' 90' ' ' ARG . 54.7 t80 -74.27 -48.88 25.78 Favored 'General case' 0 N--CA 1.477 0.887 0 CA-C-O 120.864 0.364 . . . . 0.0 110.53 175.741 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 57' ' ' LEU . . . . . 0.498 HD21 ' HA ' ' A' ' 49' ' ' GLN . 37.2 mt -70.11 -36.64 74.99 Favored 'General case' 0 N--CA 1.478 0.941 0 CA-C-N 115.427 -0.806 . . . . 0.0 112.398 -169.296 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -71.03 -49.83 40.71 Favored 'General case' 0 N--CA 1.474 0.729 0 C-N-CA 122.919 0.488 . . . . 0.0 111.106 -179.717 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 39.2 mm-40 -69.25 -20.69 63.94 Favored 'General case' 0 N--CA 1.478 0.97 0 N-CA-C 112.745 0.646 . . . . 0.0 112.745 -179.164 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 62.8 m80 -108.77 -3.2 17.95 Favored 'General case' 0 N--CA 1.483 1.213 0 C-N-CA 123.1 0.56 . . . . 0.0 111.459 176.791 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 50.5 mtmt 59.46 28.36 17.72 Favored 'General case' 0 N--CA 1.495 1.79 0 C-N-CA 124.369 1.068 . . . . 0.0 112.732 174.5 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 62' ' ' LEU . . . . . 0.508 HD11 ' HB1' ' A' ' 81' ' ' ALA . 87.3 mt -88.98 -7.46 55.96 Favored 'General case' 0 N--CA 1.486 1.364 0 C-N-CA 123.776 0.831 . . . . 0.0 112.373 -174.232 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 2.2 pp -78.3 176.72 9.04 Favored 'General case' 0 N--CA 1.479 0.985 0 C-N-CA 123.029 0.532 . . . . 0.0 110.952 177.135 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 78.32 -162.13 49.29 Favored Glycine 0 CA--C 1.526 0.724 0 CA-C-N 115.685 -0.689 . . . . 0.0 113.505 176.816 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 65' ' ' ASN . . . . . 0.414 HD22 ' N ' ' A' ' 65' ' ' ASN . 0.8 OUTLIER -64.6 113.38 3.68 Favored 'General case' 0 N--CA 1.477 0.921 0 C-N-CA 123.524 0.73 . . . . 0.0 109.185 -179.621 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 82.4 mt -54.6 -47.45 72.28 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.947 0 O-C-N 124.123 0.89 . . . . 0.0 111.775 -173.77 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -65.68 -30.29 70.96 Favored 'General case' 0 N--CA 1.483 1.186 0 N-CA-C 111.999 0.37 . . . . 0.0 111.999 -177.494 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 68' ' ' ASN . . . . . 0.493 ' O ' ' HG2' ' A' ' 71' ' ' LYS . 60.0 t30 -73.57 -34.58 65.19 Favored 'General case' 0 N--CA 1.483 1.188 0 C-N-CA 123.356 0.662 . . . . 0.0 110.268 178.141 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 67.1 t -72.94 -34.13 45.3 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.875 0 CA-C-N 115.536 -0.756 . . . . 0.0 110.082 172.247 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -75.75 1.86 13.67 Favored 'General case' 0 N--CA 1.484 1.242 0 C-N-CA 124.112 0.965 . . . . 0.0 112.953 -175.481 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 71' ' ' LYS . . . . . 0.493 ' HG2' ' O ' ' A' ' 68' ' ' ASN . 18.0 ptpt -94.7 -17.92 21.78 Favored 'General case' 0 N--CA 1.482 1.166 0 CA-C-N 118.186 0.448 . . . . 0.0 110.666 172.891 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 14.1 t -129.09 -12.98 4.58 Favored 'General case' 0 CA--C 1.547 0.84 0 C-N-CA 123.356 0.662 . . . . 0.0 111.861 -169.707 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -99.87 98.29 9.09 Favored 'General case' 0 N--CA 1.472 0.645 0 N-CA-C 107.999 -1.111 . . . . 0.0 107.999 174.863 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 26.6 p-10 -71.33 169.69 14.72 Favored 'General case' 0 N--CA 1.48 1.039 0 O-C-N 123.331 0.395 . . . . 0.0 110.388 -178.546 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 75' ' ' LYS . . . . . 0.48 ' O ' HG23 ' A' ' 79' ' ' VAL . 3.4 tppp? -61.46 -40.47 94.62 Favored 'General case' 0 CA--C 1.545 0.755 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.911 -175.81 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 23.2 m-20 -58.13 -41.11 82.97 Favored 'General case' 0 N--CA 1.486 1.374 0 C-N-CA 123.485 0.714 . . . . 0.0 111.473 -179.977 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 75.3 t60 -61.44 -40.45 94.52 Favored 'General case' 0 N--CA 1.479 0.993 0 C-N-CA 124.047 0.939 . . . . 0.0 110.827 175.72 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 58.3 mt -75.77 -28.44 58.44 Favored 'General case' 0 N--CA 1.48 1.034 0 C-N-CA 123.234 0.614 . . . . 0.0 112.54 -176.037 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 79' ' ' VAL . . . . . 0.48 HG23 ' O ' ' A' ' 75' ' ' LYS . 61.5 t -67.54 -48.27 77.47 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.704 0 N-CA-C 108.703 -0.851 . . . . 0.0 108.703 172.76 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 53.7 m -60.56 -39.96 89.9 Favored 'General case' 0 CA--C 1.542 0.659 0 CA-C-N 114.828 -1.078 . . . . 0.0 111.124 177.453 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 81' ' ' ALA . . . . . 0.508 ' HB1' HD11 ' A' ' 62' ' ' LEU . . . -70.12 -42.72 72.26 Favored 'General case' 0 CA--C 1.542 0.637 0 C-N-CA 123.049 0.54 . . . . 0.0 111.588 -178.9 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 82' ' ' TYR . . . . . 0.554 ' CD2' HD11 ' A' ' 34' ' ' LEU . 90.2 t80 -62.89 -55.89 22.1 Favored 'General case' 0 N--CA 1.479 0.995 0 C-N-CA 123.982 0.913 . . . . 0.0 110.797 -179.067 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 83' ' ' ASN . . . . . . . . . . . . . 60.8 m-80 -65.1 -46.98 78.83 Favored 'General case' 0 N--CA 1.48 1.041 0 C-N-CA 122.714 0.406 . . . . 0.0 111.589 -175.846 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 26.3 m-70 -67.04 -23.99 65.95 Favored 'General case' 0 N--CA 1.482 1.16 0 C-N-CA 123.511 0.724 . . . . 0.0 112.086 -179.121 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 21.1 tp -59.11 -54.44 47.02 Favored 'General case' 0 N--CA 1.483 1.182 0 CA-C-O 121.205 0.526 . . . . 0.0 110.553 177.5 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 86' ' ' PHE . . . . . 0.465 ' HZ ' ' HE2' ' A' ' 47' ' ' PHE . 6.3 m-85 -75.36 -29.75 60.01 Favored 'General case' 0 N--CA 1.471 0.586 0 CA-C-N 114.242 -1.344 . . . . 0.0 110.874 -176.1 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 22.8 tt0 -54.78 -40.31 69.3 Favored 'General case' 0 N--CA 1.481 1.12 0 C-N-CA 124.732 1.213 . . . . 0.0 111.105 176.378 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 40.7 p -111.62 -7.3 14.28 Favored 'General case' 0 CA--C 1.544 0.719 0 C-N-CA 124.279 1.031 . . . . 0.0 111.381 -176.634 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 8.5 mtpm? 52.84 43.26 31.74 Favored 'General case' 0 N--CA 1.481 1.11 0 C-N-CA 124.778 1.231 . . . . 0.0 111.91 -177.812 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 90' ' ' ARG . . . . . 0.401 ' HB3' ' HB2' ' A' ' 56' ' ' PHE . 94.1 mtt180 -69.59 -9.01 52.29 Favored 'General case' 0 N--CA 1.49 1.528 0 C-N-CA 123.746 0.818 . . . . 0.0 113.004 179.845 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 91' ' ' PHE . . . . . 0.557 ' HA ' ' HA2' ' A' ' 52' ' ' GLY . 21.1 p90 -65.95 133.94 51.91 Favored 'General case' 0 CA--C 1.546 0.79 0 CA-C-O 120.973 0.416 . . . . 0.0 111.492 174.084 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 61.3 tttp . . . . . 0 C--O 1.252 1.216 0 CA-C-N 115.322 -0.853 . . . . 0.0 108.854 173.599 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 27' ' ' ARG . . . . . 0.508 ' HB2' ' OH ' ' A' ' 82' ' ' TYR . 0.0 OUTLIER . . . . . 0 CA--C 1.542 0.657 0 CA-C-O 121.103 0.478 . . . . 0.0 110.918 . . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -91.39 -34.96 14.66 Favored 'General case' 0 N--CA 1.469 0.525 0 CA-C-N 115.099 -0.955 . . . . 0.0 111.436 -169.222 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 29' ' ' TRP . . . . . . . . . . . . . 4.4 m-90 -115.17 149.86 36.98 Favored 'General case' 0 N--CA 1.469 0.48 0 CA-C-N 115.51 -0.768 . . . . 0.0 111.433 -169.443 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 80.8 p -90.74 168.98 11.35 Favored 'General case' 0 CA--C 1.54 0.574 0 CA-C-N 115.275 -0.875 . . . . 0.0 109.223 172.512 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 31' ' ' VAL . . . . . 0.585 ' HA ' HD12 ' A' ' 34' ' ' LEU . 2.6 p -52.17 -41.66 33.8 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.416 0 C-N-CA 123.737 0.815 . . . . 0.0 112.633 -177.214 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 12.7 pt-20 -73.77 -36.44 65.09 Favored 'General case' 0 N--CA 1.478 0.961 0 C-N-CA 124.135 0.974 . . . . 0.0 112.111 -178.398 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 52.7 mt-30 -61.1 -38.58 86.82 Favored 'General case' 0 N--CA 1.49 1.538 0 C-N-CA 122.705 0.402 . . . . 0.0 110.101 175.267 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.585 HD12 ' HA ' ' A' ' 31' ' ' VAL . 36.1 mt -63.03 -41.32 99.5 Favored 'General case' 0 N--CA 1.473 0.699 0 CA-C-N 115.466 -0.788 . . . . 0.0 110.626 178.266 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 32.5 mtp180 -70.44 -30.31 67.13 Favored 'General case' 0 N--CA 1.478 0.939 0 C-N-CA 123.352 0.661 . . . . 0.0 111.518 -179.636 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 34.0 t -66.13 114.07 4.98 Favored 'General case' 0 N--CA 1.473 0.715 0 C-N-CA 123.308 0.643 . . . . 0.0 110.41 -179.949 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 41.0 mt-10 -73.32 -10.98 60.32 Favored 'General case' 0 CA--C 1.55 0.951 0 C-N-CA 123.454 0.702 . . . . 0.0 112.297 -176.642 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 79.1 mm-40 -55.57 -37.81 68.51 Favored 'General case' 0 N--CA 1.488 1.428 0 C-N-CA 123.695 0.798 . . . . 0.0 109.703 166.257 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 4.8 tt -78.44 128.87 76.42 Favored Pre-proline 0 CA--C 1.553 1.065 0 N-CA-C 107.329 -1.36 . . . . 0.0 107.329 170.746 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 47.5 Cg_exo -60.2 172.55 2.41 Favored 'Trans proline' 0 C--N 1.373 1.844 0 C-N-CA 123.259 2.639 . . . . 0.0 114.63 176.464 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 55.9 mtmt -93.36 -32.17 14.37 Favored 'General case' 0 N--CA 1.475 0.786 0 C-N-CA 123.662 0.785 . . . . 0.0 110.706 173.213 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 21.3 ptmt -63.83 -41.39 97.85 Favored 'General case' 0 CA--C 1.545 0.761 0 C-N-CA 123.911 0.884 . . . . 0.0 112.475 -172.801 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 30.4 p-10 -71.2 -32.37 68.76 Favored 'General case' 0 N--CA 1.481 1.103 0 C-N-CA 123.142 0.577 . . . . 0.0 111.912 -175.753 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 33.5 mt -68.85 -48.87 68.39 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.198 0 N-CA-C 109.982 -0.377 . . . . 0.0 109.982 176.079 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 79.6 mt -60.71 -39.97 83.34 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.364 0 C-N-CA 123.102 0.561 . . . . 0.0 110.938 178.005 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 84.7 tttt -62.76 -44.21 96.79 Favored 'General case' 0 CA--C 1.544 0.735 0 CA-C-N 115.436 -0.802 . . . . 0.0 110.784 177.788 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 1.0 OUTLIER -57.94 -52.08 66.99 Favored 'General case' 0 N--CA 1.484 1.256 0 O-C-N 124.248 0.967 . . . . 0.0 109.324 177.518 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 48' ' ' LEU . . . . . 0.492 HD21 ' HA ' ' A' ' 82' ' ' TYR . 96.3 mt -67.4 -31.6 71.92 Favored 'General case' 0 N--CA 1.471 0.612 0 CA-C-N 114.906 -1.043 . . . . 0.0 113.052 -174.732 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 49' ' ' GLN . . . . . 0.551 ' HA ' HD21 ' A' ' 57' ' ' LEU . 3.4 pt20 -84.18 -27.4 28.08 Favored 'General case' 0 N--CA 1.482 1.162 0 CA-C-N 117.886 0.312 . . . . 0.0 111.359 178.483 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 40.3 tt0 -75.19 -36.83 61.4 Favored 'General case' 0 N--CA 1.474 0.754 0 C-N-CA 123.387 0.675 . . . . 0.0 111.346 179.611 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 69.1 m80 -107.87 -35.46 6.64 Favored 'General case' 0 N--CA 1.476 0.855 0 CA-C-N 115.562 -0.745 . . . . 0.0 112.06 -173.163 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -66.67 172.89 27.4 Favored Glycine 0 CA--C 1.528 0.883 0 CA-C-N 117.691 0.223 . . . . 0.0 113.346 176.314 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 53' ' ' SER . . . . . 0.458 ' O ' ' HG ' ' A' ' 57' ' ' LEU . 64.0 p -94.32 161.42 14.25 Favored 'General case' 0 N--CA 1.48 1.033 0 C-N-CA 123.154 0.582 . . . . 0.0 109.825 176.514 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 5.1 p-10 -63.26 -34.27 77.31 Favored 'General case' 0 N--CA 1.485 1.283 0 C-N-CA 122.897 0.479 . . . . 0.0 111.757 -176.384 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 23.1 t -67.86 -39.6 83.75 Favored 'General case' 0 N--CA 1.481 1.076 0 C-N-CA 123.619 0.768 . . . . 0.0 110.44 177.821 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 47.7 t80 -59.78 -37.66 79.68 Favored 'General case' 0 N--CA 1.483 1.208 0 C-N-CA 124.191 0.996 . . . . 0.0 110.161 172.972 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 57' ' ' LEU . . . . . 0.551 HD21 ' HA ' ' A' ' 49' ' ' GLN . 49.0 mt -74.9 -39.01 61.71 Favored 'General case' 0 C--O 1.216 -0.684 0 CA-C-N 115.836 -0.62 . . . . 0.0 112.012 -177.911 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -66.89 -46.74 73.97 Favored 'General case' 0 N--CA 1.481 1.086 0 CA-C-O 121.344 0.592 . . . . 0.0 110.435 -178.444 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 43.4 mt-10 -66.2 -26.11 67.24 Favored 'General case' 0 CA--C 1.55 0.954 0 CA-C-N 114.939 -1.028 . . . . 0.0 112.264 178.942 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 33.1 m80 -116.7 9.18 13.96 Favored 'General case' 0 N--CA 1.493 1.691 0 N-CA-C 112.888 0.699 . . . . 0.0 112.888 -178.862 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 34.1 mmtp 57.81 26.57 13.34 Favored 'General case' 0 N--CA 1.498 1.934 0 C-N-CA 124.224 1.01 . . . . 0.0 113.34 173.11 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 62' ' ' LEU . . . . . 0.425 HD11 ' HB1' ' A' ' 81' ' ' ALA . 73.1 mt -87.36 -9.67 54.19 Favored 'General case' 0 N--CA 1.485 1.303 0 C-N-CA 123.72 0.808 . . . . 0.0 112.187 -176.379 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 1.8 pp -80.13 165.85 22.06 Favored 'General case' 0 N--CA 1.479 0.99 0 C-N-CA 122.725 0.41 . . . . 0.0 111.002 175.923 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 92.9 -162.32 26.25 Favored Glycine 0 C--N 1.339 0.729 0 CA-C-N 115.307 -0.861 . . . . 0.0 111.891 -178.877 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 65' ' ' ASN . . . . . 0.446 ' O ' HG23 ' A' ' 69' ' ' VAL . 28.6 t-20 -69.77 122.25 18.83 Favored 'General case' 0 N--CA 1.467 0.401 0 N-CA-C 109.564 -0.532 . . . . 0.0 109.564 -178.921 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 62.6 mt -60.57 -44.6 97.07 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.376 0 C-N-CA 124.19 0.996 . . . . 0.0 111.305 -169.904 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 41.1 mtpt -57.31 -43.07 82.95 Favored 'General case' 0 CA--C 1.548 0.899 0 C-N-CA 124.495 1.118 . . . . 0.0 111.118 177.201 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 68' ' ' ASN . . . . . 0.452 ' O ' ' HG2' ' A' ' 71' ' ' LYS . 5.9 t30 -72.87 -29.86 63.52 Favored 'General case' 0 CA--C 1.55 0.964 0 CA-C-N 115.31 -0.859 . . . . 0.0 111.09 -178.857 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 69' ' ' VAL . . . . . 0.446 HG23 ' O ' ' A' ' 65' ' ' ASN . 57.7 t -72.11 -39.1 64.98 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.058 0 N-CA-C 109.798 -0.445 . . . . 0.0 109.798 173.527 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -71.18 -8.38 53.14 Favored 'General case' 0 N--CA 1.479 1.011 0 C-N-CA 124.145 0.978 . . . . 0.0 112.903 -175.272 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 71' ' ' LYS . . . . . 0.452 ' HG2' ' O ' ' A' ' 68' ' ' ASN . 53.1 pttt -88.38 -19.93 25.97 Favored 'General case' 0 N--CA 1.481 1.089 0 CA-C-N 117.872 0.305 . . . . 0.0 110.51 177.781 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 10.3 t -128.85 -13.76 4.6 Favored 'General case' 0 N--CA 1.478 0.932 0 C-N-CA 123.587 0.755 . . . . 0.0 111.862 -167.716 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -103.81 100.99 10.8 Favored 'General case' 0 N--CA 1.469 0.508 0 N-CA-C 107.514 -1.291 . . . . 0.0 107.514 175.336 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 25.6 p-10 -71.04 174.2 6.56 Favored 'General case' 0 N--CA 1.478 0.965 0 C-N-CA 122.884 0.474 . . . . 0.0 111.113 -173.249 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 75' ' ' LYS . . . . . 0.477 ' O ' HG23 ' A' ' 79' ' ' VAL . 9.2 tptm -64.57 -38.09 89.8 Favored 'General case' 0 CA--C 1.545 0.778 0 C-N-CA 122.598 0.359 . . . . 0.0 110.846 -173.274 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 28.5 m-20 -64.32 -35.8 82.05 Favored 'General case' 0 N--CA 1.48 1.039 0 C-N-CA 123.508 0.723 . . . . 0.0 111.237 178.849 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 77' ' ' HIS . . . . . 0.4 ' HD2' HD23 ' A' ' 78' ' ' LEU . 18.8 t60 -60.62 -42.32 96.63 Favored 'General case' 0 N--CA 1.482 1.15 0 C-N-CA 124.159 0.984 . . . . 0.0 110.503 176.538 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 78' ' ' LEU . . . . . 0.4 HD23 ' HD2' ' A' ' 77' ' ' HIS . 42.2 mt -68.34 -37.31 80.39 Favored 'General case' 0 N--CA 1.473 0.716 0 CA-C-N 115.159 -0.928 . . . . 0.0 111.528 -175.528 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 79' ' ' VAL . . . . . 0.553 ' HA ' HD13 ' A' ' 34' ' ' LEU . 47.2 t -62.89 -49.12 84.9 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.751 0 C-N-CA 124.025 0.93 . . . . 0.0 110.008 175.495 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 70.7 m -60.81 -46.27 91.17 Favored 'General case' 0 CA--C 1.545 0.761 0 CA-C-N 114.293 -1.321 . . . . 0.0 111.681 -179.045 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 81' ' ' ALA . . . . . 0.425 ' HB1' HD11 ' A' ' 62' ' ' LEU . . . -68.84 -43.32 75.73 Favored 'General case' 0 N--CA 1.478 0.975 0 C-N-CA 123.516 0.727 . . . . 0.0 111.443 -177.639 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 82' ' ' TYR . . . . . 0.578 ' CD2' HD11 ' A' ' 34' ' ' LEU . 86.5 t80 -58.64 -55.31 36.77 Favored 'General case' 0 N--CA 1.476 0.853 0 C-N-CA 124.276 1.03 . . . . 0.0 110.408 -179.334 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 83' ' ' ASN . . . . . . . . . . . . . 93.0 m-20 -64.9 -34.7 79.02 Favored 'General case' 0 N--CA 1.477 0.879 0 C-N-CA 123.43 0.692 . . . . 0.0 111.545 -175.992 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 24.5 m170 -72.29 -26.81 62.12 Favored 'General case' 0 N--CA 1.487 1.419 0 C-N-CA 123.225 0.61 . . . . 0.0 112.354 176.965 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 85' ' ' LEU . . . . . 0.5 ' HG ' ' HD2' ' A' ' 91' ' ' PHE . 43.5 tp -57.1 -53.09 61.99 Favored 'General case' 0 N--CA 1.485 1.31 0 CA-C-O 121.935 0.874 . . . . 0.0 110.768 178.223 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 86' ' ' PHE . . . . . 0.425 ' HA ' ' HE2' ' A' ' 91' ' ' PHE . 31.7 m-85 -74.2 -32.23 62.95 Favored 'General case' 0 CA--C 1.54 0.587 0 CA-C-N 113.532 -1.667 . . . . 0.0 110.974 -177.916 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 34.2 tt0 -61.26 -44.86 96.55 Favored 'General case' 0 N--CA 1.48 1.055 0 C-N-CA 123.928 0.891 . . . . 0.0 111.847 -176.2 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 37.4 p -109.59 6.67 24.12 Favored 'General case' 0 CA--C 1.544 0.743 0 C-N-CA 123.644 0.778 . . . . 0.0 111.418 -176.004 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 13.4 mmmm 57.14 35.09 25.82 Favored 'General case' 0 N--CA 1.492 1.629 0 C-N-CA 124.471 1.108 . . . . 0.0 111.504 173.644 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 47.2 mtt-85 -65.74 -24.02 66.86 Favored 'General case' 0 N--CA 1.491 1.624 0 N-CA-C 113.518 0.933 . . . . 0.0 113.518 -172.146 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 91' ' ' PHE . . . . . 0.5 ' HD2' ' HG ' ' A' ' 85' ' ' LEU . 5.5 p90 -57.51 161.56 3.44 Favored 'General case' 0 CA--C 1.551 0.996 0 N-CA-C 114.351 1.241 . . . . 0.0 114.351 -172.946 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 16.3 ptmt . . . . . 0 CA--C 1.562 1.413 0 C-N-CA 126.101 1.76 . . . . 0.0 113.573 -171.198 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.547 0.847 0 CA-C-O 121.391 0.615 . . . . 0.0 111.135 . . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -82.0 -29.72 31.94 Favored 'General case' 0 N--CA 1.473 0.695 0 CA-C-N 115.193 -0.912 . . . . 0.0 108.787 176.439 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 29' ' ' TRP . . . . . . . . . . . . . 4.8 m-90 -134.63 146.51 49.63 Favored 'General case' 0 N--CA 1.464 0.274 0 CA-C-N 114.065 -1.425 . . . . 0.0 108.95 -177.28 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 22.7 p -86.59 175.35 8.36 Favored 'General case' 0 N--CA 1.472 0.641 0 N-CA-C 108.967 -0.753 . . . . 0.0 108.967 170.375 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 31' ' ' VAL . . . . . 0.482 ' HA ' HD12 ' A' ' 34' ' ' LEU . 14.8 p -62.21 -31.92 53.07 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.214 0 C-N-CA 122.693 0.397 . . . . 0.0 111.319 -176.157 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 12.5 pt-20 -70.99 -38.78 72.71 Favored 'General case' 0 N--CA 1.48 1.063 0 C-N-CA 124.003 0.921 . . . . 0.0 111.79 176.681 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 53.1 mt-30 -69.11 -38.15 78.76 Favored 'General case' 0 N--CA 1.477 0.92 0 C-N-CA 122.921 0.488 . . . . 0.0 110.554 176.171 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.482 HD12 ' HA ' ' A' ' 31' ' ' VAL . 87.3 mt -63.48 -50.93 67.75 Favored 'General case' 0 N--CA 1.48 1.062 0 C-N-CA 123.482 0.713 . . . . 0.0 111.171 -178.719 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 35' ' ' ARG . . . . . 0.445 HH21 HG22 ' A' ' 31' ' ' VAL . 18.6 ptp180 -69.89 -12.93 61.99 Favored 'General case' 0 CA--C 1.553 1.067 0 O-C-N 124.18 0.925 . . . . 0.0 111.474 -175.97 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 35.7 t -63.23 118.27 7.73 Favored 'General case' 0 N--CA 1.472 0.635 0 C-N-CA 123.387 0.675 . . . . 0.0 109.219 173.721 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 14.1 pt-20 -64.4 -30.21 71.25 Favored 'General case' 0 CA--C 1.548 0.879 0 C-N-CA 123.376 0.67 . . . . 0.0 111.725 -176.893 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 77.6 mt-30 -66.91 -19.06 65.66 Favored 'General case' 0 N--CA 1.484 1.252 0 C-N-CA 123.652 0.781 . . . . 0.0 111.584 179.942 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 1.8 tt -79.12 116.4 59.91 Favored Pre-proline 0 CA--C 1.551 1.008 0 N-CA-C 106.429 -1.693 . . . . 0.0 106.429 170.795 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 19.2 Cg_endo -58.57 119.97 7.55 Favored 'Trans proline' 0 C--N 1.378 2.085 0 C-N-CA 122.722 2.281 . . . . 0.0 111.62 177.011 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 41' ' ' LYS . . . . . 0.412 ' HE3' ' HB1' ' A' ' 70' ' ' ALA . 58.2 pttt -56.65 -30.48 63.4 Favored 'General case' 0 N--CA 1.48 1.068 0 C-N-CA 125.039 1.335 . . . . 0.0 112.67 -177.987 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 42' ' ' LYS . . . . . 0.433 ' HA ' HD12 ' A' ' 45' ' ' ILE . 22.5 pttp -71.41 -31.96 67.84 Favored 'General case' 0 CA--C 1.545 0.755 0 C-N-CA 123.408 0.683 . . . . 0.0 110.796 -179.486 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -73.28 -25.94 60.88 Favored 'General case' 0 N--CA 1.478 0.926 0 C-N-CA 123.028 0.531 . . . . 0.0 110.814 177.624 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 59.9 mt -67.68 -51.18 53.66 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.93 0 N-CA-C 109.294 -0.632 . . . . 0.0 109.294 171.649 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 45' ' ' ILE . . . . . 0.433 HD12 ' HA ' ' A' ' 42' ' ' LYS . 62.8 mt -54.25 -41.84 53.97 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.694 0 C-N-CA 123.827 0.851 . . . . 0.0 110.41 175.911 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 37.1 ttpt -63.45 -41.65 98.65 Favored 'General case' 0 CA--C 1.543 0.68 0 C-N-CA 124.625 1.17 . . . . 0.0 111.419 -178.089 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 27.4 t80 -66.02 -47.63 73.8 Favored 'General case' 0 N--CA 1.479 0.999 0 CA-C-N 115.794 -0.639 . . . . 0.0 111.015 178.116 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 84.9 mt -70.41 -29.83 66.55 Favored 'General case' 0 N--CA 1.471 0.61 0 C-N-CA 123.883 0.873 . . . . 0.0 111.947 -174.287 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 2.9 pt20 -79.57 -26.61 41.31 Favored 'General case' 0 N--CA 1.484 1.248 0 O-C-N 123.13 0.269 . . . . 0.0 110.482 175.163 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 43.5 tt0 -66.14 -26.98 67.69 Favored 'General case' 0 N--CA 1.482 1.153 0 C-N-CA 123.697 0.799 . . . . 0.0 112.003 -177.332 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 51' ' ' HIS . . . . . 0.471 ' NE2' HD13 ' A' ' 85' ' ' LEU . 47.7 p-80 -126.62 -17.01 5.14 Favored 'General case' 0 N--CA 1.486 1.334 0 N-CA-C 112.952 0.723 . . . . 0.0 112.952 -179.645 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -73.19 142.99 32.45 Favored Glycine 0 N--CA 1.472 1.052 0 CA-C-N 118.132 0.424 . . . . 0.0 112.593 176.247 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 53' ' ' SER . . . . . 0.441 ' O ' ' HG ' ' A' ' 57' ' ' LEU . 32.7 t -76.1 155.18 34.96 Favored 'General case' 0 N--CA 1.48 1.039 0 C-N-CA 123.142 0.577 . . . . 0.0 110.26 177.052 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 22.1 m-20 -63.73 -31.83 73.12 Favored 'General case' 0 N--CA 1.492 1.634 0 C-N-CA 123.204 0.602 . . . . 0.0 112.493 -170.473 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 28.9 t -70.05 -28.26 65.31 Favored 'General case' 0 N--CA 1.474 0.76 0 C-N-CA 123.179 0.592 . . . . 0.0 110.869 179.575 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 82.1 t80 -74.92 -48.97 21.86 Favored 'General case' 0 CA--C 1.545 0.759 0 N-CA-C 109.589 -0.523 . . . . 0.0 109.589 170.102 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 57' ' ' LEU . . . . . 0.441 ' HG ' ' O ' ' A' ' 53' ' ' SER . 79.0 mt -60.07 -46.62 88.96 Favored 'General case' 0 C--O 1.213 -0.839 0 CA-C-N 115.144 -0.934 . . . . 0.0 111.867 -169.965 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -64.63 -44.8 89.35 Favored 'General case' 0 N--CA 1.481 1.105 0 C-N-CA 123.729 0.811 . . . . 0.0 111.704 -177.361 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 19.1 mm-40 -62.03 -21.66 65.08 Favored 'General case' 0 N--CA 1.483 1.204 0 C-N-CA 123.186 0.595 . . . . 0.0 112.192 177.39 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 21.3 m80 -113.95 1.15 14.62 Favored 'General case' 0 N--CA 1.488 1.448 0 C-N-CA 123.611 0.764 . . . . 0.0 111.098 179.083 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 38.4 mtmm 56.99 25.68 10.96 Favored 'General case' 0 N--CA 1.483 1.202 0 C-N-CA 125.47 1.508 . . . . 0.0 113.706 -179.91 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 62' ' ' LEU . . . . . 0.45 HD11 ' HB1' ' A' ' 81' ' ' ALA . 90.0 mt -76.09 -14.77 60.18 Favored 'General case' 0 N--CA 1.477 0.886 0 C-N-CA 123.006 0.523 . . . . 0.0 112.344 -178.597 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 2.0 pp -86.08 174.99 8.8 Favored 'General case' 0 N--CA 1.479 1.013 0 CA-C-O 121.018 0.437 . . . . 0.0 110.946 176.109 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 84.53 -163.35 38.76 Favored Glycine 0 C--N 1.344 0.994 0 CA-C-N 115.481 -0.781 . . . . 0.0 112.384 179.473 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 30.4 m-80 -61.92 110.2 1.48 Allowed 'General case' 0 C--N 1.354 0.767 0 N-CA-C 109.139 -0.689 . . . . 0.0 109.139 176.491 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 66' ' ' ILE . . . . . 0.417 HG22 ' HB2' ' A' ' 42' ' ' LYS . 75.0 mt -61.02 -38.91 80.56 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.702 0 O-C-N 124.119 0.887 . . . . 0.0 110.769 -176.42 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 61.9 pttt -59.31 -36.89 76.44 Favored 'General case' 0 CA--C 1.553 1.084 0 C-N-CA 123.503 0.721 . . . . 0.0 111.271 176.483 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 68' ' ' ASN . . . . . 0.411 ' O ' ' HG2' ' A' ' 71' ' ' LYS . 48.3 t-20 -72.22 -44.5 62.83 Favored 'General case' 0 N--CA 1.478 0.97 0 C-N-CA 123.459 0.704 . . . . 0.0 109.726 179.594 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 69' ' ' VAL . . . . . 0.423 HG12 ' HB2' ' A' ' 73' ' ' ALA . 98.0 t -60.58 -39.03 80.09 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.733 0 CA-C-N 115.707 -0.679 . . . . 0.0 110.49 178.457 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 70' ' ' ALA . . . . . 0.435 ' HA ' ' HB3' ' A' ' 73' ' ' ALA . . . -63.29 -17.25 62.32 Favored 'General case' 0 N--CA 1.478 0.967 0 C-N-CA 124.416 1.086 . . . . 0.0 113.282 -175.215 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 71' ' ' LYS . . . . . 0.411 ' HG2' ' O ' ' A' ' 68' ' ' ASN . 16.1 ptpt -75.61 -22.27 57.02 Favored 'General case' 0 N--CA 1.489 1.521 0 CA-C-N 118.49 0.586 . . . . 0.0 110.91 -178.754 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 13.5 t -122.12 -12.31 8.33 Favored 'General case' 0 CA--C 1.543 0.703 0 C-N-CA 124.169 0.987 . . . . 0.0 110.607 -179.135 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 73' ' ' ALA . . . . . 0.526 ' HB1' HD21 ' A' ' 78' ' ' LEU . . . -77.49 86.19 3.85 Favored 'General case' 0 C--N 1.349 0.552 0 CA-C-O 121.461 0.648 . . . . 0.0 109.67 179.673 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 3.4 p30 -73.12 150.36 42.29 Favored 'General case' 0 C--O 1.24 0.58 0 CA-C-N 114.507 -1.224 . . . . 0.0 108.548 174.838 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 2.1 ttmp? -68.96 -26.66 65.16 Favored 'General case' 0 CA--C 1.544 0.72 0 C-N-CA 123.4 0.68 . . . . 0.0 111.482 -167.125 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 28.4 t70 -62.95 -43.24 99.33 Favored 'General case' 0 N--CA 1.478 0.959 0 C-N-CA 123.555 0.742 . . . . 0.0 110.604 173.868 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 61.0 t60 -61.95 -42.39 99.05 Favored 'General case' 0 N--CA 1.482 1.165 0 C-N-CA 124.404 1.082 . . . . 0.0 110.664 175.857 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 78' ' ' LEU . . . . . 0.526 HD21 ' HB1' ' A' ' 73' ' ' ALA . 96.3 mt -65.1 -38.64 91.37 Favored 'General case' 0 N--CA 1.481 1.083 0 C-N-CA 123.571 0.748 . . . . 0.0 112.196 -175.392 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 98.2 t -69.24 -40.33 80.21 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.942 0 CA-C-N 115.606 -0.724 . . . . 0.0 110.503 176.085 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 57.2 m -62.21 -41.47 98.41 Favored 'General case' 0 N--CA 1.48 1.048 0 C-N-CA 123.273 0.629 . . . . 0.0 111.118 177.31 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 81' ' ' ALA . . . . . 0.45 ' HB1' HD11 ' A' ' 62' ' ' LEU . . . -68.74 -42.19 77.92 Favored 'General case' 0 CA--C 1.543 0.699 0 C-N-CA 123.436 0.694 . . . . 0.0 110.659 178.492 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 82' ' ' TYR . . . . . . . . . . . . . 7.5 t80 -52.08 -55.55 20.02 Favored 'General case' 0 N--CA 1.475 0.802 0 C-N-CA 124.434 1.094 . . . . 0.0 110.542 175.61 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 83' ' ' ASN . . . . . . . . . . . . . 28.9 m-80 -64.37 -45.71 86.54 Favored 'General case' 0 N--CA 1.482 1.153 0 C-N-CA 123.31 0.644 . . . . 0.0 111.594 -175.855 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 23.9 m-70 -62.01 -25.37 67.6 Favored 'General case' 0 N--CA 1.481 1.084 0 C-N-CA 123.484 0.714 . . . . 0.0 111.827 -179.541 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 85' ' ' LEU . . . . . 0.471 HD13 ' NE2' ' A' ' 51' ' ' HIS . 2.9 mt -60.85 -52.36 65.38 Favored 'General case' 0 N--CA 1.476 0.857 0 CA-C-O 120.766 0.317 . . . . 0.0 111.126 173.139 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 60.8 m-85 -72.97 -30.68 64.02 Favored 'General case' 0 CA--C 1.553 1.083 0 CA-C-N 115.475 -0.784 . . . . 0.0 111.092 -176.837 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 37.4 tt0 -48.36 -48.55 36.43 Favored 'General case' 0 N--CA 1.491 1.597 0 C-N-CA 126.055 1.742 . . . . 0.0 113.83 -173.532 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 27.3 p -120.62 -4.04 9.79 Favored 'General case' 0 CA--C 1.538 0.492 0 C-N-CA 124.342 1.057 . . . . 0.0 109.99 -178.71 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 32.1 mtmm 62.23 69.88 0.6 Allowed 'General case' 0 C--N 1.357 0.922 0 C-N-CA 124.402 1.081 . . . . 0.0 109.783 -173.843 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 44.6 mtt85 -86.01 15.02 5.36 Favored 'General case' 0 N--CA 1.489 1.524 0 C-N-CA 125.244 1.417 . . . . 0.0 111.837 175.816 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 91' ' ' PHE . . . . . . . . . . . . . 1.8 m-30 -56.67 160.11 3.51 Favored 'General case' 0 N--CA 1.477 0.901 0 C-N-CA 124.646 1.178 . . . . 0.0 111.331 171.356 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 92' ' ' LYS . . . . . 0.437 ' HE3' ' HA ' ' A' ' 53' ' ' SER . 40.7 ttmt . . . . . 0 C--O 1.249 1.058 0 N-CA-C 108.106 -1.072 . . . . 0.0 108.106 -179.617 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 20' ' ' MET . . . . . . . . . . . . . 37.2 tpp . . . . . 0 N--CA 1.483 1.204 0 CA-C-O 120.441 0.162 . . . . 0.0 110.855 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -69.04 105.07 2.29 Favored 'General case' 0 C--N 1.353 0.76 0 C-N-CA 123.106 0.562 . . . . 0.0 109.597 175.474 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . 62.31 56.63 2.11 Favored 'General case' 0 CA--C 1.548 0.898 0 C-N-CA 124.841 1.256 . . . . 0.0 110.779 -175.84 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -92.11 116.32 28.84 Favored 'General case' 0 N--CA 1.475 0.792 0 CA-C-N 115.371 -0.831 . . . . 0.0 109.512 177.42 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 26.8 m -64.78 145.2 98.89 Favored Pre-proline 0 N--CA 1.481 1.113 0 C-N-CA 123.789 0.836 . . . . 0.0 111.332 -177.862 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 5.8 Cg_exo -74.78 98.42 1.14 Allowed 'Trans proline' 0 C--N 1.373 1.847 0 C-N-CA 123.057 2.505 . . . . 0.0 112.229 -176.541 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 26.3 mt-30 -78.31 117.08 19.21 Favored 'General case' 0 C--O 1.249 1.077 0 N-CA-C 106.614 -1.624 . . . . 0.0 106.614 165.647 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 27' ' ' ARG . . . . . 0.48 ' HD3' ' H ' ' A' ' 27' ' ' ARG . 0.0 OUTLIER -55.21 123.16 12.81 Favored 'General case' 0 CA--C 1.541 0.612 0 O-C-N 123.889 0.743 . . . . 0.0 111.056 -176.717 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -76.24 -37.39 57.74 Favored 'General case' 0 N--CA 1.472 0.627 0 CA-C-N 114.53 -1.214 . . . . 0.0 109.919 -176.859 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 29' ' ' TRP . . . . . . . . . . . . . 2.5 m-90 -120.94 148.13 44.5 Favored 'General case' 0 N--CA 1.471 0.6 0 CA-C-N 114.932 -1.031 . . . . 0.0 109.1 -177.279 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 76.3 p -87.18 175.33 8.11 Favored 'General case' 0 CA--C 1.54 0.596 0 C-N-CA 123.073 0.549 . . . . 0.0 110.006 176.167 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 31' ' ' VAL . . . . . 0.436 HG12 ' HE ' ' A' ' 35' ' ' ARG . 51.8 t -55.87 -46.26 80.07 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.052 0 C-N-CA 123.687 0.795 . . . . 0.0 111.484 -178.732 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 12.7 pt-20 -66.94 -41.51 86.87 Favored 'General case' 0 N--CA 1.475 0.782 0 C-N-CA 123.335 0.654 . . . . 0.0 111.403 -179.245 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 55.3 mt-30 -60.17 -36.52 77.76 Favored 'General case' 0 N--CA 1.479 0.995 0 C-N-CA 123.196 0.598 . . . . 0.0 110.974 178.329 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 85.0 mt -70.19 -51.43 31.1 Favored 'General case' 0 N--CA 1.469 0.497 0 C-N-CA 122.74 0.416 . . . . 0.0 110.427 178.864 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 35' ' ' ARG . . . . . 0.436 ' HE ' HG12 ' A' ' 31' ' ' VAL . 50.5 mtm180 -57.27 -28.45 62.99 Favored 'General case' 0 N--CA 1.484 1.251 0 C-N-CA 123.913 0.885 . . . . 0.0 111.755 -179.371 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 44.6 t -53.93 122.19 9.56 Favored 'General case' 0 CA--C 1.541 0.619 0 C-N-CA 124.262 1.025 . . . . 0.0 110.941 174.848 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 10.9 pt-20 -71.14 -8.82 56.07 Favored 'General case' 0 CA--C 1.549 0.939 0 C-N-CA 123.973 0.909 . . . . 0.0 111.482 179.038 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 95.7 mt-30 -65.89 -47.92 73.2 Favored 'General case' 0 N--CA 1.472 0.667 0 C-N-CA 123.914 0.886 . . . . 0.0 109.712 168.753 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 3.8 tt -76.89 116.92 61.25 Favored Pre-proline 0 CA--C 1.553 1.085 0 N-CA-C 108.126 -1.065 . . . . 0.0 108.126 179.509 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 32.4 Cg_exo -61.63 165.45 13.58 Favored 'Trans proline' 0 C--N 1.38 2.187 0 C-N-CA 123.479 2.786 . . . . 0.0 114.126 176.763 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 36.6 mtmm -81.54 -25.94 35.48 Favored 'General case' 0 N--CA 1.475 0.82 0 CA-C-N 115.722 -0.672 . . . . 0.0 111.004 179.536 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 18.5 ptpt -64.77 -48.11 75.68 Favored 'General case' 0 CA--C 1.547 0.865 0 C-N-CA 123.524 0.73 . . . . 0.0 112.797 -171.394 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 13.6 p-10 -73.28 -23.65 60.33 Favored 'General case' 0 N--CA 1.478 0.936 0 C-N-CA 122.666 0.386 . . . . 0.0 111.852 -176.794 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 54.2 mt -66.89 -52.69 41.76 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.084 0 C-N-CA 123.071 0.549 . . . . 0.0 110.1 171.496 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 80.3 mt -60.13 -34.73 57.92 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.17 0 C-N-CA 123.132 0.573 . . . . 0.0 110.416 177.545 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 2.7 tmtp? -59.77 -50.29 74.41 Favored 'General case' 0 N--CA 1.474 0.761 0 C-N-CA 123.714 0.806 . . . . 0.0 109.075 175.498 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 24.0 t80 -58.77 -45.16 90.39 Favored 'General case' 0 N--CA 1.485 1.319 0 C-N-CA 124.035 0.934 . . . . 0.0 111.627 179.978 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 48' ' ' LEU . . . . . 0.486 ' HB3' ' HE2' ' A' ' 56' ' ' PHE . 92.4 mt -72.01 -32.3 67.05 Favored 'General case' 0 CA--C 1.545 0.782 0 CA-C-N 115.277 -0.874 . . . . 0.0 111.816 -175.879 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 49' ' ' GLN . . . . . 0.559 ' HA ' HD21 ' A' ' 57' ' ' LEU . 3.0 pt20 -85.53 -23.86 27.52 Favored 'General case' 0 N--CA 1.491 1.594 0 C-N-CA 122.724 0.41 . . . . 0.0 112.013 175.051 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 8.5 tp10 -58.36 -39.04 78.47 Favored 'General case' 0 N--CA 1.482 1.165 0 C-N-CA 124.458 1.103 . . . . 0.0 111.24 -179.759 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 2.0 m80 -132.59 -30.23 1.47 Allowed 'General case' 0 N--CA 1.479 0.98 0 CA-C-O 119.034 -0.508 . . . . 0.0 112.169 -175.004 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -59.31 120.16 21.41 Favored Glycine 0 N--CA 1.478 1.434 0 CA-C-O 119.489 -0.617 . . . . 0.0 111.949 175.758 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 22.8 t -70.97 176.44 4.35 Favored 'General case' 0 N--CA 1.484 1.246 0 C-N-CA 123.607 0.763 . . . . 0.0 112.17 -171.251 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 5.6 p-10 -58.57 -36.49 74.02 Favored 'General case' 0 N--CA 1.48 1.056 0 C-N-CA 124.292 1.037 . . . . 0.0 113.429 -168.16 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 27.8 t -69.38 -40.7 77.26 Favored 'General case' 0 N--CA 1.476 0.827 0 C-N-CA 122.839 0.456 . . . . 0.0 110.096 -178.998 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 56' ' ' PHE . . . . . 0.64 ' HB2' ' HB3' ' A' ' 90' ' ' ARG . 65.7 t80 -59.69 -49.29 78.33 Favored 'General case' 0 N--CA 1.477 0.906 0 CA-C-O 121.378 0.609 . . . . 0.0 110.368 175.454 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 57' ' ' LEU . . . . . 0.559 HD21 ' HA ' ' A' ' 49' ' ' GLN . 68.7 mt -67.71 -31.78 71.96 Favored 'General case' 0 C--O 1.221 -0.424 0 CA-C-N 114.626 -1.17 . . . . 0.0 112.082 -176.128 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -73.68 -49.97 23.2 Favored 'General case' 0 N--CA 1.478 0.943 0 C-N-CA 122.798 0.439 . . . . 0.0 111.647 179.345 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 43.6 mt-10 -67.17 -36.59 82.12 Favored 'General case' 0 N--CA 1.485 1.301 0 C-N-CA 123.58 0.752 . . . . 0.0 111.612 -177.782 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 42.6 m-70 -98.77 -4.96 32.22 Favored 'General case' 0 N--CA 1.478 0.972 0 C-N-CA 123.122 0.569 . . . . 0.0 111.892 -177.85 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 62.9 mttp 58.56 41.35 22.54 Favored 'General case' 0 N--CA 1.496 1.849 0 C-N-CA 124.482 1.113 . . . . 0.0 112.641 175.736 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 85.1 mt -102.73 0.94 33.72 Favored 'General case' 0 N--CA 1.479 1.0 0 C-N-CA 123.592 0.757 . . . . 0.0 111.487 -178.749 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 63' ' ' LEU . . . . . 0.433 ' HB3' ' HB3' ' A' ' 57' ' ' LEU . 1.1 pp -77.07 160.73 28.85 Favored 'General case' 0 N--CA 1.483 1.206 0 C-N-CA 122.95 0.5 . . . . 0.0 111.369 174.651 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 89.28 -158.67 27.99 Favored Glycine 0 C--N 1.338 0.666 0 CA-C-N 115.167 -0.924 . . . . 0.0 112.942 173.79 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 36.8 m-80 -61.91 118.3 7.05 Favored 'General case' 0 CA--C 1.539 0.541 0 C-N-CA 123.573 0.749 . . . . 0.0 110.423 179.957 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 84.4 mt -50.05 -51.89 15.7 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.117 0 C-N-CA 124.136 0.975 . . . . 0.0 111.398 -177.617 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 67' ' ' LYS . . . . . 0.44 ' HD3' ' H ' ' A' ' 67' ' ' LYS . 0.0 OUTLIER -61.76 -38.55 88.44 Favored 'General case' 0 CA--C 1.552 1.047 0 C-N-CA 123.47 0.708 . . . . 0.0 112.148 -178.399 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 23.9 t-20 -61.54 -38.34 87.06 Favored 'General case' 0 N--CA 1.485 1.311 0 C-N-CA 123.411 0.684 . . . . 0.0 110.777 175.841 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 99.2 t -73.5 -39.72 54.75 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.786 0 CA-C-N 115.183 -0.917 . . . . 0.0 110.355 175.141 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -69.35 -26.71 64.82 Favored 'General case' 0 N--CA 1.484 1.232 0 C-N-CA 124.388 1.075 . . . . 0.0 112.589 -171.902 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 22.1 ptmt -76.82 -17.13 59.2 Favored 'General case' 0 N--CA 1.477 0.91 0 C-N-CA 122.425 0.29 . . . . 0.0 111.523 -179.94 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 9.1 t -120.98 2.29 10.46 Favored 'General case' 0 CA--C 1.55 0.966 0 C-N-CA 123.94 0.896 . . . . 0.0 110.452 177.801 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 73' ' ' ALA . . . . . 0.423 ' HB1' HD21 ' A' ' 78' ' ' LEU . . . -91.95 121.16 33.28 Favored 'General case' 0 N--CA 1.47 0.55 0 C-N-CA 123.148 0.579 . . . . 0.0 109.932 175.063 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 12.5 p-10 -93.42 145.92 24.13 Favored 'General case' 0 N--CA 1.473 0.678 0 N-CA-C 108.493 -0.929 . . . . 0.0 108.493 168.829 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 4.6 tppp? -59.64 -42.3 92.45 Favored 'General case' 0 N--CA 1.477 0.88 0 C-N-CA 123.842 0.857 . . . . 0.0 112.143 -169.839 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 6.2 p-10 -64.5 -32.45 74.08 Favored 'General case' 0 N--CA 1.477 0.893 0 C-N-CA 123.265 0.626 . . . . 0.0 111.833 -177.102 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 47.5 t60 -68.37 -34.91 76.91 Favored 'General case' 0 N--CA 1.487 1.376 0 C-N-CA 123.484 0.713 . . . . 0.0 110.465 174.046 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 78' ' ' LEU . . . . . 0.423 HD21 ' HB1' ' A' ' 73' ' ' ALA . 84.4 mt -70.23 -35.33 73.79 Favored 'General case' 0 N--CA 1.479 0.977 0 C-N-CA 122.892 0.477 . . . . 0.0 111.465 -179.174 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 53.4 t -71.71 -37.95 64.54 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.788 0 O-C-N 124.084 0.865 . . . . 0.0 110.045 176.748 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 63.6 m -61.49 -47.17 86.87 Favored 'General case' 0 CA--C 1.545 0.756 0 CA-C-N 115.625 -0.716 . . . . 0.0 110.265 173.216 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -63.48 -41.63 98.58 Favored 'General case' 0 N--CA 1.476 0.825 0 C-N-CA 123.606 0.762 . . . . 0.0 110.951 -179.608 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 82' ' ' TYR . . . . . . . . . . . . . 7.8 t80 -55.77 -55.49 31.72 Favored 'General case' 0 CA--C 1.543 0.711 0 C-N-CA 124.954 1.302 . . . . 0.0 111.11 175.964 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 83' ' ' ASN . . . . . . . . . . . . . 70.7 m-20 -65.17 -41.09 94.98 Favored 'General case' 0 N--CA 1.486 1.36 0 C-N-CA 123.302 0.641 . . . . 0.0 111.683 -175.924 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 22.2 m-70 -68.79 -25.58 64.77 Favored 'General case' 0 N--CA 1.479 0.979 0 C-N-CA 123.878 0.871 . . . . 0.0 111.567 178.171 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 85' ' ' LEU . . . . . 0.519 ' HG ' ' HD2' ' A' ' 91' ' ' PHE . 51.2 tp -57.57 -53.95 52.42 Favored 'General case' 0 N--CA 1.487 1.405 0 CA-C-O 121.831 0.824 . . . . 0.0 111.069 178.872 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 43.4 m-85 -73.11 -30.9 63.97 Favored 'General case' 0 CA--C 1.538 0.506 0 CA-C-N 113.787 -1.551 . . . . 0.0 110.889 -177.174 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 44.9 tt0 -66.51 -30.33 70.62 Favored 'General case' 0 CA--C 1.548 0.871 0 C-N-CA 124.141 0.976 . . . . 0.0 111.774 -176.221 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 11.6 p -116.98 2.58 12.74 Favored 'General case' 0 N--CA 1.48 1.071 0 C-N-CA 123.421 0.688 . . . . 0.0 111.618 179.153 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 27.2 mtpp 58.21 30.97 20.2 Favored 'General case' 0 N--CA 1.485 1.285 0 C-N-CA 123.92 0.888 . . . . 0.0 111.815 177.461 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 90' ' ' ARG . . . . . 0.64 ' HB3' ' HB2' ' A' ' 56' ' ' PHE . 53.2 mtt85 -62.8 -12.36 23.88 Favored 'General case' 0 N--CA 1.489 1.513 0 C-N-CA 124.14 0.976 . . . . 0.0 113.095 -175.748 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 91' ' ' PHE . . . . . 0.519 ' HD2' ' HG ' ' A' ' 85' ' ' LEU . 6.9 p90 -77.15 161.66 28.05 Favored 'General case' 0 CA--C 1.542 0.644 0 C-N-CA 123.462 0.705 . . . . 0.0 112.046 174.997 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 19.4 ptmt . . . . . 0 CA--C 1.557 1.218 0 N-CA-C 108.127 -1.064 . . . . 0.0 108.127 169.047 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 20' ' ' MET . . . . . . . . . . . . . 85.6 mtp . . . . . 0 N--CA 1.478 0.951 0 N-CA-C 109.703 -0.48 . . . . 0.0 109.703 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -70.67 93.57 0.94 Allowed 'General case' 0 N--CA 1.473 0.695 0 N-CA-C 108.453 -0.943 . . . . 0.0 108.453 173.877 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -83.75 106.21 15.27 Favored 'General case' 0 C--O 1.239 0.511 0 C-N-CA 123.75 0.82 . . . . 0.0 110.83 -175.544 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -73.3 101.48 3.42 Favored 'General case' 0 N--CA 1.471 0.596 0 C-N-CA 123.092 0.557 . . . . 0.0 109.557 174.85 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 9.2 m -93.25 109.07 37.74 Favored Pre-proline 0 CA--C 1.548 0.899 0 C-N-CA 122.855 0.462 . . . . 0.0 109.835 177.117 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 25' ' ' PRO . . . . . 0.43 ' HB2' ' HE1' ' A' ' 86' ' ' PHE . 11.2 Cg_exo -71.51 101.22 1.12 Allowed 'Trans proline' 0 C--N 1.373 1.852 0 C-N-CA 122.942 2.428 . . . . 0.0 110.606 175.787 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 12.0 pt20 -77.37 125.51 29.44 Favored 'General case' 0 C--O 1.24 0.568 0 N-CA-C 108.118 -1.067 . . . . 0.0 108.118 173.868 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 38.0 ttp180 -65.04 107.55 1.55 Allowed 'General case' 0 CA--C 1.537 0.473 0 N-CA-C 109.279 -0.638 . . . . 0.0 109.279 176.405 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -93.83 -15.95 24.58 Favored 'General case' 0 N--CA 1.47 0.53 0 CA-C-N 114.485 -1.234 . . . . 0.0 110.847 -174.898 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 29' ' ' TRP . . . . . . . . . . . . . 4.1 m0 -130.57 132.31 45.48 Favored 'General case' 0 N--CA 1.466 0.357 0 C-N-CA 123.791 0.836 . . . . 0.0 108.9 -174.062 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 64.7 p -80.4 174.1 11.94 Favored 'General case' 0 C--O 1.245 0.844 0 N-CA-C 108.912 -0.773 . . . . 0.0 108.912 167.927 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 31' ' ' VAL . . . . . 0.433 ' HA ' HD12 ' A' ' 34' ' ' LEU . 13.5 p -57.35 -35.38 48.97 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.262 0 C-N-CA 122.565 0.346 . . . . 0.0 111.38 -174.724 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 14.8 pt-20 -73.73 -37.75 65.0 Favored 'General case' 0 CA--C 1.551 0.99 0 C-N-CA 123.963 0.905 . . . . 0.0 111.635 178.879 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 33' ' ' GLN . . . . . 0.413 ' O ' HD13 ' A' ' 39' ' ' LEU . 15.4 mm100 -67.49 -33.49 75.22 Favored 'General case' 0 N--CA 1.479 1.014 0 C-N-CA 123.311 0.644 . . . . 0.0 110.666 179.998 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.509 HD11 ' CD2' ' A' ' 82' ' ' TYR . 83.2 mt -59.02 -48.83 80.16 Favored 'General case' 0 N--CA 1.473 0.721 0 N-CA-C 109.256 -0.646 . . . . 0.0 109.256 171.738 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 29.6 mtp180 -68.09 -12.93 61.74 Favored 'General case' 0 N--CA 1.487 1.422 0 CA-C-N 114.638 -1.164 . . . . 0.0 113.221 -176.949 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 46.1 t -56.85 117.64 4.14 Favored 'General case' 0 N--CA 1.48 1.032 0 C-N-CA 123.67 0.788 . . . . 0.0 109.929 176.784 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 12.4 pt-20 -65.58 -33.93 77.06 Favored 'General case' 0 N--CA 1.48 1.044 0 C-N-CA 123.427 0.691 . . . . 0.0 112.06 -172.248 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 18.0 mm-40 -74.07 -22.53 59.49 Favored 'General case' 0 N--CA 1.471 0.597 0 C-N-CA 123.309 0.643 . . . . 0.0 111.19 179.65 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.413 HD13 ' O ' ' A' ' 33' ' ' GLN . 5.3 tt -76.2 116.97 60.77 Favored Pre-proline 0 CA--C 1.545 0.781 0 N-CA-C 107.281 -1.377 . . . . 0.0 107.281 171.002 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 17.9 Cg_exo -66.62 136.14 41.4 Favored 'Trans proline' 0 C--N 1.375 1.963 0 C-N-CA 122.831 2.354 . . . . 0.0 111.831 -177.895 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 41' ' ' LYS . . . . . 0.404 ' HB2' ' CD1' ' A' ' 78' ' ' LEU . 16.7 ptpt -64.72 -33.4 75.87 Favored 'General case' 0 CA--C 1.548 0.899 0 C-N-CA 122.963 0.505 . . . . 0.0 110.036 177.365 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 55.0 pttt -71.19 -27.06 63.24 Favored 'General case' 0 N--CA 1.478 0.956 0 C-N-CA 123.946 0.898 . . . . 0.0 111.356 179.912 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 14.9 t70 -63.34 -36.72 84.65 Favored 'General case' 0 CA--C 1.552 1.022 0 C-N-CA 122.97 0.508 . . . . 0.0 109.702 172.561 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 42.8 mt -73.28 -47.17 47.66 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.923 0 C-N-CA 123.902 0.881 . . . . 0.0 110.183 177.818 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 82.7 mt -56.82 -39.53 65.12 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.707 0 C-N-CA 123.553 0.741 . . . . 0.0 110.953 178.973 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 37.8 ttmt -62.96 -44.52 95.84 Favored 'General case' 0 N--CA 1.476 0.865 0 C-N-CA 123.254 0.622 . . . . 0.0 110.679 178.702 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 22.8 t80 -59.34 -46.39 88.74 Favored 'General case' 0 N--CA 1.478 0.951 0 CA-C-N 115.269 -0.878 . . . . 0.0 110.42 177.274 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 48' ' ' LEU . . . . . 0.407 ' HB3' ' HE2' ' A' ' 56' ' ' PHE . 96.6 mt -72.47 -30.76 64.84 Favored 'General case' 0 CA--C 1.539 0.555 0 CA-C-N 114.625 -1.171 . . . . 0.0 112.212 -175.187 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 49' ' ' GLN . . . . . 0.542 ' HA ' HD21 ' A' ' 57' ' ' LEU . 3.0 pt20 -84.08 -34.24 24.21 Favored 'General case' 0 N--CA 1.483 1.176 0 CA-C-N 117.895 0.316 . . . . 0.0 111.42 179.796 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 43.0 tt0 -67.89 -39.67 83.63 Favored 'General case' 0 N--CA 1.48 1.056 0 CA-C-O 121.403 0.621 . . . . 0.0 110.569 -179.913 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 51' ' ' HIS . . . . . 0.408 ' HB3' ' HG3' ' A' ' 25' ' ' PRO . 76.7 m80 -96.37 -49.8 5.03 Favored 'General case' 0 N--CA 1.469 0.503 0 CA-C-N 114.865 -1.061 . . . . 0.0 111.297 -175.584 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 52' ' ' GLY . . . . . 0.542 ' HA2' ' HA ' ' A' ' 91' ' ' PHE . . . -60.77 141.31 48.1 Favored Glycine 0 C--N 1.345 1.063 0 O-C-N 123.396 0.435 . . . . 0.0 113.698 178.505 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 16.8 t -88.54 174.03 8.31 Favored 'General case' 0 N--CA 1.479 1.016 0 C-N-CA 122.737 0.415 . . . . 0.0 111.296 -176.842 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 3.2 m-20 -48.29 -45.43 34.78 Favored 'General case' 0 N--CA 1.489 1.477 0 C-N-CA 125.839 1.656 . . . . 0.0 113.831 -170.187 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 42.0 t -66.35 -43.09 87.03 Favored 'General case' 0 N--CA 1.478 0.975 0 C-N-CA 123.402 0.681 . . . . 0.0 110.855 -178.386 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 56' ' ' PHE . . . . . 0.543 ' HB2' ' HB3' ' A' ' 90' ' ' ARG . 85.1 t80 -62.08 -40.2 95.01 Favored 'General case' 0 N--CA 1.48 1.037 0 C-N-CA 123.324 0.65 . . . . 0.0 110.316 176.499 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 57' ' ' LEU . . . . . 0.542 HD21 ' HA ' ' A' ' 49' ' ' GLN . 32.0 mt -73.01 -35.68 66.86 Favored 'General case' 0 C--O 1.218 -0.591 0 CA-C-N 115.095 -0.957 . . . . 0.0 111.906 -175.532 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -73.54 -49.32 27.07 Favored 'General case' 0 N--CA 1.473 0.69 0 C-N-CA 122.64 0.376 . . . . 0.0 110.785 179.416 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 27.2 mm-40 -55.15 -36.89 66.29 Favored 'General case' 0 N--CA 1.481 1.114 0 C-N-CA 123.756 0.822 . . . . 0.0 112.253 178.586 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 57.9 m80 -108.11 1.5 22.33 Favored 'General case' 0 CA--C 1.55 0.978 0 C-N-CA 123.022 0.529 . . . . 0.0 112.338 -177.117 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 57.4 mtpt 54.93 35.31 24.19 Favored 'General case' 0 N--CA 1.496 1.857 0 C-N-CA 124.405 1.082 . . . . 0.0 112.796 177.375 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 0.441 ' HA ' HG11 ' A' ' 69' ' ' VAL . 92.3 mt -90.13 -6.62 55.19 Favored 'General case' 0 N--CA 1.482 1.133 0 C-N-CA 123.483 0.713 . . . . 0.0 111.931 -176.319 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 63' ' ' LEU . . . . . 0.418 ' H ' ' HG ' ' A' ' 63' ' ' LEU . 1.2 pp -73.51 162.65 29.03 Favored 'General case' 0 N--CA 1.481 1.079 0 C-N-CA 123.749 0.82 . . . . 0.0 111.75 179.146 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 81.23 -148.26 28.05 Favored Glycine 0 CA--C 1.528 0.864 0 CA-C-N 115.353 -0.84 . . . . 0.0 113.613 174.614 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 4.0 m-20 -68.0 113.96 6.13 Favored 'General case' 0 N--CA 1.478 0.949 0 C-N-CA 123.269 0.628 . . . . 0.0 109.505 -178.465 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 41.4 mt -55.02 -45.33 76.75 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.874 0 O-C-N 124.822 1.326 . . . . 0.0 110.968 -177.063 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 62.6 pttt -60.71 -37.44 81.69 Favored 'General case' 0 CA--C 1.554 1.114 0 C-N-CA 123.994 0.917 . . . . 0.0 111.93 179.459 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 68' ' ' ASN . . . . . 0.404 ' O ' ' HG2' ' A' ' 71' ' ' LYS . 61.5 t30 -72.75 -36.68 67.75 Favored 'General case' 0 N--CA 1.48 1.056 0 C-N-CA 123.376 0.67 . . . . 0.0 110.456 179.485 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 69' ' ' VAL . . . . . 0.441 HG11 ' HA ' ' A' ' 62' ' ' LEU . 57.8 t -66.25 -36.4 77.31 Favored 'Isoleucine or valine' 0 C--O 1.214 -0.789 0 CA-C-N 115.562 -0.745 . . . . 0.0 109.621 173.017 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -67.52 -15.42 63.65 Favored 'General case' 0 N--CA 1.478 0.962 0 C-N-CA 123.963 0.905 . . . . 0.0 113.349 -174.317 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 71' ' ' LYS . . . . . 0.404 ' HG2' ' O ' ' A' ' 68' ' ' ASN . 21.2 ptmt -94.65 -19.99 19.95 Favored 'General case' 0 N--CA 1.481 1.077 0 O-C-N 121.617 -0.677 . . . . 0.0 111.872 177.691 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 9.0 t -112.84 -15.07 12.99 Favored 'General case' 0 N--CA 1.484 1.23 0 C-N-CA 123.155 0.582 . . . . 0.0 111.716 -176.574 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -110.91 101.56 10.13 Favored 'General case' 0 C--O 1.24 0.56 0 C-N-CA 124.139 0.976 . . . . 0.0 108.41 178.892 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 26.1 p-10 -72.06 160.76 31.93 Favored 'General case' 0 CA--C 1.534 0.353 0 CA-C-N 116.242 -0.436 . . . . 0.0 110.277 177.009 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 75' ' ' LYS . . . . . 0.461 ' HD3' ' O ' ' A' ' 34' ' ' LEU . 36.8 ttmt -63.84 -33.28 75.34 Favored 'General case' 0 CA--C 1.543 0.704 0 C-N-CA 123.549 0.74 . . . . 0.0 111.708 -173.883 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 21.6 t70 -62.81 -33.18 74.69 Favored 'General case' 0 N--CA 1.485 1.321 0 C-N-CA 123.638 0.775 . . . . 0.0 110.857 178.985 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 40.9 t60 -70.63 -36.89 73.7 Favored 'General case' 0 N--CA 1.477 0.912 0 C-N-CA 124.603 1.161 . . . . 0.0 110.468 174.499 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 78' ' ' LEU . . . . . 0.404 ' CD1' ' HB2' ' A' ' 41' ' ' LYS . 60.8 mt -71.03 -31.24 67.67 Favored 'General case' 0 N--CA 1.483 1.179 0 C-N-CA 123.137 0.575 . . . . 0.0 111.577 -177.561 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 79' ' ' VAL . . . . . 0.42 HG23 ' O ' ' A' ' 75' ' ' LYS . 99.5 t -64.03 -44.27 97.74 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.759 0 O-C-N 123.959 0.787 . . . . 0.0 109.355 173.641 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 24.6 m -61.62 -42.79 99.38 Favored 'General case' 0 N--CA 1.474 0.746 0 CA-C-N 115.16 -0.927 . . . . 0.0 110.982 176.304 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -67.4 -39.97 85.58 Favored 'General case' 0 N--CA 1.473 0.698 0 C-N-CA 123.085 0.554 . . . . 0.0 111.04 178.271 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 82' ' ' TYR . . . . . 0.509 ' CD2' HD11 ' A' ' 34' ' ' LEU . 64.5 t80 -62.96 -56.97 12.46 Favored 'General case' 0 N--CA 1.472 0.658 0 C-N-CA 124.047 0.939 . . . . 0.0 110.419 -175.363 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 83' ' ' ASN . . . . . . . . . . . . . 27.8 m-80 -62.83 -40.69 98.2 Favored 'General case' 0 N--CA 1.482 1.141 0 C-N-CA 123.293 0.637 . . . . 0.0 111.25 -176.129 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 84' ' ' HIS . . . . . 0.409 ' HA ' ' HB3' ' A' ' 87' ' ' GLU . 13.2 m170 -70.08 -25.49 63.55 Favored 'General case' 0 N--CA 1.481 1.114 0 C-N-CA 123.773 0.829 . . . . 0.0 111.954 -179.465 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 85' ' ' LEU . . . . . 0.426 ' HG ' ' HD2' ' A' ' 91' ' ' PHE . 57.7 tp -56.71 -54.22 48.68 Favored 'General case' 0 N--CA 1.486 1.359 0 CA-C-O 121.912 0.863 . . . . 0.0 110.763 178.809 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 86' ' ' PHE . . . . . 0.43 ' HE1' ' HB2' ' A' ' 25' ' ' PRO . 20.1 m-85 -73.88 -32.06 63.43 Favored 'General case' 0 CA--C 1.554 1.114 0 CA-C-N 113.483 -1.689 . . . . 0.0 110.16 -178.605 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 87' ' ' GLU . . . . . 0.409 ' HB3' ' HA ' ' A' ' 84' ' ' HIS . 9.7 tp10 -68.85 -23.33 64.23 Favored 'General case' 0 N--CA 1.485 1.292 0 C-N-CA 124.718 1.207 . . . . 0.0 112.285 -174.352 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 19.9 p -128.39 5.24 5.71 Favored 'General case' 0 N--CA 1.487 1.415 0 C-N-CA 123.289 0.636 . . . . 0.0 111.867 179.694 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 14.3 mmmm 60.6 29.71 19.21 Favored 'General case' 0 N--CA 1.487 1.408 0 C-N-CA 124.109 0.964 . . . . 0.0 111.869 175.665 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 90' ' ' ARG . . . . . 0.543 ' HB3' ' HB2' ' A' ' 56' ' ' PHE . 52.2 mtt85 -66.81 -11.19 54.42 Favored 'General case' 0 N--CA 1.496 1.838 0 N-CA-C 114.403 1.26 . . . . 0.0 114.403 -171.079 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 91' ' ' PHE . . . . . 0.542 ' HA ' ' HA2' ' A' ' 52' ' ' GLY . 16.6 p90 -67.74 138.44 56.24 Favored 'General case' 0 CA--C 1.54 0.573 0 N-CA-C 112.484 0.55 . . . . 0.0 112.484 176.852 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 3.8 tmtp? . . . . . 0 CA--C 1.552 1.048 0 C-N-CA 125.153 1.381 . . . . 0.0 109.639 -178.796 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 20' ' ' MET . . . . . . . . . . . . . 23.2 ptt? . . . . . 0 N--CA 1.483 1.203 0 CA-C-O 120.602 0.239 . . . . 0.0 110.746 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -166.64 142.17 4.44 Favored 'General case' 0 N--CA 1.473 0.707 0 C-N-CA 124.355 1.062 . . . . 0.0 108.768 179.279 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . 58.82 37.26 24.92 Favored 'General case' 0 N--CA 1.483 1.179 0 C-N-CA 123.916 0.887 . . . . 0.0 110.771 -175.993 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -86.72 40.76 0.92 Allowed 'General case' 0 N--CA 1.48 1.028 0 C-N-CA 124.123 0.969 . . . . 0.0 110.957 -176.252 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 15.7 m -87.86 153.68 52.38 Favored Pre-proline 0 CA--C 1.547 0.842 0 C-N-CA 124.271 1.028 . . . . 0.0 109.452 179.348 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 96.2 Cg_endo -80.13 112.49 2.82 Favored 'Trans proline' 0 C--N 1.362 1.288 0 C-N-CA 122.366 2.044 . . . . 0.0 111.602 175.209 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 11.0 pt20 -85.57 119.44 25.92 Favored 'General case' 0 C--O 1.242 0.68 0 N-CA-C 105.97 -1.863 . . . . 0.0 105.97 164.769 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -57.85 125.68 24.1 Favored 'General case' 0 C--N 1.353 0.734 0 CA-C-O 122.002 0.906 . . . . 0.0 111.592 -168.892 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -84.36 -21.25 30.96 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 114.28 -1.327 . . . . 0.0 110.118 -178.691 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 29' ' ' TRP . . . . . . . . . . . . . 4.5 m-90 -140.94 147.6 39.06 Favored 'General case' 0 N--CA 1.476 0.833 0 C-N-CA 124.439 1.096 . . . . 0.0 109.614 -176.297 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 36.3 p -83.02 174.29 11.01 Favored 'General case' 0 N--CA 1.476 0.857 0 N-CA-C 109.629 -0.508 . . . . 0.0 109.629 169.098 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 31' ' ' VAL . . . . . 0.584 HG13 HG11 ' A' ' 79' ' ' VAL . 45.5 t -52.26 -45.52 43.85 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.022 0 C-N-CA 123.821 0.848 . . . . 0.0 111.743 179.781 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -66.31 -42.81 87.75 Favored 'General case' 0 N--CA 1.48 1.059 0 C-N-CA 123.238 0.615 . . . . 0.0 111.395 179.051 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 15.7 mm-40 -64.7 -29.07 70.06 Favored 'General case' 0 N--CA 1.482 1.146 0 C-N-CA 123.253 0.621 . . . . 0.0 110.94 179.883 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.449 ' HA ' HD23 ' A' ' 39' ' ' LEU . 79.0 mt -69.53 -53.67 17.9 Favored 'General case' 0 N--CA 1.469 0.522 0 C-N-CA 123.129 0.572 . . . . 0.0 109.772 172.984 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 35' ' ' ARG . . . . . 0.406 ' HG3' ' O ' ' A' ' 31' ' ' VAL . 83.0 mtp180 -65.05 -15.15 62.02 Favored 'General case' 0 N--CA 1.485 1.321 0 C-N-CA 123.937 0.895 . . . . 0.0 112.125 -173.706 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 47.8 t -59.72 117.65 5.21 Favored 'General case' 0 CA--C 1.54 0.587 0 N-CA-C 109.29 -0.633 . . . . 0.0 109.29 169.61 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 11.5 pt-20 -65.65 -16.29 63.59 Favored 'General case' 0 N--CA 1.477 0.884 0 C-N-CA 124.3 1.04 . . . . 0.0 111.893 178.954 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 12.7 mm100 -68.64 -25.68 64.95 Favored 'General case' 0 CA--C 1.545 0.753 0 C-N-CA 123.945 0.898 . . . . 0.0 110.639 173.822 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.449 HD23 ' HA ' ' A' ' 34' ' ' LEU . 26.0 tp -88.65 117.77 68.67 Favored Pre-proline 0 CA--C 1.545 0.755 0 N-CA-C 108.252 -1.018 . . . . 0.0 108.252 171.082 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 34.6 Cg_exo -62.08 143.35 94.73 Favored 'Trans proline' 0 C--N 1.374 1.892 0 C-N-CA 122.776 2.318 . . . . 0.0 112.571 177.522 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 54.3 mtmt -60.61 -36.65 79.1 Favored 'General case' 0 N--CA 1.471 0.613 0 CA-C-N 115.538 -0.756 . . . . 0.0 110.693 174.915 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 61.5 pttt -65.51 -33.98 77.19 Favored 'General case' 0 N--CA 1.473 0.698 0 C-N-CA 123.34 0.656 . . . . 0.0 111.152 178.878 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 27.9 t0 -69.1 -31.63 70.48 Favored 'General case' 0 N--CA 1.476 0.868 0 CA-C-O 121.288 0.566 . . . . 0.0 110.696 -178.775 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 53.7 mt -73.59 -47.12 46.09 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.736 0 CA-C-N 115.667 -0.697 . . . . 0.0 110.351 176.125 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 73.5 mt -59.95 -35.24 59.62 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.184 0 C-N-CA 123.507 0.723 . . . . 0.0 110.498 177.225 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 88.0 tttt -60.27 -42.59 95.69 Favored 'General case' 0 CA--C 1.548 0.896 0 C-N-CA 124.308 1.043 . . . . 0.0 110.708 176.822 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 22.3 t80 -67.03 -47.27 71.9 Favored 'General case' 0 CA--C 1.547 0.841 0 CA-C-N 114.1 -1.409 . . . . 0.0 111.231 176.313 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 48' ' ' LEU . . . . . 0.541 ' HB3' ' HE2' ' A' ' 56' ' ' PHE . 87.4 mt -70.38 -36.95 74.43 Favored 'General case' 0 N--CA 1.473 0.709 0 C-N-CA 124.056 0.942 . . . . 0.0 112.414 -173.921 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 3.1 pt20 -80.56 -32.24 36.69 Favored 'General case' 0 N--CA 1.478 0.959 0 C-N-CA 122.457 0.303 . . . . 0.0 111.059 -175.556 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 44.4 tt0 -59.87 -37.0 78.08 Favored 'General case' 0 N--CA 1.478 0.96 0 C-N-CA 123.278 0.631 . . . . 0.0 111.053 -176.8 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 81.8 m-70 -106.19 -37.13 6.68 Favored 'General case' 0 N--CA 1.476 0.852 0 CA-C-N 115.609 -0.723 . . . . 0.0 111.247 -176.355 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 52' ' ' GLY . . . . . 0.486 ' HA2' ' HA ' ' A' ' 91' ' ' PHE . . . -60.26 127.31 43.55 Favored Glycine 0 C--N 1.346 1.128 0 O-C-N 123.924 0.765 . . . . 0.0 113.841 -178.349 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 25.7 t -68.28 168.09 13.11 Favored 'General case' 0 CA--C 1.548 0.88 0 C-N-CA 124.274 1.03 . . . . 0.0 110.948 -179.906 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 19.5 m-20 -57.25 -27.79 62.38 Favored 'General case' 0 N--CA 1.486 1.371 0 C-N-CA 124.156 0.983 . . . . 0.0 112.801 -172.877 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 19.6 p -64.57 -50.62 66.52 Favored 'General case' 0 CA--C 1.548 0.878 0 C-N-CA 123.723 0.809 . . . . 0.0 110.925 174.426 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 56' ' ' PHE . . . . . 0.554 ' HB2' ' HB3' ' A' ' 90' ' ' ARG . 58.9 t80 -61.23 -37.22 82.28 Favored 'General case' 0 N--CA 1.482 1.128 0 C-N-CA 123.959 0.904 . . . . 0.0 110.905 178.398 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 84.9 mt -66.41 -41.79 88.74 Favored 'General case' 0 CA--C 1.54 0.578 0 CA-C-N 114.357 -1.292 . . . . 0.0 110.976 176.85 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -71.08 -27.03 63.32 Favored 'General case' 0 N--CA 1.479 1.011 0 C-N-CA 123.894 0.878 . . . . 0.0 112.5 -179.64 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -61.72 -50.24 73.21 Favored 'General case' 0 CA--C 1.547 0.838 0 C-N-CA 123.675 0.79 . . . . 0.0 112.521 -177.467 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 22.4 t-80 -119.07 14.26 13.1 Favored 'General case' 0 N--CA 1.487 1.411 0 N-CA-C 112.568 0.581 . . . . 0.0 112.568 -179.761 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 50.5 mtpt 55.31 49.51 16.9 Favored 'General case' 0 N--CA 1.482 1.175 0 C-N-CA 123.7 0.8 . . . . 0.0 110.962 -172.917 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 0.446 ' HA ' HG11 ' A' ' 69' ' ' VAL . 86.7 mt -79.69 -6.99 58.3 Favored 'General case' 0 N--CA 1.48 1.05 0 C-N-CA 123.759 0.824 . . . . 0.0 110.76 176.349 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 63' ' ' LEU . . . . . 0.406 ' HG ' ' H ' ' A' ' 63' ' ' LEU . 1.2 pp -76.12 159.86 30.32 Favored 'General case' 0 N--CA 1.475 0.805 0 C-N-CA 123.945 0.898 . . . . 0.0 110.936 173.225 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 86.14 -160.5 33.56 Favored Glycine 0 C--N 1.343 0.947 0 CA-C-N 115.524 -0.762 . . . . 0.0 113.2 179.212 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 90.5 m-20 -63.5 123.56 19.09 Favored 'General case' 0 N--CA 1.474 0.73 0 C-N-CA 123.209 0.604 . . . . 0.0 110.4 179.622 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 53.3 mt -56.49 -46.29 82.24 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.657 0 C-N-CA 124.599 1.16 . . . . 0.0 111.73 -175.006 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 62.7 pttt -58.84 -37.43 76.44 Favored 'General case' 0 CA--C 1.556 1.182 0 C-N-CA 123.855 0.862 . . . . 0.0 111.537 178.516 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 68' ' ' ASN . . . . . 0.4 ' O ' ' HG2' ' A' ' 71' ' ' LYS . 5.9 m-20 -70.42 -31.22 68.32 Favored 'General case' 0 N--CA 1.481 1.088 0 C-N-CA 124.201 1.0 . . . . 0.0 110.62 179.695 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 69' ' ' VAL . . . . . 0.446 HG11 ' HA ' ' A' ' 62' ' ' LEU . 30.7 t -74.28 -37.19 45.09 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.937 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.064 172.289 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -68.3 -21.66 64.77 Favored 'General case' 0 N--CA 1.484 1.256 0 C-N-CA 124.059 0.944 . . . . 0.0 112.765 -174.608 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 71' ' ' LYS . . . . . 0.4 ' HG2' ' O ' ' A' ' 68' ' ' ASN . 20.9 ptmt -83.0 -18.14 40.9 Favored 'General case' 0 N--CA 1.482 1.163 0 C-N-CA 122.758 0.423 . . . . 0.0 111.442 179.714 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 8.9 t -114.11 -5.67 13.08 Favored 'General case' 0 N--CA 1.478 0.969 0 C-N-CA 123.762 0.825 . . . . 0.0 110.605 179.471 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -95.35 131.7 41.17 Favored 'General case' 0 N--CA 1.47 0.537 0 C-N-CA 123.504 0.722 . . . . 0.0 110.378 177.555 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 30.7 t30 -97.14 145.04 26.4 Favored 'General case' 0 C--O 1.242 0.677 0 N-CA-C 108.169 -1.048 . . . . 0.0 108.169 170.37 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 4.6 tppp? -55.85 -43.94 77.56 Favored 'General case' 0 N--CA 1.474 0.748 0 C-N-CA 124.044 0.938 . . . . 0.0 111.754 -178.693 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 22.3 t70 -57.97 -44.03 86.84 Favored 'General case' 0 N--CA 1.479 0.98 0 C-N-CA 123.758 0.823 . . . . 0.0 111.633 -177.842 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 26.2 t60 -75.38 -26.37 58.41 Favored 'General case' 0 N--CA 1.473 0.702 0 C-N-CA 122.639 0.375 . . . . 0.0 111.085 179.729 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 67.6 mt -68.16 -31.11 70.44 Favored 'General case' 0 N--CA 1.486 1.332 0 CA-C-N 118.225 0.466 . . . . 0.0 111.931 176.026 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 79' ' ' VAL . . . . . 0.584 HG11 HG13 ' A' ' 31' ' ' VAL . 97.0 t -69.65 -39.73 78.55 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.734 0 CA-C-N 115.565 -0.743 . . . . 0.0 109.66 171.169 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 37.4 m -63.37 -40.25 96.74 Favored 'General case' 0 CA--C 1.547 0.848 0 C-N-CA 123.524 0.73 . . . . 0.0 111.204 176.576 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -71.44 -40.64 70.25 Favored 'General case' 0 N--CA 1.476 0.833 0 C-N-CA 123.895 0.878 . . . . 0.0 109.592 178.988 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 82' ' ' TYR . . . . . . . . . . . . . 11.7 t80 -54.49 -54.75 36.84 Favored 'General case' 0 N--CA 1.474 0.731 0 C-N-CA 124.648 1.179 . . . . 0.0 110.762 175.741 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 83' ' ' ASN . . . . . . . . . . . . . 14.8 m120 -67.46 -40.67 85.36 Favored 'General case' 0 N--CA 1.478 0.933 0 C-N-CA 122.475 0.31 . . . . 0.0 110.997 -176.712 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 38.6 m170 -66.65 -24.62 66.31 Favored 'General case' 0 N--CA 1.483 1.21 0 C-N-CA 123.535 0.734 . . . . 0.0 111.663 178.608 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 85' ' ' LEU . . . . . 0.455 ' HG ' ' HD2' ' A' ' 91' ' ' PHE . 35.4 tp -58.6 -53.83 53.93 Favored 'General case' 0 N--CA 1.482 1.148 0 C-N-CA 123.793 0.837 . . . . 0.0 110.653 177.042 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 36.6 m-85 -74.85 -29.78 61.15 Favored 'General case' 0 N--CA 1.474 0.729 0 CA-C-N 114.593 -1.185 . . . . 0.0 111.428 -178.896 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 40.7 tt0 -58.78 -47.69 83.85 Favored 'General case' 0 N--CA 1.477 0.887 0 C-N-CA 125.013 1.325 . . . . 0.0 112.831 -173.367 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 30.2 p -120.18 8.59 10.94 Favored 'General case' 0 N--CA 1.477 0.91 0 C-N-CA 123.634 0.774 . . . . 0.0 111.271 -178.043 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 96.6 mttt 54.78 61.78 2.82 Favored 'General case' 0 N--CA 1.477 0.915 0 C-N-CA 124.277 1.031 . . . . 0.0 111.072 -177.108 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 90' ' ' ARG . . . . . 0.554 ' HB3' ' HB2' ' A' ' 56' ' ' PHE . 44.5 mtt85 -75.63 -8.53 57.02 Favored 'General case' 0 N--CA 1.476 0.831 0 CA-C-N 114.06 -1.427 . . . . 0.0 111.807 178.403 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 91' ' ' PHE . . . . . 0.486 ' HA ' ' HA2' ' A' ' 52' ' ' GLY . 23.2 p90 -81.49 162.02 23.41 Favored 'General case' 0 N--CA 1.469 0.524 0 C-N-CA 124.164 0.986 . . . . 0.0 111.11 172.131 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 6.5 tmtm? . . . . . 0 C--O 1.253 1.265 0 CA-C-N 115.045 -0.98 . . . . 0.0 109.003 175.016 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 20' ' ' MET . . . . . . . . . . . . . 14.3 tpt . . . . . 0 N--CA 1.483 1.202 0 N-CA-C 110.38 -0.23 . . . . 0.0 110.38 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -121.28 89.69 3.17 Favored 'General case' 0 N--CA 1.474 0.771 0 N-CA-C 108.245 -1.021 . . . . 0.0 108.245 171.673 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -64.5 -47.64 78.16 Favored 'General case' 0 N--CA 1.481 1.083 0 C-N-CA 124.025 0.93 . . . . 0.0 110.455 -179.966 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -104.94 105.27 15.24 Favored 'General case' 0 C--O 1.236 0.383 0 N-CA-C 107.647 -1.242 . . . . 0.0 107.647 171.101 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 27.7 m -78.23 148.04 73.78 Favored Pre-proline 0 CA--C 1.548 0.898 0 N-CA-C 109.519 -0.548 . . . . 0.0 109.519 179.083 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 59.7 Cg_endo -73.41 93.1 0.83 Allowed 'Trans proline' 0 C--N 1.365 1.409 0 C-N-CA 122.366 2.044 . . . . 0.0 110.467 174.74 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 19.2 pt20 -76.54 -176.7 3.85 Favored 'General case' 0 C--O 1.244 0.804 0 CA-C-N 113.203 -1.817 . . . . 0.0 110.208 -178.696 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 27' ' ' ARG . . . . . 0.665 HH21 HG22 ' A' ' 30' ' ' THR . 15.4 ttt180 -60.27 120.89 10.68 Favored 'General case' 0 CA--C 1.549 0.905 0 C-N-CA 123.528 0.731 . . . . 0.0 110.522 175.098 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -90.09 -60.01 2.04 Favored 'General case' 0 CA--C 1.549 0.924 0 CA-C-N 114.589 -1.187 . . . . 0.0 109.456 174.852 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 29' ' ' TRP . . . . . . . . . . . . . 3.8 m-90 -89.67 149.54 22.74 Favored 'General case' 0 N--CA 1.474 0.762 0 C-N-CA 124.121 0.969 . . . . 0.0 111.896 -175.672 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 30' ' ' THR . . . . . 0.665 HG22 HH21 ' A' ' 27' ' ' ARG . 66.8 p -82.07 173.67 11.94 Favored 'General case' 0 N--CA 1.471 0.611 0 C-N-CA 123.328 0.651 . . . . 0.0 109.854 168.494 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 31' ' ' VAL . . . . . 0.532 ' HA ' HD12 ' A' ' 34' ' ' LEU . 69.3 t -58.99 -38.28 72.81 Favored 'Isoleucine or valine' 0 CA--C 1.554 1.1 0 C-N-CA 123.581 0.753 . . . . 0.0 111.381 -179.013 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 11.6 pt-20 -73.49 -36.25 65.75 Favored 'General case' 0 N--CA 1.482 1.158 0 CA-C-N 116.112 -0.494 . . . . 0.0 111.743 178.402 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 99.5 mt-30 -67.13 -28.17 67.92 Favored 'General case' 0 N--CA 1.482 1.134 0 C-N-CA 123.156 0.582 . . . . 0.0 111.33 175.667 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.584 HD13 ' HA ' ' A' ' 79' ' ' VAL . 89.2 mt -68.04 -52.48 34.93 Favored 'General case' 0 N--CA 1.477 0.918 0 C-N-CA 123.355 0.662 . . . . 0.0 110.963 175.463 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 15.5 ptm180 -74.7 -10.92 59.99 Favored 'General case' 0 N--CA 1.485 1.308 0 C-N-CA 123.154 0.582 . . . . 0.0 111.654 -177.606 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 33.3 t -53.7 121.23 7.43 Favored 'General case' 0 N--CA 1.478 0.965 0 C-N-CA 123.619 0.767 . . . . 0.0 110.719 171.302 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 44.1 mt-10 -67.55 -25.82 66.0 Favored 'General case' 0 N--CA 1.477 0.881 0 C-N-CA 124.234 1.014 . . . . 0.0 111.927 -174.634 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 94.8 mt-30 -65.93 -29.45 69.86 Favored 'General case' 0 N--CA 1.479 0.981 0 C-N-CA 123.812 0.845 . . . . 0.0 110.838 177.004 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 44.0 tp -83.05 117.1 67.54 Favored Pre-proline 0 CA--C 1.549 0.905 0 N-CA-C 107.749 -1.204 . . . . 0.0 107.749 170.88 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 15.9 Cg_exo -70.99 163.73 38.21 Favored 'Trans proline' 0 C--N 1.372 1.791 0 C-N-CA 122.844 2.363 . . . . 0.0 113.272 177.864 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 37.1 mtmm -68.24 -42.48 79.66 Favored 'General case' 0 N--CA 1.475 0.775 0 CA-C-N 115.537 -0.756 . . . . 0.0 110.587 175.984 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 55.2 pttt -61.41 -28.95 69.62 Favored 'General case' 0 N--CA 1.48 1.048 0 C-N-CA 123.947 0.899 . . . . 0.0 111.505 -179.216 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 6.5 t70 -70.81 -43.37 68.76 Favored 'General case' 0 CA--C 1.545 0.779 0 C-N-CA 122.598 0.359 . . . . 0.0 110.469 -179.158 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 27.9 mt -72.3 -45.68 60.08 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.122 0 C-N-CA 122.678 0.391 . . . . 0.0 110.388 179.941 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 45' ' ' ILE . . . . . 0.47 HD12 ' HB2' ' A' ' 70' ' ' ALA . 98.2 mt -58.89 -39.54 77.91 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.556 0 C-N-CA 123.366 0.667 . . . . 0.0 110.915 177.757 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 46' ' ' LYS . . . . . 0.414 ' O ' ' HB2' ' A' ' 50' ' ' GLU . 62.6 tttm -62.28 -46.72 87.54 Favored 'General case' 0 N--CA 1.473 0.723 0 C-N-CA 123.057 0.543 . . . . 0.0 110.347 175.887 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 20.5 t80 -58.56 -51.11 71.26 Favored 'General case' 0 N--CA 1.476 0.866 0 O-C-N 124.362 1.039 . . . . 0.0 110.569 -179.752 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 48' ' ' LEU . . . . . 0.416 HD21 ' CD1' ' A' ' 82' ' ' TYR . 95.3 mt -70.87 -31.33 67.97 Favored 'General case' 0 N--CA 1.468 0.466 0 CA-C-N 115.536 -0.756 . . . . 0.0 112.084 -173.746 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 1.9 pt20 -81.2 -26.35 36.02 Favored 'General case' 0 N--CA 1.481 1.093 0 N-CA-C 110.079 -0.341 . . . . 0.0 110.079 176.871 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 50' ' ' GLU . . . . . 0.414 ' HB2' ' O ' ' A' ' 46' ' ' LYS . 7.6 tp10 -59.68 -33.57 71.74 Favored 'General case' 0 N--CA 1.474 0.758 0 C-N-CA 123.694 0.798 . . . . 0.0 110.964 -178.057 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 54.8 p-80 -132.09 -20.18 2.48 Favored 'General case' 0 N--CA 1.479 0.983 0 CA-C-O 117.858 -1.068 . . . . 0.0 113.573 -176.29 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 52' ' ' GLY . . . . . 0.461 ' HA2' ' HA ' ' A' ' 91' ' ' PHE . . . -67.24 144.97 45.39 Favored Glycine 0 N--CA 1.48 1.575 0 CA-C-N 119.447 1.022 . . . . 0.0 112.362 177.876 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 53.7 m -77.73 163.08 26.47 Favored 'General case' 0 N--CA 1.486 1.344 0 CA-C-N 117.546 0.673 . . . . 0.0 111.92 -177.114 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 9.1 m-20 -54.29 -43.41 71.04 Favored 'General case' 0 N--CA 1.485 1.295 0 C-N-CA 124.533 1.133 . . . . 0.0 113.199 -170.42 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 34.5 t -68.21 -40.71 82.04 Favored 'General case' 0 N--CA 1.479 1.019 0 C-N-CA 123.38 0.672 . . . . 0.0 111.223 -176.224 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 89.8 t80 -63.49 -48.08 79.1 Favored 'General case' 0 N--CA 1.478 0.954 0 C-N-CA 123.257 0.623 . . . . 0.0 109.713 177.386 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 63.6 mt -65.02 -32.45 74.18 Favored 'General case' 0 C--O 1.22 -0.487 0 CA-C-N 115.173 -0.921 . . . . 0.0 111.18 -178.205 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -70.17 -48.43 57.32 Favored 'General case' 0 N--CA 1.475 0.82 0 C-N-CA 123.313 0.645 . . . . 0.0 110.813 179.276 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 55.2 mt-10 -61.66 -36.59 81.26 Favored 'General case' 0 N--CA 1.481 1.078 0 C-N-CA 123.23 0.612 . . . . 0.0 111.947 -179.866 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 94.5 m-70 -99.27 -4.05 32.77 Favored 'General case' 0 N--CA 1.481 1.093 0 C-N-CA 122.517 0.327 . . . . 0.0 111.866 -178.444 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 33.8 mmtp 61.18 30.34 19.26 Favored 'General case' 0 N--CA 1.495 1.807 0 C-N-CA 124.177 0.991 . . . . 0.0 112.108 179.747 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 80.4 mt -80.3 -13.49 59.15 Favored 'General case' 0 N--CA 1.482 1.165 0 C-N-CA 124.177 0.991 . . . . 0.0 111.564 179.653 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -74.33 179.78 4.37 Favored 'General case' 0 N--CA 1.485 1.317 0 C-N-CA 123.484 0.713 . . . . 0.0 111.822 177.644 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 76.43 -160.0 50.51 Favored Glycine 0 C--N 1.342 0.891 0 CA-C-N 115.362 -0.835 . . . . 0.0 113.239 175.734 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 13.3 m120 -67.98 113.51 5.74 Favored 'General case' 0 N--CA 1.479 0.992 0 C-N-CA 123.087 0.555 . . . . 0.0 109.928 -178.88 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 44.2 mt -51.99 -53.06 19.62 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.116 0 C-N-CA 125.313 1.445 . . . . 0.0 112.287 -172.159 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 41.8 mtmt -64.25 -38.41 90.94 Favored 'General case' 0 N--CA 1.482 1.14 0 C-N-CA 124.257 1.023 . . . . 0.0 111.428 -175.674 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 50.6 t30 -66.02 -39.86 90.58 Favored 'General case' 0 N--CA 1.481 1.091 0 C-N-CA 124.113 0.965 . . . . 0.0 110.894 178.49 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 69' ' ' VAL . . . . . 0.417 HG12 HD13 ' A' ' 45' ' ' ILE . 97.5 t -67.39 -39.53 82.86 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.878 0 CA-C-N 115.853 -0.612 . . . . 0.0 109.597 174.129 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 70' ' ' ALA . . . . . 0.47 ' HB2' HD12 ' A' ' 45' ' ' ILE . . . -81.77 12.23 4.15 Favored 'General case' 0 N--CA 1.483 1.209 0 C-N-CA 124.216 1.006 . . . . 0.0 111.743 179.568 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 65.4 tttp -94.43 -31.03 14.15 Favored 'General case' 0 CA--C 1.544 0.731 0 C-N-CA 124.148 0.979 . . . . 0.0 110.123 170.985 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 8.8 t -122.28 -19.86 6.35 Favored 'General case' 0 N--CA 1.482 1.167 0 N-CA-C 112.667 0.618 . . . . 0.0 112.667 -170.759 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -77.89 148.41 34.61 Favored 'General case' 0 N--CA 1.477 0.893 0 C-N-CA 122.794 0.438 . . . . 0.0 109.848 176.771 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 9.4 p30 -98.76 163.87 12.45 Favored 'General case' 0 N--CA 1.483 1.203 0 C-N-CA 122.587 0.355 . . . . 0.0 110.4 176.422 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 19.0 tptm -71.59 -39.39 70.58 Favored 'General case' 0 N--CA 1.478 0.953 0 C-N-CA 123.658 0.783 . . . . 0.0 111.357 -172.75 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 25.2 t70 -63.69 -33.08 74.84 Favored 'General case' 0 N--CA 1.483 1.217 0 C-N-CA 124.412 1.085 . . . . 0.0 111.088 -176.435 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 69.5 t60 -58.43 -43.82 88.88 Favored 'General case' 0 N--CA 1.475 0.786 0 C-N-CA 124.891 1.276 . . . . 0.0 110.26 173.416 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 56.7 mt -68.56 -31.53 70.81 Favored 'General case' 0 N--CA 1.476 0.834 0 CA-C-N 115.389 -0.823 . . . . 0.0 112.076 -174.907 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 79' ' ' VAL . . . . . 0.584 ' HA ' HD13 ' A' ' 34' ' ' LEU . 53.7 t -65.1 -48.45 83.77 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.883 0 O-C-N 124.114 0.884 . . . . 0.0 109.775 177.263 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 56.8 m -62.8 -44.52 95.95 Favored 'General case' 0 N--CA 1.474 0.771 0 CA-C-N 115.193 -0.912 . . . . 0.0 111.58 178.309 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -64.39 -48.24 76.17 Favored 'General case' 0 N--CA 1.476 0.838 0 C-N-CA 123.37 0.668 . . . . 0.0 110.557 -179.137 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 82' ' ' TYR . . . . . 0.535 ' CD2' HD11 ' A' ' 34' ' ' LEU . 74.0 t80 -53.59 -57.44 10.74 Favored 'General case' 0 N--CA 1.471 0.59 0 C-N-CA 124.288 1.035 . . . . 0.0 111.136 -178.133 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 83' ' ' ASN . . . . . . . . . . . . . 46.5 m-80 -66.76 -28.25 68.25 Favored 'General case' 0 N--CA 1.478 0.966 0 CA-C-N 115.359 -0.837 . . . . 0.0 111.913 -172.652 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 10.6 m170 -77.47 -28.47 52.31 Favored 'General case' 0 N--CA 1.482 1.129 0 C-N-CA 123.155 0.582 . . . . 0.0 111.927 177.6 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 34.2 tp -59.89 -53.03 62.69 Favored 'General case' 0 N--CA 1.492 1.657 0 CA-C-O 121.571 0.701 . . . . 0.0 111.21 -177.518 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 86' ' ' PHE . . . . . 0.404 ' HA ' ' HE2' ' A' ' 91' ' ' PHE . 34.5 m-85 -73.9 -29.82 62.26 Favored 'General case' 0 N--CA 1.47 0.556 0 CA-C-N 113.993 -1.458 . . . . 0.0 110.743 -176.074 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 13.9 tp10 -69.19 -36.99 77.9 Favored 'General case' 0 N--CA 1.471 0.616 0 C-N-CA 123.532 0.733 . . . . 0.0 110.957 -176.7 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 60.5 p -106.92 0.49 23.87 Favored 'General case' 0 N--CA 1.478 0.935 0 C-N-CA 123.967 0.907 . . . . 0.0 111.683 -177.561 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 74.4 mmtt 61.88 27.15 16.51 Favored 'General case' 0 N--CA 1.489 1.475 0 C-N-CA 124.49 1.116 . . . . 0.0 112.24 174.919 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 54.2 mtt180 -73.46 4.58 4.62 Favored 'General case' 0 N--CA 1.492 1.628 0 N-CA-C 114.056 1.132 . . . . 0.0 114.056 -172.967 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 91' ' ' PHE . . . . . 0.461 ' HA ' ' HA2' ' A' ' 52' ' ' GLY . 5.8 p90 -70.43 141.92 52.05 Favored 'General case' 0 CA--C 1.551 0.995 0 CA-C-O 121.343 0.592 . . . . 0.0 111.783 169.955 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 13.6 tptp . . . . . 0 C--O 1.25 1.097 0 C-N-CA 127.753 2.421 . . . . 0.0 112.688 -176.856 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 20' ' ' MET . . . . . . . . . . . . . 60.5 mtt . . . . . 0 N--CA 1.478 0.972 0 N-CA-C 109.126 -0.694 . . . . 0.0 109.126 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -104.56 14.39 30.01 Favored 'General case' 0 N--CA 1.481 1.09 0 C-N-CA 123.253 0.621 . . . . 0.0 112.424 -173.462 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . 74.69 -56.45 0.63 Allowed 'General case' 0 N--CA 1.496 1.843 0 C-N-CA 125.715 1.606 . . . . 0.0 113.501 176.799 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -82.7 167.52 18.13 Favored 'General case' 0 N--CA 1.474 0.745 0 C-N-CA 124.118 0.967 . . . . 0.0 112.207 -175.304 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 47.5 t -83.69 120.64 75.55 Favored Pre-proline 0 CA--C 1.552 1.024 0 CA-C-N 115.017 -0.992 . . . . 0.0 109.125 172.892 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 74.2 Cg_exo -52.99 121.17 8.87 Favored 'Trans proline' 0 C--N 1.372 1.807 0 C-N-CA 123.333 2.689 . . . . 0.0 112.823 172.222 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 5.1 pm0 -69.81 115.06 8.6 Favored 'General case' 0 N--CA 1.471 0.615 0 N-CA-C 109.202 -0.666 . . . . 0.0 109.202 175.94 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 27' ' ' ARG . . . . . 0.505 ' HD3' ' H ' ' A' ' 27' ' ' ARG . 0.0 OUTLIER -62.8 123.0 17.32 Favored 'General case' 0 CA--C 1.537 0.462 0 CA-C-O 121.54 0.686 . . . . 0.0 109.941 174.444 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -79.05 -35.08 43.14 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 114.605 -1.18 . . . . 0.0 110.613 -174.14 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 29' ' ' TRP . . . . . 0.519 ' HB3' ' HB2' ' A' ' 33' ' ' GLN . 3.2 m-90 -115.0 145.89 41.8 Favored 'General case' 0 N--CA 1.472 0.666 0 CA-C-N 115.16 -0.927 . . . . 0.0 110.57 -172.618 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 49.2 p -93.07 174.58 7.16 Favored 'General case' 0 CA--C 1.544 0.729 0 C-N-CA 123.68 0.792 . . . . 0.0 108.865 168.438 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 31' ' ' VAL . . . . . 0.515 ' HA ' HD12 ' A' ' 34' ' ' LEU . 7.1 p -58.89 -35.66 57.53 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.277 0 C-N-CA 122.907 0.483 . . . . 0.0 112.19 -174.471 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 9.0 pt-20 -66.07 -42.16 89.77 Favored 'General case' 0 N--CA 1.48 1.051 0 C-N-CA 123.657 0.783 . . . . 0.0 111.262 176.695 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 33' ' ' GLN . . . . . 0.519 ' HB2' ' HB3' ' A' ' 29' ' ' TRP . 12.4 mm100 -63.9 -42.34 97.46 Favored 'General case' 0 N--CA 1.477 0.918 0 C-N-CA 123.021 0.528 . . . . 0.0 110.085 178.209 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.515 HD12 ' HA ' ' A' ' 31' ' ' VAL . 70.2 mt -63.23 -49.57 73.65 Favored 'General case' 0 N--CA 1.472 0.649 0 O-C-N 124.485 1.116 . . . . 0.0 111.17 -176.943 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 11.5 ptp180 -73.07 -16.84 61.47 Favored 'General case' 0 N--CA 1.48 1.052 0 O-C-N 124.046 0.841 . . . . 0.0 111.636 -175.166 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 13.4 t -69.46 122.46 19.04 Favored 'General case' 0 CA--C 1.55 0.965 0 N-CA-C 109.514 -0.55 . . . . 0.0 109.514 -178.825 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 37' ' ' GLU . . . . . 0.407 ' HA ' ' HE2' ' A' ' 75' ' ' LYS . 60.1 mm-40 -63.65 -22.16 66.76 Favored 'General case' 0 N--CA 1.481 1.094 0 C-N-CA 123.903 0.881 . . . . 0.0 113.017 -174.833 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 29.3 pt20 -68.15 -21.69 64.9 Favored 'General case' 0 N--CA 1.482 1.125 0 C-N-CA 123.292 0.637 . . . . 0.0 111.636 179.541 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 2.4 tt -81.26 121.56 80.44 Favored Pre-proline 0 CA--C 1.553 1.091 0 N-CA-C 107.005 -1.48 . . . . 0.0 107.005 174.103 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_exo -56.78 126.1 21.17 Favored 'Trans proline' 0 C--N 1.381 2.254 0 C-N-CA 122.804 2.336 . . . . 0.0 111.972 173.399 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 41' ' ' LYS . . . . . 0.455 ' HB2' HD11 ' A' ' 78' ' ' LEU . 9.6 ptpp? -58.74 -34.24 71.16 Favored 'General case' 0 N--CA 1.48 1.029 0 C-N-CA 123.261 0.624 . . . . 0.0 111.194 179.925 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 21.3 ptmt -66.49 -33.17 75.08 Favored 'General case' 0 N--CA 1.472 0.669 0 C-N-CA 124.183 0.993 . . . . 0.0 111.849 179.538 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 32.5 t70 -68.1 -33.12 73.92 Favored 'General case' 0 N--CA 1.476 0.871 0 C-N-CA 123.599 0.76 . . . . 0.0 110.33 -178.007 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 53.8 mt -70.17 -46.86 70.65 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.079 0 CA-C-N 115.657 -0.701 . . . . 0.0 109.916 175.266 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 74.6 mt -57.86 -35.77 52.88 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.492 0 C-N-CA 123.199 0.599 . . . . 0.0 110.872 176.882 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 88.6 tttt -65.79 -41.85 91.44 Favored 'General case' 0 CA--C 1.546 0.79 0 C-N-CA 123.306 0.642 . . . . 0.0 110.983 178.756 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 27.2 t80 -57.21 -48.43 78.81 Favored 'General case' 0 N--CA 1.489 1.52 0 C-N-CA 123.278 0.631 . . . . 0.0 110.085 172.892 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 48' ' ' LEU . . . . . 0.438 ' HB3' ' HE2' ' A' ' 56' ' ' PHE . 96.4 mt -66.77 -35.4 80.0 Favored 'General case' 0 CA--C 1.539 0.553 0 CA-C-N 114.259 -1.337 . . . . 0.0 112.144 -174.111 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 49' ' ' GLN . . . . . 0.444 ' HA ' ' CD2' ' A' ' 57' ' ' LEU . 3.5 pt20 -82.75 -34.77 27.05 Favored 'General case' 0 N--CA 1.482 1.133 0 CA-C-N 117.903 0.32 . . . . 0.0 111.234 179.25 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 44.5 tt0 -67.47 -37.51 83.01 Favored 'General case' 0 N--CA 1.477 0.895 0 C-N-CA 123.108 0.563 . . . . 0.0 111.247 -177.642 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 97.1 m-70 -108.16 -40.43 5.2 Favored 'General case' 0 N--CA 1.48 1.032 0 CA-C-N 115.679 -0.691 . . . . 0.0 111.822 -171.75 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 52' ' ' GLY . . . . . 0.538 ' HA2' ' HA ' ' A' ' 91' ' ' PHE . . . -63.88 136.54 41.05 Favored Glycine 0 C--N 1.345 1.031 0 O-C-N 123.596 0.56 . . . . 0.0 113.016 175.178 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 53' ' ' SER . . . . . 0.426 ' O ' ' HG ' ' A' ' 57' ' ' LEU . 9.1 t -73.09 172.64 10.67 Favored 'General case' 0 N--CA 1.476 0.851 0 C-N-CA 123.553 0.741 . . . . 0.0 110.309 -177.988 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 4.3 m-20 -55.0 -39.46 69.07 Favored 'General case' 0 N--CA 1.488 1.467 0 C-N-CA 123.845 0.858 . . . . 0.0 111.356 -177.625 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 22.7 t -63.85 -30.72 71.78 Favored 'General case' 0 N--CA 1.479 1.002 0 CA-C-N 114.932 -1.031 . . . . 0.0 111.71 -179.269 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 56' ' ' PHE . . . . . 0.581 ' HB2' ' HB3' ' A' ' 90' ' ' ARG . 46.3 t80 -75.48 -41.9 54.33 Favored 'General case' 0 N--CA 1.473 0.677 0 C-N-CA 123.102 0.561 . . . . 0.0 110.947 176.449 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 57' ' ' LEU . . . . . 0.444 ' CD2' ' HA ' ' A' ' 49' ' ' GLN . 20.8 mt -74.24 -49.09 24.73 Favored 'General case' 0 N--CA 1.472 0.629 0 CA-C-N 115.094 -0.957 . . . . 0.0 112.077 -168.541 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -61.4 -48.15 82.56 Favored 'General case' 0 N--CA 1.478 0.95 0 C-N-CA 123.383 0.673 . . . . 0.0 111.319 -177.346 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 14.1 mm-40 -60.37 -30.15 69.39 Favored 'General case' 0 N--CA 1.484 1.26 0 C-N-CA 123.521 0.728 . . . . 0.0 112.768 -178.997 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 35.3 m80 -113.18 0.9 15.06 Favored 'General case' 0 N--CA 1.488 1.426 0 N-CA-C 112.331 0.493 . . . . 0.0 112.331 -175.802 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 75.4 mmtt 55.71 44.68 25.93 Favored 'General case' 0 N--CA 1.486 1.34 0 C-N-CA 124.591 1.156 . . . . 0.0 111.729 178.761 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 85.2 mt -95.33 -11.23 28.15 Favored 'General case' 0 N--CA 1.481 1.094 0 C-N-CA 123.994 0.918 . . . . 0.0 111.455 179.605 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -79.96 171.97 14.39 Favored 'General case' 0 N--CA 1.482 1.14 0 C-N-CA 123.176 0.59 . . . . 0.0 111.42 176.657 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 85.62 -153.42 27.29 Favored Glycine 0 C--N 1.34 0.796 0 CA-C-N 114.751 -1.113 . . . . 0.0 112.53 178.418 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 12.5 m120 -69.79 118.52 12.75 Favored 'General case' 0 N--CA 1.469 0.483 0 N-CA-C 108.948 -0.76 . . . . 0.0 108.948 175.364 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 59.0 mt -55.43 -39.19 51.92 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.066 0 C-N-CA 123.94 0.896 . . . . 0.0 110.813 -177.883 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 58.2 pttt -53.74 -42.88 68.62 Favored 'General case' 0 N--CA 1.485 1.311 0 C-N-CA 124.145 0.978 . . . . 0.0 112.48 178.175 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 3.8 m-20 -59.64 -41.62 90.91 Favored 'General case' 0 N--CA 1.489 1.477 0 C-N-CA 123.997 0.919 . . . . 0.0 110.404 179.257 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 21.5 t -71.22 -44.86 73.13 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.073 0 CA-C-N 113.893 -1.503 . . . . 0.0 109.996 179.307 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -82.1 7.12 14.27 Favored 'General case' 0 N--CA 1.485 1.317 0 C-N-CA 124.726 1.211 . . . . 0.0 113.441 -168.242 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 21.1 ptmt -95.26 -18.69 20.64 Favored 'General case' 0 N--CA 1.482 1.137 0 O-C-N 121.907 -0.496 . . . . 0.0 111.079 172.109 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 13.0 t -133.05 -14.09 2.71 Favored 'General case' 0 CA--C 1.553 1.077 0 C-N-CA 123.257 0.623 . . . . 0.0 112.53 -173.668 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -84.17 99.85 10.78 Favored 'General case' 0 C--O 1.244 0.796 0 N-CA-C 108.692 -0.855 . . . . 0.0 108.692 176.827 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 32.4 p30 -68.65 163.45 23.76 Favored 'General case' 0 CA--C 1.539 0.53 0 CA-C-N 115.826 -0.624 . . . . 0.0 110.132 178.819 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 75' ' ' LYS . . . . . 0.426 ' HB2' ' NZ ' ' A' ' 75' ' ' LYS . 3.5 ttmp? -67.61 -26.75 66.41 Favored 'General case' 0 CA--C 1.548 0.883 0 C-N-CA 123.053 0.541 . . . . 0.0 110.985 -173.686 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 20.8 t70 -61.9 -41.37 97.82 Favored 'General case' 0 CA--C 1.552 1.037 0 C-N-CA 124.463 1.105 . . . . 0.0 110.966 173.741 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 17.4 t60 -62.84 -36.76 84.28 Favored 'General case' 0 N--CA 1.484 1.249 0 C-N-CA 125.292 1.437 . . . . 0.0 109.653 -179.075 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 78' ' ' LEU . . . . . 0.455 HD11 ' HB2' ' A' ' 41' ' ' LYS . 48.3 mt -75.06 -36.64 61.8 Favored 'General case' 0 N--CA 1.47 0.537 0 CA-C-N 114.584 -1.189 . . . . 0.0 111.922 -172.863 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 61.9 t -67.39 -41.97 86.86 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.899 0 O-C-N 123.82 0.7 . . . . 0.0 109.699 173.182 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 22.9 m -60.22 -43.56 95.92 Favored 'General case' 0 N--CA 1.482 1.132 0 C-N-CA 123.237 0.615 . . . . 0.0 110.936 177.171 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -69.73 -43.94 71.32 Favored 'General case' 0 N--CA 1.473 0.705 0 C-N-CA 123.523 0.729 . . . . 0.0 111.019 179.077 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 82' ' ' TYR . . . . . . . . . . . . . 18.0 t80 -53.62 -55.93 21.54 Favored 'General case' 0 N--CA 1.479 1.017 0 C-N-CA 124.202 1.001 . . . . 0.0 110.598 178.765 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 83' ' ' ASN . . . . . . . . . . . . . 34.2 m-80 -66.28 -41.54 89.71 Favored 'General case' 0 N--CA 1.476 0.849 0 C-N-CA 122.627 0.371 . . . . 0.0 110.822 -175.948 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 84' ' ' HIS . . . . . 0.485 ' HA ' ' HB3' ' A' ' 87' ' ' GLU . 46.1 m170 -64.5 -26.72 68.55 Favored 'General case' 0 N--CA 1.479 0.993 0 C-N-CA 123.169 0.588 . . . . 0.0 111.837 178.779 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 85' ' ' LEU . . . . . 0.403 ' HG ' ' HD2' ' A' ' 91' ' ' PHE . 56.4 tp -58.33 -54.45 46.84 Favored 'General case' 0 N--CA 1.48 1.056 0 CA-C-O 121.711 0.767 . . . . 0.0 110.179 177.796 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 86' ' ' PHE . . . . . 0.441 ' CZ ' ' HB3' ' A' ' 27' ' ' ARG . 27.1 m-85 -75.63 -26.5 57.83 Favored 'General case' 0 CA--C 1.546 0.821 0 CA-C-N 114.273 -1.33 . . . . 0.0 111.308 179.876 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 87' ' ' GLU . . . . . 0.485 ' HB3' ' HA ' ' A' ' 84' ' ' HIS . 14.9 tp10 -69.55 -25.67 64.12 Favored 'General case' 0 N--CA 1.484 1.262 0 C-N-CA 124.204 1.002 . . . . 0.0 111.745 -176.523 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 39.0 p -123.89 0.86 8.65 Favored 'General case' 0 N--CA 1.474 0.75 0 C-N-CA 123.385 0.674 . . . . 0.0 110.837 179.215 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 34.5 mmtp 54.57 40.05 31.58 Favored 'General case' 0 N--CA 1.483 1.213 0 C-N-CA 124.083 0.953 . . . . 0.0 110.606 -177.109 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 90' ' ' ARG . . . . . 0.581 ' HB3' ' HB2' ' A' ' 56' ' ' PHE . 28.5 mtt180 -73.08 -7.69 52.42 Favored 'General case' 0 N--CA 1.487 1.381 0 C-N-CA 125.323 1.449 . . . . 0.0 113.352 -174.544 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 91' ' ' PHE . . . . . 0.538 ' HA ' ' HA2' ' A' ' 52' ' ' GLY . 3.2 p90 -68.75 164.72 21.13 Favored 'General case' 0 N--CA 1.476 0.86 0 C-N-CA 123.398 0.679 . . . . 0.0 111.347 168.377 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 24.2 ttpp . . . . . 0 CA--C 1.556 1.19 0 O-C-N 124.567 1.167 . . . . 0.0 110.451 171.896 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 20' ' ' MET . . . . . . . . . . . . . 3.1 ppp? . . . . . 0 N--CA 1.478 0.943 0 CA-C-O 120.471 0.177 . . . . 0.0 110.534 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -173.37 101.25 0.12 Allowed 'General case' 0 N--CA 1.473 0.708 0 C-N-CA 125.168 1.387 . . . . 0.0 107.945 178.219 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -67.52 95.15 0.45 Allowed 'General case' 0 N--CA 1.473 0.704 0 N-CA-C 109.426 -0.583 . . . . 0.0 109.426 178.006 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -83.15 57.78 4.12 Favored 'General case' 0 N--CA 1.474 0.733 0 C-N-CA 123.995 0.918 . . . . 0.0 110.294 -175.816 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 35.4 m -77.38 127.05 83.97 Favored Pre-proline 0 CA--C 1.549 0.912 0 CA-C-N 115.061 -0.972 . . . . 0.0 109.058 -178.372 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 25' ' ' PRO . . . . . 0.401 ' HB2' ' CE1' ' A' ' 51' ' ' HIS . 22.8 Cg_exo -61.28 98.53 0.15 Allowed 'Trans proline' 0 C--N 1.381 2.275 0 C-N-CA 122.881 2.387 . . . . 0.0 112.681 -172.809 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 28.1 pt20 -82.69 -168.28 1.96 Allowed 'General case' 0 N--CA 1.474 0.729 0 CA-C-N 114.715 -1.13 . . . . 0.0 110.199 179.899 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 40.4 ttp180 -58.88 118.21 5.5 Favored 'General case' 0 CA--C 1.549 0.935 0 CA-C-O 121.351 0.596 . . . . 0.0 110.779 174.481 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -94.99 -19.6 20.07 Favored 'General case' 0 CA--C 1.549 0.925 0 CA-C-N 114.664 -1.153 . . . . 0.0 111.604 178.621 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 29' ' ' TRP . . . . . . . . . . . . . 2.9 m-90 -135.98 135.0 39.18 Favored 'General case' 0 N--CA 1.483 1.182 0 C-N-CA 124.187 0.995 . . . . 0.0 108.949 -172.705 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 82.1 p -75.63 170.34 16.36 Favored 'General case' 0 CA--C 1.545 0.783 0 N-CA-C 109.804 -0.443 . . . . 0.0 109.804 178.161 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 31' ' ' VAL . . . . . 0.406 ' HA ' HD12 ' A' ' 34' ' ' LEU . 91.2 t -59.17 -37.52 68.96 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.273 0 C-N-CA 122.391 0.276 . . . . 0.0 111.186 -177.042 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 10.7 pt-20 -69.09 -34.24 74.79 Favored 'General case' 0 N--CA 1.48 1.072 0 C-N-CA 123.49 0.716 . . . . 0.0 110.918 178.15 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 79.4 mt-30 -70.16 -33.81 72.23 Favored 'General case' 0 N--CA 1.477 0.892 0 C-N-CA 123.005 0.522 . . . . 0.0 110.397 176.233 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.487 HD11 ' CD2' ' A' ' 82' ' ' TYR . 76.2 mt -64.36 -53.7 44.57 Favored 'General case' 0 N--CA 1.477 0.901 0 N-CA-C 109.305 -0.628 . . . . 0.0 109.305 175.651 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 75.9 mtp180 -71.01 -12.02 61.3 Favored 'General case' 0 N--CA 1.477 0.889 0 CA-C-N 114.468 -1.242 . . . . 0.0 111.466 -177.469 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 44.0 t -57.83 143.2 43.2 Favored 'General case' 0 C--N 1.354 0.777 0 C-N-CA 123.482 0.713 . . . . 0.0 111.468 175.496 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 35.7 mt-10 -80.02 -8.31 59.3 Favored 'General case' 0 CA--C 1.55 0.97 0 CA-C-N 114.765 -1.107 . . . . 0.0 111.205 -178.707 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 28.1 mm-40 -86.36 -38.06 17.82 Favored 'General case' 0 N--CA 1.474 0.746 0 C-N-CA 124.038 0.935 . . . . 0.0 110.676 179.509 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 1.3 tt -82.61 112.93 41.07 Favored Pre-proline 0 N--CA 1.476 0.84 0 N-CA-C 108.328 -0.99 . . . . 0.0 108.328 179.096 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 40' ' ' PRO . . . . . 0.522 ' HB2' ' HG2' ' A' ' 42' ' ' LYS . 79.0 Cg_endo -73.81 148.7 41.52 Favored 'Trans proline' 0 C--N 1.372 1.809 0 C-N-CA 121.933 1.755 . . . . 0.0 111.406 -179.638 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 18.8 ptpt -64.52 -28.27 69.54 Favored 'General case' 0 N--CA 1.472 0.669 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.871 -178.429 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 42' ' ' LYS . . . . . 0.522 ' HG2' ' HB2' ' A' ' 40' ' ' PRO . 19.8 ptpt -65.08 -33.89 77.11 Favored 'General case' 0 N--CA 1.472 0.653 0 C-N-CA 123.453 0.701 . . . . 0.0 111.387 179.571 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 43' ' ' ASP . . . . . 0.412 ' HB2' ' HG2' ' A' ' 40' ' ' PRO . 25.1 t70 -75.37 -31.53 60.52 Favored 'General case' 0 N--CA 1.476 0.845 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.642 -177.515 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 49.4 mt -69.06 -50.18 55.69 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.779 0 N-CA-C 109.657 -0.497 . . . . 0.0 109.657 176.068 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 72.9 mt -57.62 -41.89 80.17 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.335 0 C-N-CA 123.497 0.719 . . . . 0.0 110.468 176.521 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 46' ' ' LYS . . . . . 0.42 ' HD3' HD11 ' A' ' 66' ' ' ILE . 23.1 tptm -53.46 -46.92 70.09 Favored 'General case' 0 N--CA 1.485 1.307 0 C-N-CA 124.555 1.142 . . . . 0.0 110.85 176.53 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 11.9 t80 -66.49 -47.58 72.56 Favored 'General case' 0 N--CA 1.473 0.686 0 CA-C-N 114.916 -1.038 . . . . 0.0 110.897 -179.478 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 93.2 mt -68.12 -33.44 74.5 Favored 'General case' 0 CA--C 1.541 0.627 0 C-N-CA 122.922 0.489 . . . . 0.0 111.842 -173.225 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 3.6 pt20 -83.5 -25.5 31.04 Favored 'General case' 0 N--CA 1.484 1.271 0 C-N-CA 122.464 0.306 . . . . 0.0 111.592 177.623 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 4.2 tm-20 -54.21 -42.5 69.83 Favored 'General case' 0 N--CA 1.49 1.526 0 C-N-CA 124.327 1.051 . . . . 0.0 111.846 -178.919 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 51' ' ' HIS . . . . . 0.401 ' CE1' ' HB2' ' A' ' 25' ' ' PRO . 4.0 p80 -138.74 -20.73 1.01 Allowed 'General case' 0 N--CA 1.481 1.123 0 CA-C-N 116.28 -0.418 . . . . 0.0 112.09 -172.755 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -60.26 135.2 50.18 Favored Glycine 0 C--N 1.352 1.43 0 CA-C-O 119.714 -0.492 . . . . 0.0 112.006 172.032 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 53' ' ' SER . . . . . 0.423 ' O ' ' HG ' ' A' ' 57' ' ' LEU . 32.4 t -62.98 148.09 48.66 Favored 'General case' 0 N--CA 1.471 0.622 0 C-N-CA 123.349 0.66 . . . . 0.0 111.868 -175.495 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 25.5 t70 -59.12 -36.95 76.08 Favored 'General case' 0 N--CA 1.481 1.125 0 C-N-CA 124.005 0.922 . . . . 0.0 112.197 -176.038 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 38.4 m -64.0 -37.53 87.74 Favored 'General case' 0 CA--C 1.549 0.931 0 C-N-CA 123.516 0.726 . . . . 0.0 111.367 177.591 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 52.4 t80 -66.5 -47.26 73.53 Favored 'General case' 0 N--CA 1.481 1.085 0 C-N-CA 123.498 0.719 . . . . 0.0 109.593 173.253 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 57' ' ' LEU . . . . . 0.423 ' HG ' ' O ' ' A' ' 53' ' ' SER . 76.3 mt -60.16 -33.47 72.22 Favored 'General case' 0 N--CA 1.476 0.874 0 CA-C-N 115.203 -0.908 . . . . 0.0 111.377 -175.427 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -65.03 -48.4 73.98 Favored 'General case' 0 N--CA 1.476 0.839 0 C-N-CA 123.626 0.771 . . . . 0.0 111.538 178.646 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 40.2 mt-10 -62.34 -26.47 68.46 Favored 'General case' 0 N--CA 1.482 1.128 0 CA-C-N 115.222 -0.899 . . . . 0.0 112.039 -178.262 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 72.8 m80 -114.37 1.76 14.51 Favored 'General case' 0 N--CA 1.483 1.197 0 C-N-CA 123.3 0.64 . . . . 0.0 112.241 -176.754 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 49.1 mtmt 62.37 22.82 13.48 Favored 'General case' 0 N--CA 1.497 1.881 0 C-N-CA 125.268 1.427 . . . . 0.0 112.6 178.073 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 89.6 mt -80.1 -10.97 59.8 Favored 'General case' 0 N--CA 1.478 0.926 0 C-N-CA 124.186 0.994 . . . . 0.0 112.312 -177.033 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 1.4 pp -74.4 162.48 28.81 Favored 'General case' 0 N--CA 1.48 1.035 0 CA-C-O 121.322 0.582 . . . . 0.0 111.207 175.298 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 89.23 -159.96 29.09 Favored Glycine 0 C--O 1.242 0.649 0 CA-C-N 115.02 -0.991 . . . . 0.0 112.267 178.683 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 65' ' ' ASN . . . . . 0.46 ' OD1' ' HG2' ' A' ' 67' ' ' LYS . 14.0 t-20 -75.63 139.34 41.96 Favored 'General case' 0 N--CA 1.469 0.481 0 N-CA-C 109.441 -0.578 . . . . 0.0 109.441 -179.447 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 66' ' ' ILE . . . . . 0.42 HD11 ' HD3' ' A' ' 46' ' ' LYS . 59.7 mt -61.0 -46.41 96.71 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.797 0 O-C-N 123.69 0.619 . . . . 0.0 112.568 -171.261 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 67' ' ' LYS . . . . . 0.46 ' HG2' ' OD1' ' A' ' 65' ' ' ASN . 8.9 ptpp? -60.48 -36.29 77.95 Favored 'General case' 0 N--CA 1.491 1.617 0 CA-C-N 118.334 0.515 . . . . 0.0 110.83 -178.344 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 7.0 t30 -61.42 -40.5 94.63 Favored 'General case' 0 N--CA 1.48 1.028 0 C-N-CA 124.543 1.137 . . . . 0.0 110.975 176.692 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 32.8 t -73.13 -40.22 57.9 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.808 0 CA-C-N 115.223 -0.899 . . . . 0.0 110.441 175.984 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -72.82 -5.89 41.21 Favored 'General case' 0 N--CA 1.484 1.229 0 C-N-CA 124.614 1.166 . . . . 0.0 113.221 -170.332 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -90.34 -18.94 24.65 Favored 'General case' 0 CA--C 1.548 0.867 0 C-N-CA 122.209 0.203 . . . . 0.0 110.765 176.278 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 10.1 t -120.08 -15.16 8.78 Favored 'General case' 0 N--CA 1.477 0.876 0 C-N-CA 123.927 0.891 . . . . 0.0 111.354 -178.022 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -90.32 97.37 11.14 Favored 'General case' 0 N--CA 1.475 0.777 0 C-N-CA 123.243 0.617 . . . . 0.0 110.317 179.407 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 74' ' ' ASN . . . . . 0.403 ' ND2' ' HB3' ' A' ' 76' ' ' ASP . 54.4 t30 -66.3 156.7 33.64 Favored 'General case' 0 N--CA 1.477 0.876 0 CA-C-N 115.431 -0.804 . . . . 0.0 109.125 173.077 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 75' ' ' LYS . . . . . 0.442 ' O ' HG23 ' A' ' 79' ' ' VAL . 2.9 tppp? -64.32 -38.76 92.18 Favored 'General case' 0 CA--C 1.548 0.892 0 N-CA-C 110.186 -0.302 . . . . 0.0 110.186 179.734 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 76' ' ' ASP . . . . . 0.403 ' HB3' ' ND2' ' A' ' 74' ' ' ASN . 31.0 t70 -64.53 -34.82 79.12 Favored 'General case' 0 N--CA 1.484 1.253 0 C-N-CA 124.156 0.982 . . . . 0.0 111.28 175.783 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 17.3 t60 -66.45 -38.63 87.77 Favored 'General case' 0 N--CA 1.487 1.386 0 C-N-CA 123.967 0.907 . . . . 0.0 109.376 174.232 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 71.8 mt -74.42 -26.62 60.18 Favored 'General case' 0 N--CA 1.475 0.793 0 C-N-CA 123.401 0.68 . . . . 0.0 112.326 -178.536 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 79' ' ' VAL . . . . . 0.442 HG23 ' O ' ' A' ' 75' ' ' LYS . 88.1 t -68.79 -44.02 82.34 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.018 0 N-CA-C 109.271 -0.64 . . . . 0.0 109.271 172.79 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 59.9 m -58.11 -51.77 68.33 Favored 'General case' 0 CA--C 1.546 0.79 0 CA-C-N 115.041 -0.981 . . . . 0.0 110.783 175.847 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -65.49 -45.88 81.87 Favored 'General case' 0 N--CA 1.475 0.786 0 C-N-CA 123.483 0.713 . . . . 0.0 111.779 -176.864 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 82' ' ' TYR . . . . . 0.487 ' CD2' HD11 ' A' ' 34' ' ' LEU . 79.8 t80 -58.82 -57.34 13.45 Favored 'General case' 0 N--CA 1.474 0.75 0 C-N-CA 124.289 1.036 . . . . 0.0 110.307 -177.712 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 83' ' ' ASN . . . . . . . . . . . . . 6.6 m120 -60.56 -42.1 95.91 Favored 'General case' 0 CA--C 1.549 0.913 0 CA-C-N 115.677 -0.692 . . . . 0.0 111.65 -176.037 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 63.5 m-70 -68.22 -25.24 65.11 Favored 'General case' 0 N--CA 1.481 1.097 0 CA-C-O 118.733 -0.651 . . . . 0.0 112.66 178.78 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 57.1 tp -62.08 -53.5 54.55 Favored 'General case' 0 N--CA 1.49 1.553 0 CA-C-N 118.76 0.709 . . . . 0.0 110.876 178.643 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 24.4 m-85 -75.33 -20.64 58.93 Favored 'General case' 0 N--CA 1.477 0.898 0 CA-C-N 114.613 -1.176 . . . . 0.0 110.868 -177.54 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 34.4 tt0 -69.36 -26.6 64.75 Favored 'General case' 0 N--CA 1.479 1.004 0 C-N-CA 123.316 0.647 . . . . 0.0 111.062 175.988 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 26.3 p -112.26 -21.93 11.18 Favored 'General case' 0 N--CA 1.477 0.92 0 C-N-CA 123.897 0.879 . . . . 0.0 110.914 179.385 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 97.3 mttt 55.1 46.87 23.16 Favored 'General case' 0 N--CA 1.481 1.09 0 C-N-CA 124.985 1.314 . . . . 0.0 112.292 -176.131 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 99.2 mtt180 -71.5 -16.05 62.33 Favored 'General case' 0 N--CA 1.493 1.697 0 C-N-CA 124.144 0.978 . . . . 0.0 112.095 177.973 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 91' ' ' PHE . . . . . . . . . . . . . 54.3 p90 -72.57 161.14 31.17 Favored 'General case' 0 CA--C 1.543 0.681 0 C-N-CA 123.631 0.773 . . . . 0.0 111.904 178.435 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 49.2 pttt . . . . . 0 C--O 1.254 1.294 0 N-CA-C 108.313 -0.995 . . . . 0.0 108.313 165.959 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 20' ' ' MET . . . . . . . . . . . . . 96.4 mmm . . . . . 0 N--CA 1.481 1.077 0 N-CA-C 110.093 -0.336 . . . . 0.0 110.093 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -143.03 135.88 27.84 Favored 'General case' 0 N--CA 1.472 0.667 0 C-N-CA 124.032 0.933 . . . . 0.0 108.823 179.886 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -82.27 85.09 6.9 Favored 'General case' 0 N--CA 1.47 0.532 0 C-N-CA 123.351 0.661 . . . . 0.0 110.227 -177.619 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -83.23 163.68 20.6 Favored 'General case' 0 N--CA 1.472 0.636 0 CA-C-N 115.877 -0.601 . . . . 0.0 110.861 178.776 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 24.3 m -114.52 136.15 22.36 Favored Pre-proline 0 CA--C 1.548 0.887 0 C-N-CA 124.144 0.978 . . . . 0.0 109.734 178.855 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 87.4 Cg_exo -50.3 118.71 4.22 Favored 'Trans proline' 0 C--N 1.382 2.301 0 C-N-CA 123.91 3.074 . . . . 0.0 114.462 179.776 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 45.6 mt-30 -76.83 171.02 15.41 Favored 'General case' 0 C--O 1.245 0.847 0 CA-C-N 115.785 -0.643 . . . . 0.0 109.364 165.973 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -63.66 134.19 54.97 Favored 'General case' 0 CA--C 1.544 0.736 0 CA-C-O 120.837 0.351 . . . . 0.0 110.209 175.384 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -77.56 -41.76 37.77 Favored 'General case' 0 N--CA 1.47 0.574 0 N-CA-C 109.101 -0.703 . . . . 0.0 109.101 178.192 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 29' ' ' TRP . . . . . 0.4 ' CH2' ' HB3' ' A' ' 43' ' ' ASP . 10.7 m-90 -138.32 159.68 41.44 Favored 'General case' 0 N--CA 1.477 0.9 0 C-N-CA 124.717 1.207 . . . . 0.0 108.236 175.462 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 67.9 p -85.42 168.55 14.5 Favored 'General case' 0 N--CA 1.483 1.218 0 N-CA-C 108.662 -0.866 . . . . 0.0 108.662 176.525 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 7.2 p -61.0 -39.34 81.86 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.197 0 CA-C-N 118.052 0.387 . . . . 0.0 111.425 -174.859 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -64.26 -35.74 81.83 Favored 'General case' 0 N--CA 1.479 1.015 0 C-N-CA 123.836 0.855 . . . . 0.0 111.42 177.775 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 52.2 mt-30 -69.66 -42.37 74.31 Favored 'General case' 0 C--N 1.353 0.746 0 C-N-CA 123.28 0.632 . . . . 0.0 110.757 175.045 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.442 ' HA ' HD13 ' A' ' 39' ' ' LEU . 89.2 mt -63.51 -53.61 49.23 Favored 'General case' 0 N--CA 1.478 0.974 0 C-N-CA 123.237 0.615 . . . . 0.0 111.094 -175.697 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 8.0 ptm180 -65.01 -22.45 67.0 Favored 'General case' 0 N--CA 1.473 0.719 0 O-C-N 124.176 0.923 . . . . 0.0 112.003 -172.718 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 23.3 t -60.2 132.3 53.49 Favored 'General case' 0 CA--C 1.545 0.756 0 C-N-CA 123.552 0.741 . . . . 0.0 110.457 177.917 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 3.1 mp0 -66.72 -21.15 66.08 Favored 'General case' 0 CA--C 1.546 0.819 0 C-N-CA 123.658 0.783 . . . . 0.0 111.718 -173.395 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 13.8 pt20 -69.47 -29.18 66.79 Favored 'General case' 0 N--CA 1.479 1.011 0 C-N-CA 122.823 0.449 . . . . 0.0 111.211 177.456 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.442 HD13 ' HA ' ' A' ' 34' ' ' LEU . 4.0 tt -86.33 113.09 50.54 Favored Pre-proline 0 N--CA 1.475 0.775 0 N-CA-C 107.967 -1.123 . . . . 0.0 107.967 177.728 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 40' ' ' PRO . . . . . 0.451 ' HB2' ' HG2' ' A' ' 42' ' ' LYS . 98.6 Cg_endo -73.03 149.26 46.41 Favored 'Trans proline' 0 C--N 1.375 1.963 0 C-N-CA 122.509 2.14 . . . . 0.0 112.015 -178.92 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 46.2 mtmt -68.27 -21.12 64.82 Favored 'General case' 0 N--CA 1.472 0.65 0 CA-C-N 114.868 -1.06 . . . . 0.0 112.043 -175.572 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 42' ' ' LYS . . . . . 0.451 ' HG2' ' HB2' ' A' ' 40' ' ' PRO . 17.3 ptpt -65.08 -34.16 77.76 Favored 'General case' 0 CA--C 1.544 0.747 0 C-N-CA 123.97 0.908 . . . . 0.0 111.149 178.462 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 43' ' ' ASP . . . . . 0.4 ' HB3' ' CH2' ' A' ' 29' ' ' TRP . 0.8 OUTLIER -69.79 -38.79 76.8 Favored 'General case' 0 C--O 1.241 0.616 0 C-N-CA 123.617 0.767 . . . . 0.0 111.161 179.015 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 43.1 mt -68.74 -50.88 51.05 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.596 0 CA-C-N 115.49 -0.777 . . . . 0.0 110.164 -178.457 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 75.7 mt -59.81 -36.09 64.17 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.163 0 C-N-CA 123.277 0.631 . . . . 0.0 110.872 177.471 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 13.4 ttmm -59.48 -48.45 81.62 Favored 'General case' 0 N--CA 1.479 0.996 0 C-N-CA 122.788 0.435 . . . . 0.0 111.023 174.384 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 20.9 t80 -54.88 -45.96 74.71 Favored 'General case' 0 N--CA 1.484 1.254 0 CA-C-O 121.259 0.552 . . . . 0.0 110.73 176.115 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 48' ' ' LEU . . . . . 0.421 ' HB3' ' HE2' ' A' ' 56' ' ' PHE . 90.8 mt -70.58 -37.93 74.01 Favored 'General case' 0 CA--C 1.544 0.73 0 CA-C-N 115.045 -0.98 . . . . 0.0 112.163 -175.152 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 49' ' ' GLN . . . . . 0.418 ' HA ' HD11 ' A' ' 57' ' ' LEU . 3.3 pt20 -85.6 -36.43 20.39 Favored 'General case' 0 N--CA 1.489 1.503 0 N-CA-C 113.121 0.786 . . . . 0.0 113.121 -175.935 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 32.5 tt0 -69.1 -37.42 78.41 Favored 'General case' 0 N--CA 1.479 0.991 0 C-N-CA 123.802 0.841 . . . . 0.0 111.599 -170.303 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -141.04 14.0 2.25 Favored 'General case' 0 N--CA 1.48 1.064 0 N-CA-C 113.107 0.78 . . . . 0.0 113.107 -178.93 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -103.9 150.38 17.45 Favored Glycine 0 N--CA 1.478 1.472 0 N-CA-C 110.639 -0.984 . . . . 0.0 110.639 162.564 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 53' ' ' SER . . . . . 0.485 ' O ' ' HG ' ' A' ' 57' ' ' LEU . 80.1 p -68.09 159.25 31.28 Favored 'General case' 0 N--CA 1.485 1.308 0 N-CA-C 113.353 0.871 . . . . 0.0 113.353 -170.137 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 22.1 t70 -66.21 -38.85 88.96 Favored 'General case' 0 N--CA 1.48 1.062 0 C-N-CA 124.514 1.126 . . . . 0.0 111.409 -177.331 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 13.3 t -67.49 -31.06 70.93 Favored 'General case' 0 N--CA 1.478 0.965 0 C-N-CA 123.544 0.738 . . . . 0.0 110.992 -179.364 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 56' ' ' PHE . . . . . 0.455 ' HD1' HH11 ' A' ' 90' ' ' ARG . 27.2 t80 -65.56 -48.81 71.14 Favored 'General case' 0 CA--C 1.548 0.874 0 CA-C-N 115.435 -0.802 . . . . 0.0 110.246 170.753 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 57' ' ' LEU . . . . . 0.485 ' HG ' ' O ' ' A' ' 53' ' ' SER . 72.1 mt -60.97 -45.4 94.9 Favored 'General case' 0 N--CA 1.481 1.122 0 C-N-CA 122.884 0.473 . . . . 0.0 111.347 -177.674 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -52.74 -26.24 13.53 Favored 'General case' 0 CA--C 1.545 0.752 0 C-N-CA 125.918 1.687 . . . . 0.0 113.734 -175.033 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 57.0 mt-10 -57.08 -49.09 76.93 Favored 'General case' 0 N--CA 1.481 1.118 0 C-N-CA 123.812 0.845 . . . . 0.0 111.789 179.81 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 58.7 t-80 -109.93 -5.2 15.55 Favored 'General case' 0 N--CA 1.485 1.276 0 C-N-CA 123.379 0.672 . . . . 0.0 111.013 177.563 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 24.9 mtpp 64.84 59.43 0.9 Allowed 'General case' 0 CA--C 1.545 0.763 0 C-N-CA 124.578 1.151 . . . . 0.0 109.908 -170.692 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 0.507 ' HA ' HG11 ' A' ' 69' ' ' VAL . 84.6 mt -83.49 -0.34 49.78 Favored 'General case' 0 N--CA 1.489 1.518 0 C-N-CA 124.11 0.964 . . . . 0.0 110.848 175.771 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -82.47 158.83 23.07 Favored 'General case' 0 C--O 1.242 0.672 0 C-N-CA 124.631 1.172 . . . . 0.0 110.751 176.093 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 85.67 -146.92 21.76 Favored Glycine 0 C--N 1.337 0.6 0 CA-C-N 115.038 -0.983 . . . . 0.0 113.466 175.91 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 78.1 m-20 -65.36 111.21 2.93 Favored 'General case' 0 N--CA 1.473 0.698 0 C-N-CA 124.182 0.993 . . . . 0.0 109.83 -175.691 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 55.1 mt -56.1 -51.45 61.95 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.107 0 O-C-N 124.31 1.006 . . . . 0.0 112.678 -169.015 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 67' ' ' LYS . . . . . 0.566 ' H ' ' HD2' ' A' ' 67' ' ' LYS . 0.0 OUTLIER -71.69 -32.07 67.44 Favored 'General case' 0 N--CA 1.485 1.293 0 C-N-CA 123.183 0.593 . . . . 0.0 110.28 -174.634 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 49.0 t30 -62.82 -35.67 80.66 Favored 'General case' 0 N--CA 1.482 1.127 0 CA-C-N 115.277 -0.874 . . . . 0.0 110.846 175.326 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 69' ' ' VAL . . . . . 0.507 HG11 ' HA ' ' A' ' 62' ' ' LEU . 64.6 t -73.85 -41.28 53.76 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.859 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.145 172.058 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 70' ' ' ALA . . . . . 0.526 ' HA ' ' HB3' ' A' ' 73' ' ' ALA . . . -69.94 -1.94 11.04 Favored 'General case' 0 N--CA 1.487 1.393 0 C-N-CA 124.377 1.071 . . . . 0.0 113.417 -174.172 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 64.0 pttt -75.91 -33.71 59.91 Favored 'General case' 0 N--CA 1.478 0.966 0 CA-C-N 118.06 0.391 . . . . 0.0 110.131 174.081 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 10.0 t -115.16 -13.92 11.77 Favored 'General case' 0 N--CA 1.472 0.641 0 C-N-CA 123.988 0.915 . . . . 0.0 110.626 -176.906 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 73' ' ' ALA . . . . . 0.526 ' HB3' ' HA ' ' A' ' 70' ' ' ALA . . . -78.25 94.19 4.75 Favored 'General case' 0 C--N 1.343 0.317 0 N-CA-C 108.976 -0.75 . . . . 0.0 108.976 174.16 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 27.8 p-10 -74.25 155.54 38.17 Favored 'General case' 0 C--O 1.244 0.79 0 N-CA-C 109.372 -0.603 . . . . 0.0 109.372 176.33 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 4.6 tppp? -56.54 -39.05 72.76 Favored 'General case' 0 CA--C 1.549 0.916 0 C-N-CA 123.82 0.848 . . . . 0.0 111.846 -174.476 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 25.9 t70 -59.42 -49.5 77.54 Favored 'General case' 0 N--CA 1.476 0.869 0 C-N-CA 124.055 0.942 . . . . 0.0 112.333 -177.215 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 8.7 t60 -70.76 -28.12 64.45 Favored 'General case' 0 N--CA 1.476 0.869 0 C-N-CA 123.327 0.651 . . . . 0.0 110.696 -176.717 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 78' ' ' LEU . . . . . 0.463 HD21 ' HB1' ' A' ' 73' ' ' ALA . 82.4 mt -68.72 -33.61 74.23 Favored 'General case' 0 N--CA 1.478 0.925 0 C-N-CA 122.824 0.449 . . . . 0.0 111.972 176.266 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 57.1 t -66.03 -45.48 90.63 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.702 0 O-C-N 124.031 0.832 . . . . 0.0 109.653 171.227 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 33.8 m -58.63 -40.1 82.41 Favored 'General case' 0 N--CA 1.479 1.004 0 C-N-CA 123.855 0.862 . . . . 0.0 111.209 177.571 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -69.55 -46.66 65.93 Favored 'General case' 0 N--CA 1.469 0.514 0 C-N-CA 123.858 0.863 . . . . 0.0 110.527 178.142 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 82' ' ' TYR . . . . . . . . . . . . . 10.6 t80 -52.05 -54.8 25.75 Favored 'General case' 0 N--CA 1.475 0.816 0 C-N-CA 124.857 1.263 . . . . 0.0 110.997 179.349 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 83' ' ' ASN . . . . . . . . . . . . . 62.3 m-80 -65.0 -38.16 90.05 Favored 'General case' 0 N--CA 1.478 0.953 0 C-N-CA 122.825 0.45 . . . . 0.0 111.511 -177.609 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 32.1 m170 -66.64 -26.14 66.92 Favored 'General case' 0 N--CA 1.484 1.269 0 C-N-CA 123.729 0.811 . . . . 0.0 112.054 177.993 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 37.9 tp -58.52 -52.67 64.66 Favored 'General case' 0 N--CA 1.478 0.959 0 CA-C-O 121.386 0.613 . . . . 0.0 110.538 176.948 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 28.6 m-85 -75.44 -32.56 60.72 Favored 'General case' 0 N--CA 1.47 0.562 0 CA-C-N 114.261 -1.336 . . . . 0.0 111.771 -179.11 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 35.9 tt0 -55.99 -45.58 78.95 Favored 'General case' 0 N--CA 1.484 1.229 0 C-N-CA 123.941 0.896 . . . . 0.0 112.306 -172.664 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 16.5 p -112.77 3.41 16.46 Favored 'General case' 0 N--CA 1.477 0.908 0 C-N-CA 123.91 0.884 . . . . 0.0 111.393 178.194 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 47.9 mtpt 52.75 64.66 1.77 Allowed 'General case' 0 N--CA 1.479 0.977 0 C-N-CA 124.664 1.186 . . . . 0.0 110.612 179.182 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 90' ' ' ARG . . . . . 0.455 HH11 ' HD1' ' A' ' 56' ' ' PHE . 99.3 mtt180 -78.5 -33.19 48.27 Favored 'General case' 0 N--CA 1.473 0.701 0 CA-C-N 114.561 -1.199 . . . . 0.0 112.099 -172.374 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 91' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -51.41 160.73 0.54 Allowed 'General case' 0 N--CA 1.483 1.188 0 C-N-CA 124.116 0.966 . . . . 0.0 113.436 178.353 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 92' ' ' LYS . . . . . 0.588 ' HA ' ' HE2' ' A' ' 92' ' ' LYS . 11.0 mmpt? . . . . . 0 C--O 1.254 1.305 0 C-N-CA 124.33 1.052 . . . . 0.0 111.825 178.421 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 20' ' ' MET . . . . . 0.415 ' SD ' ' N ' ' A' ' 20' ' ' MET . 1.1 pmm? . . . . . 0 N--CA 1.476 0.829 0 N-CA-C 109.548 -0.538 . . . . 0.0 109.548 . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -98.92 133.66 42.88 Favored 'General case' 0 N--CA 1.476 0.831 0 C-N-CA 123.582 0.753 . . . . 0.0 109.872 -178.884 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -69.27 91.73 0.54 Allowed 'General case' 0 N--CA 1.472 0.652 0 CA-C-O 121.272 0.558 . . . . 0.0 110.021 178.298 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -128.08 35.51 4.43 Favored 'General case' 0 N--CA 1.472 0.662 0 C-N-CA 124.331 1.052 . . . . 0.0 108.738 178.612 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 21.9 m -73.39 147.66 87.66 Favored Pre-proline 0 CA--C 1.55 0.962 0 CA-C-N 114.748 -1.115 . . . . 0.0 110.492 -175.546 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 36.8 Cg_endo -65.1 109.13 1.26 Allowed 'Trans proline' 0 C--N 1.371 1.754 0 C-N-CA 122.127 1.884 . . . . 0.0 111.282 175.139 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 68.0 mt-30 -90.71 170.71 9.91 Favored 'General case' 0 N--CA 1.475 0.82 0 CA-C-N 114.668 -1.151 . . . . 0.0 108.063 174.704 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 27' ' ' ARG . . . . . 0.535 ' HB2' ' OH ' ' A' ' 82' ' ' TYR . 0.0 OUTLIER -62.06 139.34 58.44 Favored 'General case' 0 N--CA 1.477 0.895 0 CA-C-O 120.889 0.376 . . . . 0.0 111.521 179.577 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -101.51 -43.3 5.95 Favored 'General case' 0 N--CA 1.475 0.818 0 C-N-CA 123.591 0.756 . . . . 0.0 110.878 -174.489 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 29' ' ' TRP . . . . . . . . . . . . . 3.7 m-90 -101.76 152.64 20.63 Favored 'General case' 0 N--CA 1.474 0.731 0 C-N-CA 124.554 1.142 . . . . 0.0 111.605 -169.43 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 64.9 p -92.09 174.16 7.46 Favored 'General case' 0 CA--C 1.542 0.657 0 C-N-CA 123.511 0.724 . . . . 0.0 109.505 170.963 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 31' ' ' VAL . . . . . 0.428 ' HA ' HD12 ' A' ' 34' ' ' LEU . 12.4 p -56.11 -37.97 51.58 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.36 0 C-N-CA 123.379 0.672 . . . . 0.0 111.973 -177.674 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 32' ' ' GLU . . . . . 0.41 ' HA ' ' HG2' ' A' ' 35' ' ' ARG . 10.0 pt-20 -73.61 -35.92 65.41 Favored 'General case' 0 N--CA 1.474 0.727 0 C-N-CA 123.666 0.787 . . . . 0.0 111.843 -178.994 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 1.1 mp0 -66.64 -33.42 75.61 Favored 'General case' 0 N--CA 1.482 1.149 0 C-N-CA 122.839 0.455 . . . . 0.0 110.652 176.144 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.543 HD13 ' HA ' ' A' ' 79' ' ' VAL . 79.4 mt -65.48 -50.72 64.28 Favored 'General case' 0 N--CA 1.48 1.041 0 CA-C-O 121.302 0.572 . . . . 0.0 111.127 177.131 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 35' ' ' ARG . . . . . 0.41 ' HG2' ' HA ' ' A' ' 32' ' ' GLU . 13.8 ptm180 -74.34 -11.51 60.28 Favored 'General case' 0 CA--C 1.548 0.892 0 CA-C-N 114.727 -1.124 . . . . 0.0 112.073 -175.786 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 48.3 t -64.73 143.98 57.55 Favored 'General case' 0 CA--C 1.553 1.079 0 C-N-CA 123.497 0.719 . . . . 0.0 111.113 173.65 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 13.9 pt-20 -73.71 -27.99 61.49 Favored 'General case' 0 N--CA 1.481 1.078 0 C-N-CA 123.307 0.643 . . . . 0.0 110.489 175.816 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 92.9 mt-30 -63.16 -31.16 72.24 Favored 'General case' 0 N--CA 1.474 0.773 0 C-N-CA 124.982 1.313 . . . . 0.0 110.868 -177.18 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.44 HD23 ' HA ' ' A' ' 34' ' ' LEU . 48.7 tp -92.04 109.16 35.54 Favored Pre-proline 0 CA--C 1.549 0.92 0 N-CA-C 108.362 -0.977 . . . . 0.0 108.362 170.713 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 40' ' ' PRO . . . . . 0.498 ' HG2' ' HB2' ' A' ' 43' ' ' ASP . 47.3 Cg_endo -68.61 151.11 75.23 Favored 'Trans proline' 0 C--N 1.378 2.081 0 C-N-CA 122.821 2.347 . . . . 0.0 112.466 -178.587 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 49.7 mtmt -58.21 -42.72 86.84 Favored 'General case' 0 N--CA 1.477 0.883 0 C-N-CA 123.983 0.913 . . . . 0.0 111.325 -179.806 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 17.8 ptpt -63.52 -34.34 77.57 Favored 'General case' 0 CA--C 1.542 0.669 0 CA-C-N 114.442 -1.254 . . . . 0.0 111.763 -176.274 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 43' ' ' ASP . . . . . 0.498 ' HB2' ' HG2' ' A' ' 40' ' ' PRO . 14.0 t70 -73.99 -30.83 62.69 Favored 'General case' 0 N--CA 1.48 1.048 0 O-C-N 123.109 0.256 . . . . 0.0 110.847 -176.941 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 44' ' ' ILE . . . . . 0.605 HD12 HD13 ' A' ' 78' ' ' LEU . 42.8 mt -70.22 -52.16 32.54 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.973 0 C-N-CA 122.827 0.451 . . . . 0.0 110.033 177.036 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 69.5 mt -55.64 -41.84 66.43 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.537 0 C-N-CA 123.612 0.765 . . . . 0.0 110.581 177.008 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 35.1 ttmt -56.25 -48.38 76.64 Favored 'General case' 0 N--CA 1.474 0.763 0 C-N-CA 124.737 1.215 . . . . 0.0 111.241 178.036 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 15.9 t80 -61.37 -46.48 90.02 Favored 'General case' 0 N--CA 1.474 0.74 0 CA-C-N 115.045 -0.979 . . . . 0.0 110.903 178.021 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 88.5 mt -69.42 -32.56 71.61 Favored 'General case' 0 N--CA 1.473 0.705 0 C-N-CA 123.544 0.738 . . . . 0.0 112.14 -174.704 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 3.1 pt20 -82.29 -26.33 33.19 Favored 'General case' 0 N--CA 1.479 0.979 0 CA-C-O 120.779 0.323 . . . . 0.0 110.716 178.788 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 11.3 tp10 -63.43 -26.27 68.66 Favored 'General case' 0 N--CA 1.48 1.046 0 C-N-CA 124.068 0.947 . . . . 0.0 112.07 -176.933 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 51' ' ' HIS . . . . . 0.462 ' O ' ' HG2' ' A' ' 92' ' ' LYS . 0.4 OUTLIER -136.22 -24.94 1.22 Allowed 'General case' 0 N--CA 1.487 1.404 0 N-CA-C 113.428 0.899 . . . . 0.0 113.428 178.764 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -58.04 131.68 52.17 Favored Glycine 0 C--N 1.346 1.089 0 CA-C-N 118.426 0.557 . . . . 0.0 112.761 174.118 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 48.2 t -64.36 160.14 19.63 Favored 'General case' 0 N--CA 1.477 0.914 0 C-N-CA 123.014 0.525 . . . . 0.0 111.34 -177.51 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 4.8 m-20 -56.95 -38.19 72.6 Favored 'General case' 0 N--CA 1.482 1.167 0 C-N-CA 124.111 0.964 . . . . 0.0 111.003 -178.587 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 28.2 t -65.98 -36.45 83.34 Favored 'General case' 0 CA--C 1.548 0.891 0 CA-C-N 114.175 -1.375 . . . . 0.0 110.847 -179.468 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 88.5 t80 -70.75 -51.12 29.23 Favored 'General case' 0 N--CA 1.476 0.862 0 C-N-CA 123.102 0.561 . . . . 0.0 110.099 175.791 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 57' ' ' LEU . . . . . 0.449 HD22 ' HB2' ' A' ' 62' ' ' LEU . 73.1 mt -62.78 -31.8 72.84 Favored 'General case' 0 N--CA 1.474 0.771 0 CA-C-N 115.19 -0.913 . . . . 0.0 111.561 -173.633 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -62.09 -49.5 75.68 Favored 'General case' 0 N--CA 1.476 0.862 0 C-N-CA 123.587 0.755 . . . . 0.0 111.443 177.286 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 36.1 mt-10 -57.4 -48.74 78.29 Favored 'General case' 0 N--CA 1.483 1.224 0 C-N-CA 123.81 0.844 . . . . 0.0 110.555 179.357 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 64.2 m80 -95.67 1.95 53.79 Favored 'General case' 0 N--CA 1.477 0.876 0 CA-C-N 114.86 -1.064 . . . . 0.0 111.974 -170.532 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 39.4 mtmm 57.34 27.46 13.8 Favored 'General case' 0 N--CA 1.492 1.666 0 C-N-CA 124.496 1.118 . . . . 0.0 112.797 176.951 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 0.456 HD11 ' HB1' ' A' ' 81' ' ' ALA . 85.1 mt -82.32 -11.61 58.5 Favored 'General case' 0 N--CA 1.483 1.183 0 C-N-CA 123.298 0.639 . . . . 0.0 111.671 -176.012 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 2.9 pp -79.54 158.45 27.17 Favored 'General case' 0 N--CA 1.475 0.806 0 CA-C-O 121.103 0.478 . . . . 0.0 110.724 175.347 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 93.42 -168.52 29.58 Favored Glycine 0 C--N 1.339 0.74 0 CA-C-N 115.313 -0.858 . . . . 0.0 112.774 179.76 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 65' ' ' ASN . . . . . 0.416 ' O ' HG23 ' A' ' 69' ' ' VAL . 51.5 t-20 -59.7 111.87 1.6 Allowed 'General case' 0 N--CA 1.478 0.974 0 C-N-CA 124.08 0.952 . . . . 0.0 109.593 -177.521 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 39.8 mt -55.36 -42.69 68.18 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.58 0 C-N-CA 123.873 0.869 . . . . 0.0 111.307 -171.652 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 17.5 mtpp -55.96 -45.73 78.8 Favored 'General case' 0 CA--C 1.545 0.781 0 C-N-CA 124.466 1.106 . . . . 0.0 111.156 178.277 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 2.1 m-20 -74.13 -33.09 63.43 Favored 'General case' 0 N--CA 1.481 1.083 0 C-N-CA 123.31 0.644 . . . . 0.0 111.121 -178.909 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 69' ' ' VAL . . . . . 0.416 HG23 ' O ' ' A' ' 65' ' ' ASN . 89.8 t -63.03 -44.06 99.4 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.061 0 C-N-CA 123.367 0.667 . . . . 0.0 109.936 174.393 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -67.04 -5.18 12.01 Favored 'General case' 0 N--CA 1.484 1.268 0 C-N-CA 124.742 1.217 . . . . 0.0 112.709 -176.101 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 85.6 tttt -72.27 -50.68 25.34 Favored 'General case' 0 CA--C 1.545 0.754 0 C-N-CA 122.738 0.415 . . . . 0.0 109.912 173.908 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 14.5 t -91.53 -21.33 20.93 Favored 'General case' 0 N--CA 1.473 0.716 0 C-N-CA 123.374 0.67 . . . . 0.0 110.889 179.56 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -85.44 85.31 7.44 Favored 'General case' 0 C--O 1.241 0.653 0 CA-C-O 121.681 0.753 . . . . 0.0 109.407 178.428 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 74' ' ' ASN . . . . . 0.455 ' O ' ' HG ' ' A' ' 78' ' ' LEU . 28.0 p-10 -74.92 172.83 11.55 Favored 'General case' 0 N--CA 1.474 0.763 0 CA-C-N 114.494 -1.23 . . . . 0.0 109.885 176.854 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 75' ' ' LYS . . . . . 0.501 ' HA ' HD12 ' A' ' 78' ' ' LEU . 1.9 tpmt? -54.27 -40.73 68.1 Favored 'General case' 0 CA--C 1.552 1.05 0 C-N-CA 123.867 0.867 . . . . 0.0 111.519 -176.056 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 34.8 t70 -64.68 -40.38 95.3 Favored 'General case' 0 N--CA 1.478 0.943 0 C-N-CA 124.293 1.037 . . . . 0.0 112.122 179.457 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 34.5 t60 -59.35 -42.89 92.58 Favored 'General case' 0 N--CA 1.485 1.32 0 C-N-CA 124.076 0.951 . . . . 0.0 110.363 178.974 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 78' ' ' LEU . . . . . 0.605 HD13 HD12 ' A' ' 44' ' ' ILE . 34.0 mt -60.32 -46.26 90.51 Favored 'General case' 0 C--O 1.218 -0.578 0 CA-C-N 114.296 -1.32 . . . . 0.0 111.377 -176.174 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 79' ' ' VAL . . . . . 0.543 ' HA ' HD13 ' A' ' 34' ' ' LEU . 60.2 t -63.68 -46.84 93.59 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.631 0 O-C-N 124.367 1.042 . . . . 0.0 110.743 -178.728 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 34.5 m -60.05 -50.51 73.44 Favored 'General case' 0 N--CA 1.478 0.94 0 CA-C-N 115.61 -0.723 . . . . 0.0 111.259 179.392 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 81' ' ' ALA . . . . . 0.456 ' HB1' HD11 ' A' ' 62' ' ' LEU . . . -66.4 -43.55 85.51 Favored 'General case' 0 N--CA 1.474 0.747 0 C-N-CA 123.767 0.827 . . . . 0.0 111.31 -177.286 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 82' ' ' TYR . . . . . 0.535 ' OH ' ' HB2' ' A' ' 27' ' ' ARG . 78.6 t80 -58.22 -58.93 6.3 Favored 'General case' 0 N--CA 1.473 0.721 0 C-N-CA 124.024 0.93 . . . . 0.0 110.379 -178.262 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 83' ' ' ASN . . . . . . . . . . . . . 16.6 m-80 -59.47 -39.69 84.51 Favored 'General case' 0 N--CA 1.48 1.063 0 C-N-CA 123.546 0.738 . . . . 0.0 111.011 -175.042 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 3.7 m-70 -65.07 -33.89 77.11 Favored 'General case' 0 N--CA 1.478 0.943 0 C-N-CA 123.765 0.826 . . . . 0.0 112.605 179.969 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 40.6 tp -59.18 -52.1 67.16 Favored 'General case' 0 N--CA 1.479 1.021 0 CA-C-O 121.519 0.676 . . . . 0.0 110.847 -176.811 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 86' ' ' PHE . . . . . 0.431 ' HA ' ' HE2' ' A' ' 91' ' ' PHE . 21.6 m-85 -76.27 -29.47 57.44 Favored 'General case' 0 N--CA 1.473 0.702 0 CA-C-N 114.106 -1.406 . . . . 0.0 111.165 -177.933 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 11.2 tp10 -61.01 -27.65 68.47 Favored 'General case' 0 N--CA 1.48 1.045 0 C-N-CA 124.734 1.214 . . . . 0.0 111.981 -179.905 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 31.5 p -128.46 -4.37 5.4 Favored 'General case' 0 N--CA 1.484 1.231 0 C-N-CA 123.74 0.816 . . . . 0.0 111.613 -177.761 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 44.7 mtmt 58.05 50.15 10.54 Favored 'General case' 0 N--CA 1.485 1.317 0 C-N-CA 124.614 1.166 . . . . 0.0 112.168 178.687 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 99.5 mtt180 -80.93 -5.43 57.45 Favored 'General case' 0 N--CA 1.481 1.077 0 CA-C-N 115.698 -0.683 . . . . 0.0 111.627 178.208 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 91' ' ' PHE . . . . . 0.431 ' HE2' ' HA ' ' A' ' 86' ' ' PHE . 48.9 p90 -71.98 163.61 27.56 Favored 'General case' 0 N--CA 1.474 0.763 0 C-N-CA 123.53 0.732 . . . . 0.0 110.674 167.416 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 92' ' ' LYS . . . . . 0.462 ' HG2' ' O ' ' A' ' 51' ' ' HIS . 32.2 mmmt . . . . . 0 C--O 1.252 1.194 0 C-N-CA 123.466 0.707 . . . . 0.0 110.674 -176.226 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 20' ' ' MET . . . . . . . . . . . . . 77.8 mtp . . . . . 0 N--CA 1.483 1.207 0 N-CA-C 110.168 -0.308 . . . . 0.0 110.168 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -88.18 155.97 19.48 Favored 'General case' 0 C--O 1.244 0.794 0 N-CA-C 109.303 -0.628 . . . . 0.0 109.303 169.481 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -71.5 114.66 9.81 Favored 'General case' 0 N--CA 1.47 0.574 0 C-N-CA 123.42 0.688 . . . . 0.0 109.904 178.851 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -75.7 78.36 2.67 Favored 'General case' 0 N--CA 1.471 0.621 0 C-N-CA 123.215 0.606 . . . . 0.0 109.513 174.426 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 6.1 m -117.58 79.85 12.85 Favored Pre-proline 0 CA--C 1.551 0.993 0 C-N-CA 124.239 1.015 . . . . 0.0 109.404 -176.811 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 61.3 Cg_endo -68.92 117.09 4.81 Favored 'Trans proline' 0 C--N 1.375 1.924 0 C-N-CA 122.993 2.462 . . . . 0.0 112.521 -173.602 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 88.0 mt-30 -78.73 154.09 30.33 Favored 'General case' 0 C--O 1.248 0.986 0 N-CA-C 108.144 -1.058 . . . . 0.0 108.144 170.352 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -59.47 141.08 55.52 Favored 'General case' 0 CA--C 1.542 0.664 0 O-C-N 123.508 0.505 . . . . 0.0 111.177 178.604 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -85.1 -42.4 14.83 Favored 'General case' 0 N--CA 1.474 0.753 0 C-N-CA 123.5 0.72 . . . . 0.0 109.423 178.197 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 29' ' ' TRP . . . . . . . . . . . . . 6.6 m-90 -123.48 153.7 40.14 Favored 'General case' 0 N--CA 1.476 0.835 0 C-N-CA 124.571 1.148 . . . . 0.0 108.935 177.966 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 30' ' ' THR . . . . . 0.426 ' O ' ' HG ' ' A' ' 34' ' ' LEU . 55.9 p -87.49 170.59 11.21 Favored 'General case' 0 N--CA 1.475 0.812 0 C-N-CA 123.007 0.523 . . . . 0.0 110.095 -178.92 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 8.1 p -56.13 -46.23 80.98 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.312 0 C-N-CA 123.909 0.884 . . . . 0.0 113.206 -168.435 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 1.2 pm0 -75.77 -29.85 58.93 Favored 'General case' 0 N--CA 1.48 1.035 0 C-N-CA 123.615 0.766 . . . . 0.0 111.416 178.553 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 43.1 mt-30 -62.63 -29.04 70.33 Favored 'General case' 0 N--CA 1.491 1.605 0 CA-C-N 118.227 0.467 . . . . 0.0 110.705 172.538 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.43 ' HA ' HD23 ' A' ' 39' ' ' LEU . 42.1 mt -72.85 -39.61 66.38 Favored 'General case' 0 N--CA 1.472 0.662 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.49 174.798 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 47.5 mtm105 -71.68 -20.23 61.96 Favored 'General case' 0 N--CA 1.478 0.945 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.967 176.444 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 46.9 t -64.23 123.25 18.63 Favored 'General case' 0 C--O 1.238 0.494 0 C-N-CA 123.455 0.702 . . . . 0.0 110.334 179.819 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 33.4 mt-10 -62.58 -19.22 63.48 Favored 'General case' 0 CA--C 1.547 0.836 0 C-N-CA 124.484 1.114 . . . . 0.0 111.512 178.909 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 82.9 mt-30 -61.8 -50.29 72.91 Favored 'General case' 0 N--CA 1.472 0.633 0 C-N-CA 124.37 1.068 . . . . 0.0 110.341 176.487 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.43 HD23 ' HA ' ' A' ' 34' ' ' LEU . 62.1 tp -72.62 123.67 89.83 Favored Pre-proline 0 CA--C 1.55 0.948 0 CA-C-N 115.396 -0.82 . . . . 0.0 109.783 -178.917 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 39.9 Cg_exo -61.7 149.43 89.97 Favored 'Trans proline' 0 C--N 1.378 2.095 0 C-N-CA 123.157 2.571 . . . . 0.0 113.532 175.105 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 41' ' ' LYS . . . . . 0.633 ' HG2' ' HD3' ' A' ' 75' ' ' LYS . 42.4 mtpt -67.01 -43.51 82.68 Favored 'General case' 0 N--CA 1.477 0.897 0 C-N-CA 124.321 1.048 . . . . 0.0 110.211 179.05 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 11.9 ptmm? -56.18 -36.63 68.57 Favored 'General case' 0 N--CA 1.476 0.859 0 C-N-CA 125.193 1.397 . . . . 0.0 112.864 179.458 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -64.87 -41.08 95.94 Favored 'General case' 0 N--CA 1.476 0.871 0 O-C-N 123.753 0.658 . . . . 0.0 111.281 179.888 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 43.8 mt -67.35 -48.23 78.46 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.961 0 C-N-CA 122.927 0.491 . . . . 0.0 110.085 179.206 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 82.1 mt -59.5 -43.96 91.86 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.05 0 CA-C-N 115.529 -0.76 . . . . 0.0 110.795 -179.875 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 88.3 tttt -63.81 -37.61 88.03 Favored 'General case' 0 N--CA 1.476 0.864 0 O-C-N 123.972 0.795 . . . . 0.0 111.159 -179.859 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 37.8 t80 -63.51 -54.03 42.76 Favored 'General case' 0 N--CA 1.477 0.901 0 CA-C-N 115.266 -0.879 . . . . 0.0 110.638 176.185 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 86.6 mt -68.65 -30.74 69.5 Favored 'General case' 0 N--CA 1.478 0.94 0 C-N-CA 123.642 0.777 . . . . 0.0 111.892 -173.108 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 49' ' ' GLN . . . . . 0.578 ' HA ' HD21 ' A' ' 57' ' ' LEU . 3.5 pt20 -81.62 -26.6 34.72 Favored 'General case' 0 N--CA 1.483 1.185 0 N-CA-C 111.62 0.23 . . . . 0.0 111.62 -179.085 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 12.1 tp10 -62.07 -38.7 89.8 Favored 'General case' 0 N--CA 1.479 1.014 0 C-N-CA 123.7 0.8 . . . . 0.0 111.815 -179.118 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 16.5 p80 -122.09 -25.67 4.88 Favored 'General case' 0 N--CA 1.493 1.71 0 N-CA-C 112.814 0.672 . . . . 0.0 112.814 -175.832 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 52' ' ' GLY . . . . . 0.493 ' HA2' ' HA ' ' A' ' 91' ' ' PHE . . . -61.54 139.58 47.12 Favored Glycine 0 C--N 1.347 1.145 0 CA-C-O 119.628 -0.54 . . . . 0.0 112.374 173.761 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 53' ' ' SER . . . . . 0.476 ' O ' ' HG ' ' A' ' 57' ' ' LEU . 28.7 t -63.57 151.88 40.26 Favored 'General case' 0 N--CA 1.481 1.084 0 C-N-CA 123.523 0.729 . . . . 0.0 111.476 -179.008 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 26.9 t70 -55.45 -37.04 67.2 Favored 'General case' 0 N--CA 1.483 1.189 0 O-C-N 124.309 1.006 . . . . 0.0 111.727 178.046 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 46.0 m -66.13 -42.19 89.45 Favored 'General case' 0 CA--C 1.543 0.71 0 O-C-N 123.84 0.712 . . . . 0.0 111.142 177.312 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 56' ' ' PHE . . . . . 0.43 ' HB2' ' HB3' ' A' ' 90' ' ' ARG . 27.6 t80 -60.57 -41.86 95.48 Favored 'General case' 0 N--CA 1.482 1.174 0 C-N-CA 123.714 0.805 . . . . 0.0 110.365 174.497 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 57' ' ' LEU . . . . . 0.578 HD21 ' HA ' ' A' ' 49' ' ' GLN . 65.0 mt -69.95 -37.73 75.92 Favored 'General case' 0 N--CA 1.47 0.539 0 CA-C-N 115.514 -0.767 . . . . 0.0 111.079 -176.815 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -67.38 -49.2 64.91 Favored 'General case' 0 N--CA 1.482 1.142 0 C-N-CA 123.332 0.653 . . . . 0.0 110.865 -179.74 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 47.1 mt-10 -59.87 -32.04 70.34 Favored 'General case' 0 N--CA 1.477 0.885 0 CA-C-N 115.318 -0.855 . . . . 0.0 111.96 178.183 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 41.1 m80 -116.13 14.39 15.95 Favored 'General case' 0 N--CA 1.485 1.278 0 N-CA-C 112.881 0.697 . . . . 0.0 112.881 -174.805 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 57.6 mttp 57.07 20.6 5.62 Favored 'General case' 0 N--CA 1.498 1.962 0 N-CA-C 114.167 1.173 . . . . 0.0 114.167 172.995 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 94.9 mt -83.64 -10.7 58.04 Favored 'General case' 0 N--CA 1.482 1.172 0 C-N-CA 122.822 0.449 . . . . 0.0 111.951 -174.847 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 2.5 pp -81.96 176.33 9.64 Favored 'General case' 0 N--CA 1.481 1.112 0 CA-C-O 121.31 0.576 . . . . 0.0 111.144 175.481 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 90.17 -148.9 19.97 Favored Glycine 0 C--N 1.336 0.583 0 CA-C-N 114.686 -1.143 . . . . 0.0 111.823 177.973 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 9.8 m120 -77.03 119.77 21.22 Favored 'General case' 0 N--CA 1.468 0.441 0 N-CA-C 108.68 -0.859 . . . . 0.0 108.68 176.283 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 64.1 mt -54.08 -48.06 65.49 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.051 0 C-N-CA 123.709 0.804 . . . . 0.0 110.157 178.698 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 61.3 pttt -54.12 -38.75 65.75 Favored 'General case' 0 N--CA 1.485 1.293 0 C-N-CA 124.022 0.929 . . . . 0.0 112.461 178.563 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 8.1 t30 -68.32 -45.64 72.41 Favored 'General case' 0 N--CA 1.478 0.941 0 C-N-CA 123.319 0.647 . . . . 0.0 110.692 179.524 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 69' ' ' VAL . . . . . 0.445 ' HA ' HG22 ' A' ' 72' ' ' THR . 44.9 t -71.94 -31.88 42.22 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.974 0 CA-C-N 115.58 -0.737 . . . . 0.0 110.714 -178.075 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -73.09 -14.94 61.49 Favored 'General case' 0 N--CA 1.479 1.007 0 C-N-CA 123.697 0.799 . . . . 0.0 112.212 -177.413 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 16.8 ptpt -99.3 -48.78 4.69 Favored 'General case' 0 CA--C 1.547 0.851 0 CA-C-N 118.11 0.414 . . . . 0.0 111.41 170.605 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 72' ' ' THR . . . . . 0.445 HG22 ' HA ' ' A' ' 69' ' ' VAL . 7.6 t -73.39 -35.34 65.89 Favored 'General case' 0 N--CA 1.487 1.419 0 C-N-CA 122.937 0.495 . . . . 0.0 112.027 -171.157 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -100.92 130.55 46.94 Favored 'General case' 0 N--CA 1.472 0.669 0 C-N-CA 123.699 0.799 . . . . 0.0 109.425 177.485 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 74' ' ' ASN . . . . . 0.401 ' O ' ' HG ' ' A' ' 78' ' ' LEU . 29.1 p-10 -82.98 173.81 11.46 Favored 'General case' 0 N--CA 1.484 1.27 0 C-N-CA 123.491 0.716 . . . . 0.0 111.216 -174.45 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 75' ' ' LYS . . . . . 0.633 ' HD3' ' HG2' ' A' ' 41' ' ' LYS . 15.7 tptm -64.25 -39.8 94.7 Favored 'General case' 0 N--CA 1.477 0.898 0 C-N-CA 123.676 0.79 . . . . 0.0 111.176 -174.403 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 22.3 t70 -64.41 -38.41 90.93 Favored 'General case' 0 N--CA 1.482 1.142 0 C-N-CA 124.009 0.924 . . . . 0.0 111.053 -177.212 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 77' ' ' HIS . . . . . 0.424 ' HD2' HD23 ' A' ' 78' ' ' LEU . 33.0 t60 -55.39 -43.58 75.31 Favored 'General case' 0 N--CA 1.481 1.076 0 C-N-CA 124.696 1.198 . . . . 0.0 110.56 173.902 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 78' ' ' LEU . . . . . 0.424 HD23 ' HD2' ' A' ' 77' ' ' HIS . 25.5 mt -67.74 -40.26 84.15 Favored 'General case' 0 N--CA 1.477 0.894 0 C-N-CA 123.882 0.873 . . . . 0.0 111.103 -175.663 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 79' ' ' VAL . . . . . 0.414 HG23 ' O ' ' A' ' 75' ' ' LYS . 45.2 t -66.55 -45.01 89.79 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.821 0 C-N-CA 123.801 0.841 . . . . 0.0 110.118 179.276 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 33.1 m -60.72 -42.91 98.23 Favored 'General case' 0 N--CA 1.482 1.171 0 C-N-CA 123.599 0.76 . . . . 0.0 111.117 179.08 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -66.87 -39.9 87.69 Favored 'General case' 0 N--CA 1.476 0.868 0 C-N-CA 123.705 0.802 . . . . 0.0 110.992 178.87 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 82' ' ' TYR . . . . . 0.444 ' O ' ' HB3' ' A' ' 85' ' ' LEU . 5.5 t80 -56.67 -55.64 31.47 Favored 'General case' 0 C--O 1.218 -0.557 0 C-N-CA 124.663 1.185 . . . . 0.0 110.908 177.035 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 83' ' ' ASN . . . . . . . . . . . . . 59.7 m-80 -67.33 -40.51 85.91 Favored 'General case' 0 N--CA 1.486 1.352 0 C-N-CA 122.52 0.328 . . . . 0.0 111.143 -174.58 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 55.4 m170 -66.51 -24.3 66.37 Favored 'General case' 0 N--CA 1.483 1.222 0 C-N-CA 123.771 0.829 . . . . 0.0 111.612 177.415 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 85' ' ' LEU . . . . . 0.444 ' HB3' ' O ' ' A' ' 82' ' ' TYR . 53.9 tp -59.3 -54.73 43.44 Favored 'General case' 0 N--CA 1.479 0.982 0 CA-C-O 121.327 0.584 . . . . 0.0 110.822 175.16 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 45.0 m-85 -73.77 -30.4 62.75 Favored 'General case' 0 N--CA 1.475 0.777 0 CA-C-N 114.515 -1.22 . . . . 0.0 110.798 -176.627 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 44.3 tt0 -65.29 -24.6 67.34 Favored 'General case' 0 N--CA 1.482 1.137 0 C-N-CA 124.076 0.95 . . . . 0.0 112.48 -175.95 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 10.1 p -125.16 -4.2 7.44 Favored 'General case' 0 N--CA 1.478 0.949 0 C-N-CA 123.731 0.812 . . . . 0.0 110.921 177.765 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 94.3 mttt 56.23 49.75 14.73 Favored 'General case' 0 N--CA 1.485 1.293 0 C-N-CA 124.364 1.066 . . . . 0.0 111.48 -175.806 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 90' ' ' ARG . . . . . 0.43 ' HB3' ' HB2' ' A' ' 56' ' ' PHE . 54.4 mtt85 -68.95 -13.27 62.34 Favored 'General case' 0 N--CA 1.488 1.44 0 C-N-CA 124.791 1.237 . . . . 0.0 112.891 178.018 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 91' ' ' PHE . . . . . 0.493 ' HA ' ' HA2' ' A' ' 52' ' ' GLY . 4.2 p90 -68.14 139.96 56.16 Favored 'General case' 0 N--CA 1.475 0.816 0 C-N-CA 122.442 0.297 . . . . 0.0 110.787 175.295 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 C--O 1.256 1.406 0 C-N-CA 124.441 1.097 . . . . 0.0 108.286 172.357 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 20' ' ' MET . . . . . . . . . . . . . 25.6 ttt . . . . . 0 N--CA 1.476 0.865 0 N-CA-C 109.263 -0.643 . . . . 0.0 109.263 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -127.64 156.49 42.23 Favored 'General case' 0 N--CA 1.47 0.542 0 C-N-CA 123.549 0.74 . . . . 0.0 110.308 -178.643 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -136.94 178.0 7.42 Favored 'General case' 0 C--O 1.241 0.615 0 C-N-CA 124.052 0.941 . . . . 0.0 109.31 178.976 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -158.97 135.67 9.44 Favored 'General case' 0 C--O 1.24 0.605 0 C-N-CA 123.855 0.862 . . . . 0.0 109.325 -179.656 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 24' ' ' VAL . . . . . 0.415 ' HA ' ' HD3' ' A' ' 25' ' ' PRO . 30.8 m -76.29 131.78 74.43 Favored Pre-proline 0 CA--C 1.55 0.955 0 N-CA-C 109.245 -0.65 . . . . 0.0 109.245 172.424 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 25' ' ' PRO . . . . . 0.415 ' HD3' ' HA ' ' A' ' 24' ' ' VAL . 18.7 Cg_exo -65.09 113.71 2.51 Favored 'Trans proline' 0 C--N 1.376 2.022 0 C-N-CA 123.0 2.467 . . . . 0.0 109.946 178.355 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 76.2 mm-40 -62.21 96.48 0.07 Allowed 'General case' 0 C--O 1.241 0.654 0 N-CA-C 108.061 -1.088 . . . . 0.0 108.061 178.094 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 27.7 ptt180 -61.91 130.51 45.97 Favored 'General case' 0 CA--C 1.543 0.683 0 CA-C-N 114.149 -1.387 . . . . 0.0 110.457 -164.14 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -74.84 -22.38 58.72 Favored 'General case' 0 CA--C 1.54 0.575 0 CA-C-N 114.912 -1.04 . . . . 0.0 112.668 -167.047 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 29' ' ' TRP . . . . . 0.421 ' HB3' ' HB2' ' A' ' 33' ' ' GLN . 3.9 m-90 -138.89 150.71 46.27 Favored 'General case' 0 N--CA 1.478 0.945 0 C-N-CA 123.829 0.852 . . . . 0.0 110.902 -168.529 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 37.7 p -90.4 173.78 7.92 Favored 'General case' 0 N--CA 1.471 0.593 0 CA-C-N 115.37 -0.832 . . . . 0.0 109.05 170.404 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 31' ' ' VAL . . . . . 0.524 ' HA ' HD12 ' A' ' 34' ' ' LEU . 10.5 p -59.29 -34.3 53.57 Favored 'Isoleucine or valine' 0 CA--C 1.557 1.248 0 C-N-CA 123.741 0.816 . . . . 0.0 112.362 -174.689 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 12.5 pt-20 -70.48 -35.67 73.41 Favored 'General case' 0 N--CA 1.481 1.098 0 C-N-CA 123.589 0.756 . . . . 0.0 111.028 176.816 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 33' ' ' GLN . . . . . 0.421 ' HB2' ' HB3' ' A' ' 29' ' ' TRP . 22.5 mm-40 -72.64 -30.4 64.27 Favored 'General case' 0 CA--C 1.546 0.803 0 C-N-CA 123.103 0.561 . . . . 0.0 110.798 176.184 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.54 ' HB3' HG22 ' A' ' 79' ' ' VAL . 93.1 mt -72.27 -37.78 68.98 Favored 'General case' 0 N--CA 1.476 0.839 0 C-N-CA 123.674 0.79 . . . . 0.0 112.287 -179.0 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 12.0 ptt180 -76.43 -22.56 54.5 Favored 'General case' 0 N--CA 1.479 1.019 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.275 176.508 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 41.5 t -58.39 109.91 0.87 Allowed 'General case' 0 C--N 1.356 0.859 0 O-C-N 124.017 0.823 . . . . 0.0 111.829 -173.593 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 9.9 pt-20 -62.27 -21.08 64.93 Favored 'General case' 0 N--CA 1.484 1.261 0 C-N-CA 124.771 1.228 . . . . 0.0 112.541 179.453 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 12.0 mm100 -67.85 -32.82 73.61 Favored 'General case' 0 N--CA 1.473 0.715 0 C-N-CA 123.941 0.896 . . . . 0.0 110.356 176.437 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 3.5 tt -73.38 127.59 88.71 Favored Pre-proline 0 CA--C 1.547 0.861 0 N-CA-C 108.024 -1.102 . . . . 0.0 108.024 175.866 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 53.0 Cg_exo -55.41 126.35 22.21 Favored 'Trans proline' 0 C--N 1.378 2.088 0 C-N-CA 122.546 2.164 . . . . 0.0 112.365 174.015 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 41' ' ' LYS . . . . . 0.756 ' HG2' ' HD3' ' A' ' 75' ' ' LYS . 35.9 mtmm -58.08 -37.78 75.13 Favored 'General case' 0 N--CA 1.48 1.069 0 C-N-CA 124.348 1.059 . . . . 0.0 110.483 177.58 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 18.8 ptpt -62.19 -35.9 80.25 Favored 'General case' 0 N--CA 1.472 0.626 0 CA-C-N 114.777 -1.101 . . . . 0.0 111.9 175.498 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 30.2 t70 -69.82 -32.72 71.3 Favored 'General case' 0 CA--C 1.545 0.757 0 C-N-CA 122.444 0.298 . . . . 0.0 110.82 -174.338 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 56.2 mt -66.57 -52.4 46.45 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.148 0 N-CA-C 109.575 -0.528 . . . . 0.0 109.575 174.217 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 45' ' ' ILE . . . . . 0.48 HD13 HG12 ' A' ' 69' ' ' VAL . 76.4 mt -58.49 -33.38 48.0 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.333 0 C-N-CA 124.451 1.1 . . . . 0.0 111.654 178.95 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 33.0 ttmt -61.68 -41.94 98.24 Favored 'General case' 0 N--CA 1.48 1.028 0 C-N-CA 124.394 1.078 . . . . 0.0 110.796 179.233 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 2.0 t80 -70.89 -37.66 73.01 Favored 'General case' 0 CA--C 1.548 0.884 0 CA-C-N 114.488 -1.233 . . . . 0.0 109.858 177.698 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 48' ' ' LEU . . . . . 0.483 HD21 ' HA ' ' A' ' 82' ' ' TYR . 93.1 mt -68.89 -31.84 71.05 Favored 'General case' 0 N--CA 1.476 0.862 0 C-N-CA 123.481 0.712 . . . . 0.0 112.488 -178.73 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 49' ' ' GLN . . . . . 0.568 ' HA ' HD21 ' A' ' 57' ' ' LEU . 3.8 pt20 -85.07 -28.03 25.91 Favored 'General case' 0 N--CA 1.479 1.012 0 C-N-CA 122.103 0.161 . . . . 0.0 111.393 176.081 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 42.7 tt0 -61.22 -35.17 76.48 Favored 'General case' 0 N--CA 1.479 1.007 0 O-C-N 123.767 0.667 . . . . 0.0 111.26 -178.176 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 59.7 m-70 -112.86 -44.68 3.27 Favored 'General case' 0 N--CA 1.469 0.524 0 CA-C-N 115.798 -0.637 . . . . 0.0 110.022 -179.066 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 52' ' ' GLY . . . . . 0.422 ' HA2' ' HA ' ' A' ' 91' ' ' PHE . . . -57.07 131.28 51.97 Favored Glycine 0 C--N 1.354 1.564 0 O-C-N 123.912 0.757 . . . . 0.0 114.318 -175.328 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 44.1 m -72.58 166.12 23.34 Favored 'General case' 0 CA--C 1.54 0.57 0 C-N-CA 124.07 0.948 . . . . 0.0 111.736 -177.159 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 23.3 t70 -54.17 -38.77 65.93 Favored 'General case' 0 N--CA 1.481 1.083 0 CA-C-N 115.001 -0.999 . . . . 0.0 112.574 -175.233 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 20.2 t -67.05 -37.98 85.04 Favored 'General case' 0 CA--C 1.55 0.966 0 O-C-N 123.55 0.531 . . . . 0.0 111.098 -179.532 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 56' ' ' PHE . . . . . 0.501 ' HD1' HH11 ' A' ' 90' ' ' ARG . 53.4 t80 -67.02 -41.04 87.3 Favored 'General case' 0 N--CA 1.486 1.332 0 C-N-CA 123.632 0.773 . . . . 0.0 110.109 176.049 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 57' ' ' LEU . . . . . 0.568 HD21 ' HA ' ' A' ' 49' ' ' GLN . 39.0 mt -69.56 -55.25 10.68 Favored 'General case' 0 N--CA 1.471 0.595 0 CA-C-N 115.829 -0.623 . . . . 0.0 110.666 -175.802 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -61.55 -29.1 69.79 Favored 'General case' 0 N--CA 1.487 1.386 0 C-N-CA 124.394 1.078 . . . . 0.0 112.742 -174.109 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 50.6 mt-10 -54.39 -45.64 72.94 Favored 'General case' 0 N--CA 1.484 1.246 0 C-N-CA 122.798 0.439 . . . . 0.0 111.497 174.508 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 37.5 t-80 -114.07 4.14 15.54 Favored 'General case' 0 N--CA 1.48 1.042 0 C-N-CA 122.845 0.458 . . . . 0.0 111.345 -176.104 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 32.5 mmtp 49.29 60.5 3.72 Favored 'General case' 0 N--CA 1.476 0.831 0 C-N-CA 124.672 1.189 . . . . 0.0 111.301 -171.867 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 0.52 ' HA ' HG11 ' A' ' 69' ' ' VAL . 95.2 mt -85.17 -14.77 45.89 Favored 'General case' 0 N--CA 1.481 1.11 0 CA-C-N 115.013 -0.994 . . . . 0.0 110.214 174.417 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 1.1 pp -76.66 171.11 15.22 Favored 'General case' 0 CA--C 1.545 0.769 0 C-N-CA 124.098 0.959 . . . . 0.0 110.739 173.556 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 88.4 -146.62 19.62 Favored Glycine 0 C--N 1.341 0.821 0 CA-C-N 115.61 -0.723 . . . . 0.0 111.921 -179.922 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 65' ' ' ASN . . . . . 0.414 ' O ' HG23 ' A' ' 69' ' ' VAL . 38.8 m-80 -72.73 113.12 9.41 Favored 'General case' 0 N--CA 1.478 0.947 0 N-CA-C 108.578 -0.897 . . . . 0.0 108.578 175.228 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 17.9 mt -55.9 -39.63 57.98 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.208 0 O-C-N 124.266 0.979 . . . . 0.0 110.335 -177.5 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 60.9 pttt -60.9 -39.76 90.54 Favored 'General case' 0 N--CA 1.478 0.961 0 C-N-CA 124.928 1.291 . . . . 0.0 112.246 178.302 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 28.3 t-20 -73.86 -36.47 64.86 Favored 'General case' 0 N--CA 1.477 0.899 0 C-N-CA 123.704 0.802 . . . . 0.0 109.984 -177.061 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 69' ' ' VAL . . . . . 0.52 HG11 ' HA ' ' A' ' 62' ' ' LEU . 58.7 t -63.53 -45.55 97.46 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.622 0 CA-C-N 114.984 -1.007 . . . . 0.0 109.522 172.17 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -67.59 -17.95 64.81 Favored 'General case' 0 N--CA 1.477 0.925 0 C-N-CA 124.582 1.153 . . . . 0.0 112.363 -177.068 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 25.3 ttpp -76.43 -43.66 39.19 Favored 'General case' 0 CA--C 1.539 0.55 0 C-N-CA 123.122 0.569 . . . . 0.0 110.469 175.524 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 15.1 t -99.94 -9.6 22.61 Favored 'General case' 0 CA--C 1.558 1.286 0 C-N-CA 123.848 0.859 . . . . 0.0 113.092 -171.304 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -87.79 160.02 18.2 Favored 'General case' 0 N--CA 1.484 1.25 0 C-N-CA 123.257 0.623 . . . . 0.0 110.553 179.544 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 50.4 t30 -110.16 129.99 55.62 Favored 'General case' 0 N--CA 1.48 1.066 0 C-N-CA 124.3 1.04 . . . . 0.0 109.321 -175.822 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 75' ' ' LYS . . . . . 0.756 ' HD3' ' HG2' ' A' ' 41' ' ' LYS . 22.7 tptp -59.48 -40.23 86.29 Favored 'General case' 0 N--CA 1.492 1.652 0 C-N-CA 123.977 0.911 . . . . 0.0 112.165 -169.932 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 3.5 p30 -74.74 -29.02 61.02 Favored 'General case' 0 N--CA 1.484 1.257 0 O-C-N 123.227 0.329 . . . . 0.0 111.05 -177.347 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 27.7 t60 -73.47 -28.74 62.11 Favored 'General case' 0 CA--C 1.549 0.935 0 C-N-CA 123.005 0.522 . . . . 0.0 110.062 173.341 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 83.1 mt -65.47 -32.84 74.67 Favored 'General case' 0 N--CA 1.49 1.547 0 C-N-CA 122.918 0.487 . . . . 0.0 110.596 175.147 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 79' ' ' VAL . . . . . 0.54 HG22 ' HB3' ' A' ' 34' ' ' LEU . 40.8 t -62.18 -47.94 90.75 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.139 0 C-N-CA 124.193 0.997 . . . . 0.0 109.658 172.718 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 16.0 m -64.53 -48.13 76.22 Favored 'General case' 0 N--CA 1.47 0.548 0 CA-C-N 114.176 -1.374 . . . . 0.0 111.841 -175.785 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -67.55 -34.02 76.22 Favored 'General case' 0 N--CA 1.477 0.923 0 C-N-CA 123.766 0.826 . . . . 0.0 111.176 -177.601 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 82' ' ' TYR . . . . . 0.483 ' HA ' HD21 ' A' ' 48' ' ' LEU . 81.4 t80 -60.19 -54.95 39.72 Favored 'General case' 0 N--CA 1.469 0.519 0 C-N-CA 124.487 1.115 . . . . 0.0 110.669 177.788 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 83' ' ' ASN . . . . . . . . . . . . . 90.6 m-20 -69.77 -31.11 68.88 Favored 'General case' 0 CA--C 1.54 0.565 0 CA-C-N 114.847 -1.069 . . . . 0.0 110.574 -178.021 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 2.8 m-70 -70.32 -28.44 65.16 Favored 'General case' 0 N--CA 1.485 1.282 0 C-N-CA 123.576 0.75 . . . . 0.0 111.607 174.734 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 44.9 tp -60.29 -53.26 59.72 Favored 'General case' 0 N--CA 1.478 0.968 0 CA-C-O 121.739 0.781 . . . . 0.0 109.911 -178.724 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 86' ' ' PHE . . . . . 0.46 ' HA ' ' HE2' ' A' ' 91' ' ' PHE . 6.3 m-85 -75.48 -31.4 60.22 Favored 'General case' 0 CA--C 1.549 0.935 0 CA-C-N 113.771 -1.559 . . . . 0.0 111.079 -175.42 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 10.4 tp10 -69.16 -40.49 78.15 Favored 'General case' 0 N--CA 1.482 1.158 0 C-N-CA 124.103 0.961 . . . . 0.0 111.719 -173.436 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 37.0 p -109.56 2.8 20.61 Favored 'General case' 0 N--CA 1.484 1.256 0 C-N-CA 123.28 0.632 . . . . 0.0 111.689 -178.622 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 89' ' ' LYS . . . . . 0.453 ' HA ' ' CE2' ' A' ' 91' ' ' PHE . 48.7 mtpt 59.34 44.7 14.94 Favored 'General case' 0 N--CA 1.478 0.949 0 C-N-CA 124.391 1.076 . . . . 0.0 112.225 179.843 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 90' ' ' ARG . . . . . 0.501 HH11 ' HD1' ' A' ' 56' ' ' PHE . 20.5 mtt180 -67.94 -7.39 28.16 Favored 'General case' 0 N--CA 1.486 1.355 0 C-N-CA 124.426 1.09 . . . . 0.0 113.266 178.547 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 91' ' ' PHE . . . . . 0.46 ' HE2' ' HA ' ' A' ' 86' ' ' PHE . 36.7 p90 -77.67 161.91 27.41 Favored 'General case' 0 CA--C 1.541 0.603 0 C-N-CA 124.118 0.967 . . . . 0.0 111.651 171.622 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 61.7 tttm . . . . . 0 C--O 1.25 1.112 0 C-N-CA 124.177 0.991 . . . . 0.0 109.581 178.178 . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 20' ' ' MET . . . . . . . . . . . . . 26.6 ptt? . . . . . 0 N--CA 1.486 1.367 0 CA-C-O 120.969 0.414 . . . . 0.0 110.958 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -128.35 141.92 51.28 Favored 'General case' 0 N--CA 1.476 0.851 0 N-CA-C 108.463 -0.94 . . . . 0.0 108.463 172.3 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -76.39 80.15 3.12 Favored 'General case' 0 C--O 1.243 0.719 0 CA-C-O 121.168 0.509 . . . . 0.0 109.664 177.721 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -80.05 76.05 6.79 Favored 'General case' 0 C--O 1.24 0.563 0 CA-C-N 115.446 -0.797 . . . . 0.0 109.098 179.987 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 29.3 m -73.49 149.59 88.75 Favored Pre-proline 0 CA--C 1.543 0.698 0 CA-C-N 114.924 -1.035 . . . . 0.0 109.866 -175.771 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 25' ' ' PRO . . . . . 0.571 ' HG3' ' HB3' ' A' ' 51' ' ' HIS . 9.2 Cg_exo -67.01 102.84 0.68 Allowed 'Trans proline' 0 C--N 1.377 2.034 0 C-N-CA 122.794 2.33 . . . . 0.0 112.024 -171.313 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 15.2 mm-40 -71.92 104.44 3.5 Favored 'General case' 0 C--O 1.241 0.621 0 N-CA-C 106.642 -1.614 . . . . 0.0 106.642 172.621 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 9.8 ptp85 -55.16 141.35 35.27 Favored 'General case' 0 CA--C 1.544 0.75 0 O-C-N 123.79 0.682 . . . . 0.0 111.132 -174.855 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -95.78 -15.85 22.29 Favored 'General case' 0 N--CA 1.476 0.871 0 C-N-CA 123.185 0.594 . . . . 0.0 110.936 -176.237 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 29' ' ' TRP . . . . . . . . . . . . . 8.5 m-90 -142.94 157.78 44.24 Favored 'General case' 0 N--CA 1.482 1.155 0 C-N-CA 123.983 0.913 . . . . 0.0 109.879 -174.623 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 11.9 m -82.49 161.71 22.29 Favored 'General case' 0 CA--C 1.549 0.928 0 N-CA-C 108.065 -1.087 . . . . 0.0 108.065 168.495 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 31' ' ' VAL . . . . . 0.553 ' HA ' HD12 ' A' ' 34' ' ' LEU . 4.6 p -52.92 -39.64 32.91 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.399 0 C-N-CA 123.924 0.89 . . . . 0.0 111.796 -179.757 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 11.4 pt-20 -66.39 -43.21 86.49 Favored 'General case' 0 N--CA 1.479 1.022 0 C-N-CA 124.716 1.206 . . . . 0.0 111.263 177.483 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 44.8 mt-30 -64.7 -32.68 74.46 Favored 'General case' 0 N--CA 1.477 0.923 0 C-N-CA 123.525 0.73 . . . . 0.0 110.935 -179.038 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.553 HD12 ' HA ' ' A' ' 31' ' ' VAL . 51.6 mt -66.36 -50.35 63.83 Favored 'General case' 0 N--CA 1.47 0.548 0 O-C-N 124.112 0.883 . . . . 0.0 110.965 176.012 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 29.8 mtp180 -68.72 -18.99 64.34 Favored 'General case' 0 N--CA 1.475 0.795 0 C-N-CA 124.38 1.072 . . . . 0.0 111.665 -178.139 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 46.6 t -60.34 123.85 18.52 Favored 'General case' 0 CA--C 1.544 0.742 0 O-C-N 123.657 0.598 . . . . 0.0 110.251 176.162 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -55.53 -28.94 57.76 Favored 'General case' 0 CA--C 1.549 0.935 0 C-N-CA 125.057 1.343 . . . . 0.0 112.981 -177.056 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 91.3 mt-30 -65.17 -34.97 79.66 Favored 'General case' 0 N--CA 1.48 1.041 0 C-N-CA 123.927 0.891 . . . . 0.0 112.362 -177.774 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.432 HD23 ' HD2' ' A' ' 40' ' ' PRO . 1.2 tt -69.2 123.09 87.53 Favored Pre-proline 0 N--CA 1.488 1.433 0 N-CA-C 109.154 -0.684 . . . . 0.0 109.154 -178.904 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 40' ' ' PRO . . . . . 0.468 ' HB2' ' HG2' ' A' ' 42' ' ' LYS . 35.1 Cg_endo -62.82 128.95 24.57 Favored 'Trans proline' 0 C--N 1.37 1.709 0 C-N-CA 122.149 1.899 . . . . 0.0 112.02 173.278 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 35.9 mtmm -56.71 -36.7 69.98 Favored 'General case' 0 N--CA 1.483 1.186 0 C-N-CA 123.922 0.889 . . . . 0.0 111.671 178.603 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 42' ' ' LYS . . . . . 0.468 ' HG2' ' HB2' ' A' ' 40' ' ' PRO . 19.2 ptpt -58.9 -34.39 71.62 Favored 'General case' 0 N--CA 1.474 0.772 0 C-N-CA 124.015 0.926 . . . . 0.0 111.6 -177.856 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 3.4 t70 -73.47 -36.22 65.81 Favored 'General case' 0 CA--C 1.54 0.594 0 CA-C-N 115.457 -0.792 . . . . 0.0 109.707 -176.415 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 44' ' ' ILE . . . . . 0.437 ' HB ' HD13 ' A' ' 78' ' ' LEU . 38.1 mt -68.61 -46.79 79.4 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.927 0 CA-C-N 115.742 -0.663 . . . . 0.0 110.023 177.702 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 74.7 mt -55.52 -42.82 69.92 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.593 0 C-N-CA 123.754 0.821 . . . . 0.0 110.495 174.88 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 38.2 ttpt -59.24 -36.43 75.44 Favored 'General case' 0 CA--C 1.55 0.945 0 C-N-CA 124.516 1.126 . . . . 0.0 111.178 179.154 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 18.7 t80 -69.69 -47.72 62.2 Favored 'General case' 0 N--CA 1.48 1.057 0 CA-C-N 115.634 -0.712 . . . . 0.0 111.027 176.272 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 90.5 mt -71.82 -32.79 67.92 Favored 'General case' 0 N--CA 1.476 0.851 0 C-N-CA 123.935 0.894 . . . . 0.0 112.885 -171.588 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 49' ' ' GLN . . . . . 0.446 ' HA ' HD21 ' A' ' 57' ' ' LEU . 3.5 pt20 -82.44 -27.95 31.61 Favored 'General case' 0 N--CA 1.484 1.264 0 CA-C-N 117.747 0.249 . . . . 0.0 111.231 -179.989 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 9.9 tp10 -69.69 -33.66 72.86 Favored 'General case' 0 N--CA 1.475 0.79 0 C-N-CA 123.353 0.661 . . . . 0.0 110.797 -179.402 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 51' ' ' HIS . . . . . 0.571 ' HB3' ' HG3' ' A' ' 25' ' ' PRO . 66.2 m80 -112.06 -43.15 3.61 Favored 'General case' 0 N--CA 1.474 0.756 0 CA-C-N 115.309 -0.86 . . . . 0.0 112.381 -171.182 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 52' ' ' GLY . . . . . 0.418 ' HA2' ' HA ' ' A' ' 91' ' ' PHE . . . -65.41 132.74 35.64 Favored Glycine 0 N--CA 1.47 0.923 0 CA-C-O 119.346 -0.696 . . . . 0.0 111.899 171.976 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 20.1 t -80.28 168.52 18.95 Favored 'General case' 0 N--CA 1.48 1.073 0 CA-C-N 117.342 0.571 . . . . 0.0 110.165 -178.074 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 6.2 p-10 -58.87 -34.61 71.8 Favored 'General case' 0 N--CA 1.488 1.463 0 C-N-CA 124.345 1.058 . . . . 0.0 113.661 -169.313 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 23.1 m -72.93 -24.99 60.88 Favored 'General case' 0 N--CA 1.484 1.249 0 C-N-CA 122.748 0.419 . . . . 0.0 111.733 -179.421 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 56' ' ' PHE . . . . . 0.479 ' HB2' ' HB3' ' A' ' 90' ' ' ARG . 63.9 t80 -75.68 -49.93 16.89 Favored 'General case' 0 C--O 1.241 0.641 0 C-N-CA 123.445 0.698 . . . . 0.0 109.264 169.002 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 57' ' ' LEU . . . . . 0.446 HD21 ' HA ' ' A' ' 49' ' ' GLN . 62.0 mt -59.72 -50.64 73.04 Favored 'General case' 0 C--O 1.211 -0.938 0 CA-C-N 114.879 -1.055 . . . . 0.0 112.068 -168.892 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -60.42 -38.64 84.7 Favored 'General case' 0 N--CA 1.482 1.169 0 C-N-CA 123.497 0.719 . . . . 0.0 112.215 -175.403 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 12.3 mm-40 -67.27 -23.25 65.66 Favored 'General case' 0 N--CA 1.478 0.939 0 C-N-CA 123.176 0.59 . . . . 0.0 112.114 179.297 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 88.1 m-70 -115.99 7.28 14.31 Favored 'General case' 0 N--CA 1.484 1.274 0 C-N-CA 123.554 0.742 . . . . 0.0 111.332 176.275 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 48.3 mtpt 47.33 44.81 16.49 Favored 'General case' 0 N--CA 1.488 1.472 0 C-N-CA 125.119 1.368 . . . . 0.0 112.948 -178.934 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 66.8 mt -94.04 -11.42 30.76 Favored 'General case' 0 N--CA 1.478 0.951 0 C-N-CA 124.04 0.936 . . . . 0.0 111.931 -179.07 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 1.4 pp -79.44 -178.06 6.09 Favored 'General case' 0 N--CA 1.484 1.254 0 CA-C-O 121.357 0.598 . . . . 0.0 111.793 178.762 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 77.35 -142.44 27.14 Favored Glycine 0 C--N 1.341 0.828 0 CA-C-N 114.827 -1.078 . . . . 0.0 112.17 177.557 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 79.3 m-20 -82.04 131.06 35.24 Favored 'General case' 0 N--CA 1.469 0.481 0 N-CA-C 109.173 -0.677 . . . . 0.0 109.173 177.866 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 69.8 mt -57.49 -40.47 74.85 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.055 0 C-N-CA 123.478 0.711 . . . . 0.0 110.568 179.519 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 38.8 mtmm -55.19 -48.22 74.14 Favored 'General case' 0 N--CA 1.485 1.285 0 C-N-CA 123.332 0.653 . . . . 0.0 111.69 177.01 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 68' ' ' ASN . . . . . 0.415 ' O ' HG22 ' A' ' 72' ' ' THR . 3.3 m-20 -54.46 -41.71 69.79 Favored 'General case' 0 N--CA 1.49 1.558 0 C-N-CA 123.742 0.817 . . . . 0.0 111.606 177.905 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 22.3 t -73.07 -38.77 56.16 Favored 'Isoleucine or valine' 0 CA--C 1.551 0.996 0 CA-C-N 115.648 -0.705 . . . . 0.0 110.454 179.396 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -73.78 -26.46 60.65 Favored 'General case' 0 N--CA 1.488 1.432 0 C-N-CA 123.485 0.714 . . . . 0.0 112.592 -173.254 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 22.4 ptmt -81.88 -18.66 43.0 Favored 'General case' 0 N--CA 1.485 1.293 0 C-N-CA 122.704 0.402 . . . . 0.0 111.817 -176.232 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 72' ' ' THR . . . . . 0.415 HG22 ' O ' ' A' ' 68' ' ' ASN . 9.5 t -118.42 -34.8 3.94 Favored 'General case' 0 N--CA 1.484 1.234 0 C-N-CA 123.146 0.578 . . . . 0.0 111.754 -174.56 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 73' ' ' ALA . . . . . 0.444 ' HB1' ' ND1' ' A' ' 77' ' ' HIS . . . -98.35 141.25 31.47 Favored 'General case' 0 N--CA 1.471 0.586 0 C-N-CA 123.455 0.702 . . . . 0.0 110.219 -174.332 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 74' ' ' ASN . . . . . 0.441 ' ND2' ' HB3' ' A' ' 76' ' ' ASP . 26.9 p-10 -97.25 175.5 6.25 Favored 'General case' 0 N--CA 1.474 0.761 0 C-N-CA 123.603 0.761 . . . . 0.0 111.014 -176.043 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 75' ' ' LYS . . . . . 0.461 ' O ' HG23 ' A' ' 79' ' ' VAL . 32.0 ttmt -70.06 -38.82 75.88 Favored 'General case' 0 CA--C 1.541 0.602 0 C-N-CA 123.958 0.903 . . . . 0.0 111.269 -177.357 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 76' ' ' ASP . . . . . 0.441 ' HB3' ' ND2' ' A' ' 74' ' ' ASN . 24.0 t70 -58.77 -37.14 75.63 Favored 'General case' 0 N--CA 1.488 1.467 0 C-N-CA 123.577 0.751 . . . . 0.0 110.929 179.022 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 77' ' ' HIS . . . . . 0.444 ' ND1' ' HB1' ' A' ' 73' ' ' ALA . 4.1 t-80 -59.09 -47.56 84.81 Favored 'General case' 0 N--CA 1.476 0.86 0 C-N-CA 124.543 1.137 . . . . 0.0 110.818 173.262 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 78' ' ' LEU . . . . . 0.437 HD13 ' HB ' ' A' ' 44' ' ' ILE . 70.7 mt -65.68 -41.33 92.56 Favored 'General case' 0 N--CA 1.477 0.898 0 C-N-CA 123.372 0.669 . . . . 0.0 111.58 -172.268 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 79' ' ' VAL . . . . . 0.539 HG22 ' HB3' ' A' ' 34' ' ' LEU . 45.7 t -67.14 -44.71 87.75 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.697 0 C-N-CA 123.985 0.914 . . . . 0.0 110.552 -179.243 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 99.6 m -59.33 -50.01 75.62 Favored 'General case' 0 N--CA 1.477 0.876 0 C-N-CA 123.535 0.734 . . . . 0.0 110.924 176.185 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -62.35 -38.02 87.91 Favored 'General case' 0 N--CA 1.477 0.895 0 C-N-CA 123.545 0.738 . . . . 0.0 111.028 179.618 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 82' ' ' TYR . . . . . 0.422 ' O ' ' HB3' ' A' ' 85' ' ' LEU . 7.6 t80 -56.31 -54.16 48.75 Favored 'General case' 0 N--CA 1.476 0.854 0 C-N-CA 124.867 1.267 . . . . 0.0 111.614 177.67 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 83' ' ' ASN . . . . . . . . . . . . . 64.7 m-80 -66.14 -45.71 80.07 Favored 'General case' 0 N--CA 1.483 1.182 0 C-N-CA 122.849 0.46 . . . . 0.0 110.524 -176.953 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 15.2 m-70 -64.58 -26.16 68.29 Favored 'General case' 0 N--CA 1.481 1.097 0 C-N-CA 124.096 0.958 . . . . 0.0 111.295 -179.35 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 85' ' ' LEU . . . . . 0.429 HD11 ' HB3' ' A' ' 91' ' ' PHE . 25.2 tp -58.18 -54.28 48.72 Favored 'General case' 0 N--CA 1.481 1.109 0 C-N-CA 123.679 0.792 . . . . 0.0 110.724 176.59 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 86' ' ' PHE . . . . . 0.402 ' HA ' ' HE2' ' A' ' 91' ' ' PHE . 8.8 m-85 -74.87 -30.59 61.37 Favored 'General case' 0 CA--C 1.544 0.713 0 CA-C-N 113.539 -1.664 . . . . 0.0 111.0 -176.873 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 10.9 tp10 -67.69 -32.5 73.2 Favored 'General case' 0 N--CA 1.475 0.811 0 C-N-CA 124.144 0.978 . . . . 0.0 111.476 -174.436 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 43.3 p -113.94 -9.07 13.07 Favored 'General case' 0 N--CA 1.477 0.923 0 C-N-CA 123.972 0.909 . . . . 0.0 110.982 179.806 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 52.6 mtpt 62.93 41.1 8.82 Favored 'General case' 0 N--CA 1.481 1.081 0 C-N-CA 124.492 1.117 . . . . 0.0 112.415 174.338 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 90' ' ' ARG . . . . . 0.479 ' HB3' ' HB2' ' A' ' 56' ' ' PHE . 54.2 mtt180 -76.82 -5.81 49.79 Favored 'General case' 0 N--CA 1.487 1.423 0 C-N-CA 124.189 0.996 . . . . 0.0 112.735 -178.893 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 91' ' ' PHE . . . . . 0.429 ' HB3' HD11 ' A' ' 85' ' ' LEU . 5.5 p90 -61.9 150.8 36.52 Favored 'General case' 0 N--CA 1.472 0.664 0 C-N-CA 123.041 0.536 . . . . 0.0 112.309 175.475 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 86.2 tttt . . . . . 0 CA--C 1.549 0.914 0 CA-C-N 114.819 -1.082 . . . . 0.0 109.631 -179.155 . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 20' ' ' MET . . . . . . . . . . . . . 26.2 ptt? . . . . . 0 N--CA 1.478 0.964 0 N-CA-C 110.017 -0.364 . . . . 0.0 110.017 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -77.51 77.96 4.03 Favored 'General case' 0 C--O 1.245 0.82 0 C-N-CA 123.13 0.572 . . . . 0.0 109.681 177.869 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -170.88 76.73 0.07 Allowed 'General case' 0 N--CA 1.469 0.523 0 C-N-CA 124.52 1.128 . . . . 0.0 108.624 -175.975 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -70.7 94.07 0.99 Allowed 'General case' 0 N--CA 1.473 0.719 0 C-N-CA 123.663 0.785 . . . . 0.0 109.695 179.664 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 34.6 m -66.96 128.31 93.83 Favored Pre-proline 0 CA--C 1.553 1.077 0 C-N-CA 123.036 0.534 . . . . 0.0 110.53 -175.879 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 31.5 Cg_endo -68.71 99.91 0.67 Allowed 'Trans proline' 0 C--N 1.369 1.648 0 C-N-CA 121.834 1.689 . . . . 0.0 110.688 170.108 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 25.8 pt20 -73.08 -179.89 3.48 Favored 'General case' 0 C--O 1.239 0.536 0 CA-C-N 114.216 -1.356 . . . . 0.0 109.144 170.209 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -51.34 137.11 23.91 Favored 'General case' 0 N--CA 1.475 0.785 0 C-N-CA 123.304 0.642 . . . . 0.0 112.566 -177.808 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -89.68 -29.51 18.73 Favored 'General case' 0 CA--C 1.544 0.748 0 CA-C-N 115.888 -0.597 . . . . 0.0 109.423 174.125 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 29' ' ' TRP . . . . . . . . . . . . . 6.8 m-90 -141.12 160.59 39.76 Favored 'General case' 0 N--CA 1.487 1.418 0 C-N-CA 124.301 1.041 . . . . 0.0 110.018 -177.925 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 74.5 p -88.44 170.23 11.09 Favored 'General case' 0 N--CA 1.472 0.643 0 C-N-CA 123.172 0.589 . . . . 0.0 109.463 175.261 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 31' ' ' VAL . . . . . 0.5 ' HA ' HD12 ' A' ' 34' ' ' LEU . 14.5 p -62.22 -37.15 77.84 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.416 0 C-N-CA 123.154 0.582 . . . . 0.0 111.817 -173.143 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 9.9 pt-20 -70.32 -34.04 72.22 Favored 'General case' 0 N--CA 1.479 0.98 0 C-N-CA 124.167 0.987 . . . . 0.0 111.304 177.682 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 16.0 mm100 -70.82 -36.17 72.82 Favored 'General case' 0 N--CA 1.475 0.785 0 C-N-CA 122.809 0.444 . . . . 0.0 110.701 173.385 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.56 ' HA ' HD23 ' A' ' 39' ' ' LEU . 92.1 mt -66.07 -53.58 36.53 Favored 'General case' 0 N--CA 1.475 0.792 0 C-N-CA 123.195 0.598 . . . . 0.0 110.614 -177.383 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 9.7 ptp180 -66.35 -21.19 66.24 Favored 'General case' 0 N--CA 1.477 0.879 0 CA-C-N 115.071 -0.968 . . . . 0.0 111.742 -174.323 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 42.0 t -57.11 126.78 28.76 Favored 'General case' 0 C--N 1.354 0.766 0 C-N-CA 123.941 0.897 . . . . 0.0 110.84 176.372 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 16.4 mp0 -63.91 -32.92 74.61 Favored 'General case' 0 CA--C 1.544 0.741 0 C-N-CA 123.339 0.655 . . . . 0.0 110.864 -179.616 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 1.8 mp0 -78.2 0.65 24.26 Favored 'General case' 0 N--CA 1.478 0.959 0 C-N-CA 123.597 0.759 . . . . 0.0 112.318 179.237 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.56 HD23 ' HA ' ' A' ' 34' ' ' LEU . 62.4 tp -97.96 111.22 58.64 Favored Pre-proline 0 C--O 1.248 0.996 0 N-CA-C 106.5 -1.667 . . . . 0.0 106.5 158.58 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 32.5 Cg_exo -58.02 135.48 68.92 Favored 'Trans proline' 0 C--N 1.382 2.303 0 C-N-CA 122.662 2.241 . . . . 0.0 112.459 -178.981 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 41' ' ' LYS . . . . . 0.577 ' HG2' ' HE3' ' A' ' 75' ' ' LYS . 53.7 mtpt -56.71 -37.57 71.12 Favored 'General case' 0 N--CA 1.476 0.861 0 C-N-CA 124.885 1.274 . . . . 0.0 111.372 179.675 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 18.1 ptpt -63.31 -32.16 73.5 Favored 'General case' 0 C--O 1.217 -0.622 0 O-C-N 124.117 0.886 . . . . 0.0 112.08 -178.2 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 2.5 m-20 -65.32 -41.17 94.26 Favored 'General case' 0 N--CA 1.487 1.376 0 CA-C-O 120.782 0.325 . . . . 0.0 110.868 176.187 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 57.7 mt -69.16 -50.48 52.5 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.887 0 C-N-CA 123.468 0.707 . . . . 0.0 110.34 -178.835 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 75.8 mt -62.02 -38.5 80.93 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.062 0 C-N-CA 123.513 0.725 . . . . 0.0 110.867 179.495 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -58.09 -50.34 73.8 Favored 'General case' 0 N--CA 1.482 1.141 0 N-CA-C 108.86 -0.793 . . . . 0.0 108.86 175.63 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 27.7 t80 -58.65 -51.92 67.86 Favored 'General case' 0 CA--C 1.548 0.866 0 O-C-N 124.515 1.135 . . . . 0.0 111.069 -178.813 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 92.6 mt -69.62 -30.55 68.3 Favored 'General case' 0 N--CA 1.475 0.803 0 C-N-CA 123.822 0.849 . . . . 0.0 112.203 -173.826 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 2.9 pt20 -82.07 -26.11 33.96 Favored 'General case' 0 N--CA 1.484 1.258 0 C-N-CA 122.384 0.273 . . . . 0.0 110.629 177.174 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 43.1 tt0 -68.71 -22.47 64.34 Favored 'General case' 0 N--CA 1.484 1.243 0 C-N-CA 124.07 0.948 . . . . 0.0 111.811 -177.69 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 56.5 p-80 -127.79 -26.53 2.93 Favored 'General case' 0 N--CA 1.487 1.406 0 N-CA-C 112.635 0.606 . . . . 0.0 112.635 178.013 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -66.57 138.82 36.26 Favored Glycine 0 C--N 1.344 1.007 0 CA-C-O 119.506 -0.608 . . . . 0.0 112.715 178.924 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 53' ' ' SER . . . . . 0.448 ' O ' ' HG ' ' A' ' 57' ' ' LEU . 47.4 t -65.77 147.25 53.68 Favored 'General case' 0 N--CA 1.478 0.933 0 N-CA-C 109.677 -0.49 . . . . 0.0 109.677 178.515 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 8.8 p-10 -61.58 -28.18 69.16 Favored 'General case' 0 N--CA 1.485 1.303 0 C-N-CA 123.529 0.732 . . . . 0.0 111.937 -174.872 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 42.0 p -62.85 -44.13 96.96 Favored 'General case' 0 CA--C 1.552 1.05 0 C-N-CA 124.371 1.068 . . . . 0.0 111.141 174.836 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 67.2 t80 -64.27 -45.78 86.58 Favored 'General case' 0 N--CA 1.482 1.146 0 C-N-CA 124.277 1.031 . . . . 0.0 109.733 174.185 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 57' ' ' LEU . . . . . 0.448 ' HG ' ' O ' ' A' ' 53' ' ' SER . 75.7 mt -63.6 -29.7 70.91 Favored 'General case' 0 C--O 1.214 -0.775 0 CA-C-N 114.415 -1.266 . . . . 0.0 111.161 -176.073 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -71.34 -47.96 53.27 Favored 'General case' 0 N--CA 1.475 0.788 0 C-N-CA 123.237 0.615 . . . . 0.0 110.884 176.189 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 41.0 mt-10 -58.35 -36.12 72.97 Favored 'General case' 0 N--CA 1.491 1.583 0 C-N-CA 123.907 0.883 . . . . 0.0 111.661 178.082 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 54.0 m80 -107.42 -2.05 20.9 Favored 'General case' 0 N--CA 1.486 1.339 0 C-N-CA 123.465 0.706 . . . . 0.0 112.062 -174.454 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 95.8 mttt 54.33 38.61 29.77 Favored 'General case' 0 N--CA 1.492 1.648 0 C-N-CA 124.678 1.191 . . . . 0.0 112.775 -179.935 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 85.9 mt -88.26 -8.89 54.53 Favored 'General case' 0 N--CA 1.479 0.986 0 C-N-CA 123.15 0.58 . . . . 0.0 111.164 176.653 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -80.17 166.78 21.12 Favored 'General case' 0 N--CA 1.485 1.318 0 CA-C-O 120.917 0.389 . . . . 0.0 111.168 174.632 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 92.63 -168.76 30.8 Favored Glycine 0 C--N 1.34 0.799 0 CA-C-N 115.22 -0.9 . . . . 0.0 112.155 -179.477 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 88.5 m-20 -60.79 120.43 10.11 Favored 'General case' 0 N--CA 1.472 0.626 0 C-N-CA 123.232 0.613 . . . . 0.0 109.668 179.306 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 26.9 mt -61.33 -47.9 91.36 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.766 0 C-N-CA 124.039 0.936 . . . . 0.0 111.65 -167.069 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.66 -31.85 72.8 Favored 'General case' 0 N--CA 1.487 1.4 0 C-N-CA 123.748 0.819 . . . . 0.0 111.369 177.615 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 6.0 t30 -69.89 -36.43 75.43 Favored 'General case' 0 N--CA 1.483 1.22 0 C-N-CA 124.429 1.092 . . . . 0.0 110.609 178.396 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 47.7 t -73.06 -34.98 46.97 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.925 0 CA-C-N 115.83 -0.623 . . . . 0.0 109.502 172.274 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -73.44 -6.7 47.99 Favored 'General case' 0 N--CA 1.477 0.922 0 C-N-CA 124.207 1.003 . . . . 0.0 113.062 -174.538 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 22.3 ptmt -97.5 -26.66 14.75 Favored 'General case' 0 N--CA 1.48 1.052 0 CA-C-N 118.507 0.594 . . . . 0.0 112.271 173.454 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 8.8 t -112.08 -36.72 5.27 Favored 'General case' 0 N--CA 1.484 1.236 0 N-CA-C 112.787 0.662 . . . . 0.0 112.787 -166.734 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -91.2 102.46 15.18 Favored 'General case' 0 N--CA 1.472 0.661 0 N-CA-C 107.927 -1.138 . . . . 0.0 107.927 177.558 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 74' ' ' ASN . . . . . 0.449 ' O ' ' HG ' ' A' ' 78' ' ' LEU . 9.4 p30 -65.96 167.67 9.35 Favored 'General case' 0 N--CA 1.486 1.35 0 C-N-CA 123.863 0.865 . . . . 0.0 112.093 -169.687 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 75' ' ' LYS . . . . . 0.577 ' HE3' ' HG2' ' A' ' 41' ' ' LYS . 4.7 tppp? -63.08 -41.32 99.39 Favored 'General case' 0 CA--C 1.55 0.965 0 C-N-CA 122.9 0.48 . . . . 0.0 112.257 -174.014 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 19.1 t70 -60.38 -36.92 79.18 Favored 'General case' 0 N--CA 1.492 1.674 0 C-N-CA 123.52 0.728 . . . . 0.0 110.817 178.561 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 77' ' ' HIS . . . . . 0.415 ' HB3' ' O ' ' A' ' 74' ' ' ASN . 29.9 t60 -63.78 -39.73 94.95 Favored 'General case' 0 N--CA 1.479 0.983 0 C-N-CA 125.257 1.423 . . . . 0.0 110.466 175.206 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 78' ' ' LEU . . . . . 0.449 ' HG ' ' O ' ' A' ' 74' ' ' ASN . 40.9 mt -70.42 -38.89 74.66 Favored 'General case' 0 N--CA 1.487 1.417 0 C-N-CA 123.427 0.691 . . . . 0.0 111.91 -177.742 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 69.1 t -64.52 -46.09 93.7 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.904 0 C-N-CA 123.994 0.918 . . . . 0.0 110.27 179.526 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 51.1 m -62.14 -42.63 99.43 Favored 'General case' 0 N--CA 1.479 0.986 0 C-N-CA 123.418 0.687 . . . . 0.0 111.259 177.497 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -62.74 -43.4 98.9 Favored 'General case' 0 N--CA 1.477 0.882 0 C-N-CA 123.585 0.754 . . . . 0.0 110.837 177.676 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 82' ' ' TYR . . . . . . . . . . . . . 17.4 t80 -52.92 -57.9 8.74 Favored 'General case' 0 N--CA 1.473 0.691 0 C-N-CA 124.754 1.221 . . . . 0.0 110.519 178.751 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 83' ' ' ASN . . . . . . . . . . . . . 52.9 m-80 -64.9 -43.9 91.33 Favored 'General case' 0 N--CA 1.481 1.092 0 N-CA-C 112.429 0.529 . . . . 0.0 112.429 -171.067 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 88.6 m-70 -70.88 -24.42 62.49 Favored 'General case' 0 N--CA 1.48 1.062 0 C-N-CA 123.687 0.795 . . . . 0.0 112.083 -178.397 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 17.3 tp -58.76 -53.45 58.19 Favored 'General case' 0 N--CA 1.485 1.279 0 CA-C-O 121.903 0.858 . . . . 0.0 110.888 175.859 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 86' ' ' PHE . . . . . 0.417 ' HA ' ' HE2' ' A' ' 91' ' ' PHE . 56.7 m-85 -72.81 -36.35 67.52 Favored 'General case' 0 C--O 1.234 0.261 0 CA-C-N 113.937 -1.483 . . . . 0.0 110.87 -178.419 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 40.2 tt0 -59.33 -48.85 80.09 Favored 'General case' 0 N--CA 1.473 0.692 0 O-C-N 124.008 0.817 . . . . 0.0 112.202 -171.835 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 19.0 p -109.99 16.32 21.98 Favored 'General case' 0 N--CA 1.475 0.808 0 C-N-CA 123.241 0.616 . . . . 0.0 111.542 -178.897 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 47.3 mmtm 57.61 37.66 27.55 Favored 'General case' 0 N--CA 1.488 1.447 0 C-N-CA 123.95 0.9 . . . . 0.0 111.98 170.743 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 52.6 mtt-85 -70.79 -8.32 51.54 Favored 'General case' 0 N--CA 1.482 1.136 0 C-N-CA 124.126 0.97 . . . . 0.0 112.78 -176.621 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 91' ' ' PHE . . . . . 0.417 ' HE2' ' HA ' ' A' ' 86' ' ' PHE . 13.9 p90 -76.98 157.19 31.39 Favored 'General case' 0 N--CA 1.469 0.491 0 C-N-CA 123.139 0.576 . . . . 0.0 111.499 173.747 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 11.7 tmtt? . . . . . 0 CA--C 1.544 0.733 0 N-CA-C 107.062 -1.458 . . . . 0.0 107.062 -179.502 . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 20' ' ' MET . . . . . . . . . . . . . 28.2 ttt . . . . . 0 N--CA 1.482 1.155 0 N-CA-C 108.283 -1.006 . . . . 0.0 108.283 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -58.57 122.31 13.11 Favored 'General case' 0 N--CA 1.481 1.091 0 C-N-CA 124.173 0.989 . . . . 0.0 111.485 -172.79 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . 73.18 -59.02 0.58 Allowed 'General case' 0 N--CA 1.475 0.778 0 C-N-CA 125.944 1.698 . . . . 0.0 112.112 -176.259 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -75.08 80.02 2.24 Favored 'General case' 0 CA--C 1.543 0.7 0 C-N-CA 123.812 0.845 . . . . 0.0 111.955 -175.926 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 28.5 m -119.9 153.62 54.99 Favored Pre-proline 0 CA--C 1.543 0.686 0 N-CA-C 107.806 -1.183 . . . . 0.0 107.806 169.767 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 51.2 Cg_exo -55.51 129.95 37.88 Favored 'Trans proline' 0 C--N 1.372 1.8 0 C-N-CA 121.961 1.774 . . . . 0.0 111.869 169.325 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 11.3 pt20 -89.68 -158.82 0.54 Allowed 'General case' 0 N--CA 1.475 0.783 0 N-CA-C 108.051 -1.092 . . . . 0.0 108.051 168.782 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -59.02 153.05 18.51 Favored 'General case' 0 N--CA 1.475 0.804 0 C-N-CA 122.841 0.456 . . . . 0.0 111.572 173.708 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -108.98 -39.47 5.29 Favored 'General case' 0 N--CA 1.476 0.839 0 C-N-CA 123.23 0.612 . . . . 0.0 110.551 179.941 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 29' ' ' TRP . . . . . . . . . . . . . 3.6 m-90 -128.92 144.98 51.34 Favored 'General case' 0 N--CA 1.481 1.079 0 C-N-CA 123.972 0.909 . . . . 0.0 109.023 -176.495 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 20.2 p -83.53 169.6 15.27 Favored 'General case' 0 N--CA 1.474 0.77 0 C-N-CA 122.947 0.499 . . . . 0.0 109.789 -178.519 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 31' ' ' VAL . . . . . 0.584 ' HA ' HD12 ' A' ' 34' ' ' LEU . 7.4 p -56.98 -34.9 45.76 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.378 0 C-N-CA 122.887 0.475 . . . . 0.0 111.737 -173.844 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 12.9 pt-20 -67.19 -41.18 86.3 Favored 'General case' 0 N--CA 1.474 0.742 0 C-N-CA 123.814 0.846 . . . . 0.0 111.457 177.251 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 12.9 mm-40 -68.9 -35.24 76.62 Favored 'General case' 0 N--CA 1.477 0.902 0 C-N-CA 123.328 0.651 . . . . 0.0 111.266 178.792 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.584 HD12 ' HA ' ' A' ' 31' ' ' VAL . 66.3 mt -65.73 -45.64 81.88 Favored 'General case' 0 N--CA 1.472 0.643 0 O-C-N 123.618 0.573 . . . . 0.0 111.0 -179.693 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 35' ' ' ARG . . . . . 0.404 ' HG2' HG21 ' A' ' 79' ' ' VAL . 93.0 mtt-85 -79.01 -15.86 57.67 Favored 'General case' 0 CA--C 1.546 0.815 0 CA-C-N 115.419 -0.81 . . . . 0.0 111.352 179.637 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 40.0 t -63.83 138.65 58.57 Favored 'General case' 0 N--CA 1.48 1.057 0 C-N-CA 123.235 0.614 . . . . 0.0 111.414 -179.597 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 12.4 pt-20 -65.65 -18.86 65.63 Favored 'General case' 0 CA--C 1.551 1.014 0 C-N-CA 124.563 1.145 . . . . 0.0 111.97 179.989 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 76.3 mt-30 -73.42 -51.36 17.53 Favored 'General case' 0 CA--C 1.54 0.568 0 C-N-CA 124.116 0.966 . . . . 0.0 111.072 -177.984 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 46.7 tp -70.62 120.43 78.8 Favored Pre-proline 0 N--CA 1.478 0.941 0 CA-C-O 118.702 -0.666 . . . . 0.0 110.399 -176.189 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 24.6 Cg_exo -63.61 138.83 66.65 Favored 'Trans proline' 0 C--N 1.385 2.451 0 C-N-CA 122.747 2.298 . . . . 0.0 112.059 -179.19 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 21.5 ptmt -69.84 -32.36 70.72 Favored 'General case' 0 CA--C 1.537 0.444 0 C-N-CA 123.585 0.754 . . . . 0.0 110.825 -177.335 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 21.6 pttp -70.61 -28.83 65.15 Favored 'General case' 0 N--CA 1.474 0.753 0 C-N-CA 123.527 0.731 . . . . 0.0 110.915 175.994 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 28.0 t70 -69.24 -36.5 77.25 Favored 'General case' 0 N--CA 1.477 0.896 0 C-N-CA 122.543 0.337 . . . . 0.0 110.298 176.194 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 47.8 mt -66.34 -53.57 35.02 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.988 0 C-N-CA 122.878 0.471 . . . . 0.0 109.979 176.551 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 86.7 mt -55.91 -39.98 59.97 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.388 0 C-N-CA 123.959 0.903 . . . . 0.0 111.162 179.746 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 40.1 ttmt -57.49 -45.53 84.78 Favored 'General case' 0 N--CA 1.473 0.694 0 C-N-CA 123.703 0.801 . . . . 0.0 110.891 178.591 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 11.8 t80 -63.73 -48.29 77.63 Favored 'General case' 0 N--CA 1.471 0.606 0 O-C-N 123.897 0.748 . . . . 0.0 110.357 177.843 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 85.3 mt -68.86 -31.19 69.96 Favored 'General case' 0 CA--C 1.544 0.746 0 C-N-CA 123.201 0.6 . . . . 0.0 112.314 -172.742 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 49' ' ' GLN . . . . . 0.413 ' HA ' HD21 ' A' ' 57' ' ' LEU . 3.2 pt20 -84.61 -36.36 22.07 Favored 'General case' 0 N--CA 1.484 1.25 0 N-CA-C 111.674 0.25 . . . . 0.0 111.674 179.79 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 12.6 tp10 -69.14 -39.17 78.99 Favored 'General case' 0 N--CA 1.481 1.125 0 CA-C-O 121.587 0.708 . . . . 0.0 110.252 179.781 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 3.0 t60 -93.43 -49.85 5.72 Favored 'General case' 0 N--CA 1.47 0.548 0 CA-C-N 114.63 -1.168 . . . . 0.0 110.467 -173.349 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 52' ' ' GLY . . . . . 0.473 ' HA2' ' HA ' ' A' ' 91' ' ' PHE . . . -65.0 144.9 48.76 Favored Glycine 0 C--N 1.349 1.262 0 O-C-N 123.527 0.517 . . . . 0.0 113.185 173.253 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 34.5 t -89.67 166.45 13.59 Favored 'General case' 0 CA--C 1.55 0.971 0 C-N-CA 123.744 0.817 . . . . 0.0 110.669 -178.494 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 48.7 m-20 -58.0 -36.16 72.26 Favored 'General case' 0 N--CA 1.494 1.757 0 C-N-CA 123.912 0.885 . . . . 0.0 112.978 -169.175 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 40.2 t -64.0 -31.59 72.83 Favored 'General case' 0 N--CA 1.476 0.847 0 C-N-CA 123.605 0.762 . . . . 0.0 111.493 -178.299 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 85.4 t80 -76.21 -45.7 31.85 Favored 'General case' 0 CA--C 1.546 0.825 0 C-N-CA 123.497 0.719 . . . . 0.0 110.282 171.285 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 57' ' ' LEU . . . . . 0.413 HD21 ' HA ' ' A' ' 49' ' ' GLN . 45.7 mt -65.03 -33.44 76.04 Favored 'General case' 0 N--CA 1.478 0.935 0 CA-C-N 115.175 -0.921 . . . . 0.0 112.845 -169.701 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -68.4 -48.53 64.46 Favored 'General case' 0 N--CA 1.475 0.784 0 C-N-CA 122.62 0.368 . . . . 0.0 110.475 178.739 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 10.0 mm-40 -62.31 -33.5 74.8 Favored 'General case' 0 N--CA 1.476 0.87 0 CA-C-N 115.771 -0.649 . . . . 0.0 111.045 -178.484 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 34.5 m-70 -105.99 4.33 29.29 Favored 'General case' 0 N--CA 1.479 0.99 0 C-N-CA 123.223 0.609 . . . . 0.0 112.297 -178.214 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 46.0 mmtm 56.14 28.2 12.67 Favored 'General case' 0 N--CA 1.498 1.933 0 C-N-CA 124.377 1.071 . . . . 0.0 113.164 174.855 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 0.487 HD11 ' HB1' ' A' ' 81' ' ' ALA . 92.2 mt -88.43 -8.85 54.3 Favored 'General case' 0 N--CA 1.481 1.094 0 C-N-CA 123.609 0.763 . . . . 0.0 112.061 -178.214 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 1.4 pp -67.48 167.34 12.94 Favored 'General case' 0 N--CA 1.477 0.913 0 C-N-CA 122.92 0.488 . . . . 0.0 111.44 177.727 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 77.01 -154.81 43.62 Favored Glycine 0 C--N 1.338 0.674 0 CA-C-N 115.653 -0.703 . . . . 0.0 113.623 174.695 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 65' ' ' ASN . . . . . 0.414 ' O ' HG23 ' A' ' 69' ' ' VAL . 15.9 m120 -64.57 124.66 22.44 Favored 'General case' 0 N--CA 1.472 0.658 0 C-N-CA 123.698 0.799 . . . . 0.0 110.609 -176.952 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 49.7 mt -58.03 -45.83 88.1 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.974 0 C-N-CA 124.127 0.971 . . . . 0.0 110.546 -179.327 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 17.7 mtpp -51.46 -46.02 62.94 Favored 'General case' 0 N--CA 1.482 1.175 0 C-N-CA 124.642 1.177 . . . . 0.0 111.714 174.714 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 68' ' ' ASN . . . . . 0.447 ' O ' ' HG2' ' A' ' 71' ' ' LYS . 7.8 t30 -64.57 -40.77 96.16 Favored 'General case' 0 N--CA 1.478 0.943 0 C-N-CA 123.484 0.714 . . . . 0.0 111.02 -179.169 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 69' ' ' VAL . . . . . 0.414 HG23 ' O ' ' A' ' 65' ' ' ASN . 18.4 t -71.4 -32.14 45.59 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.094 0 CA-C-O 121.018 0.437 . . . . 0.0 110.038 178.074 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -76.55 -16.33 59.64 Favored 'General case' 0 N--CA 1.485 1.288 0 C-N-CA 123.635 0.774 . . . . 0.0 112.229 -177.122 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 71' ' ' LYS . . . . . 0.447 ' HG2' ' O ' ' A' ' 68' ' ' ASN . 20.0 ptmt -94.76 -17.35 22.25 Favored 'General case' 0 N--CA 1.479 1.003 0 C-N-CA 122.367 0.267 . . . . 0.0 111.521 178.925 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 13.1 t -114.29 -35.32 5.02 Favored 'General case' 0 N--CA 1.479 1.006 0 C-N-CA 122.89 0.476 . . . . 0.0 111.777 -172.087 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -99.59 119.66 38.42 Favored 'General case' 0 N--CA 1.47 0.544 0 C-N-CA 124.048 0.939 . . . . 0.0 109.702 -176.082 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 74' ' ' ASN . . . . . 0.401 ' O ' ' HG ' ' A' ' 78' ' ' LEU . 27.8 p-10 -74.67 169.7 17.29 Favored 'General case' 0 N--CA 1.481 1.096 0 C-N-CA 123.563 0.745 . . . . 0.0 111.226 -177.171 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 15.0 tptm -60.23 -39.05 85.29 Favored 'General case' 0 N--CA 1.481 1.081 0 C-N-CA 124.029 0.932 . . . . 0.0 110.929 -174.122 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 29.7 t70 -64.4 -38.46 91.11 Favored 'General case' 0 N--CA 1.475 0.793 0 C-N-CA 124.125 0.97 . . . . 0.0 111.338 -179.099 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 31.1 t60 -59.8 -37.43 79.11 Favored 'General case' 0 N--CA 1.481 1.084 0 C-N-CA 124.213 1.005 . . . . 0.0 110.446 176.492 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 78' ' ' LEU . . . . . 0.401 ' HG ' ' O ' ' A' ' 74' ' ' ASN . 27.2 mt -72.72 -35.36 67.56 Favored 'General case' 0 N--CA 1.478 0.931 0 CA-C-N 115.78 -0.645 . . . . 0.0 111.278 -174.954 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 79' ' ' VAL . . . . . 0.404 HG21 ' HG2' ' A' ' 35' ' ' ARG . 21.5 t -69.86 -40.72 79.23 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.69 0 C-N-CA 123.306 0.642 . . . . 0.0 109.712 175.11 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 43.3 m -57.73 -45.1 86.26 Favored 'General case' 0 N--CA 1.478 0.928 0 C-N-CA 123.783 0.833 . . . . 0.0 110.489 175.118 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 81' ' ' ALA . . . . . 0.487 ' HB1' HD11 ' A' ' 62' ' ' LEU . . . -66.48 -43.53 85.18 Favored 'General case' 0 CA--C 1.534 0.335 0 CA-C-N 115.719 -0.673 . . . . 0.0 110.927 -179.592 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 82' ' ' TYR . . . . . 0.438 ' CD2' ' HE2' ' A' ' 86' ' ' PHE . 18.4 t80 -53.67 -56.39 17.69 Favored 'General case' 0 CA--C 1.543 0.676 0 C-N-CA 124.079 0.952 . . . . 0.0 110.409 176.816 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 83' ' ' ASN . . . . . . . . . . . . . 3.4 m-20 -55.68 -51.24 67.94 Favored 'General case' 0 N--CA 1.489 1.493 0 C-N-CA 123.46 0.704 . . . . 0.0 111.081 -175.824 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 72.4 m80 -70.43 -22.83 62.67 Favored 'General case' 0 CA--C 1.543 0.707 0 C-N-CA 124.553 1.141 . . . . 0.0 112.567 -175.771 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 42.4 tp -63.19 -55.32 26.08 Favored 'General case' 0 N--CA 1.483 1.212 0 CA-C-O 121.603 0.716 . . . . 0.0 110.986 177.96 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 86' ' ' PHE . . . . . 0.49 ' HA ' ' HE1' ' A' ' 91' ' ' PHE . 37.2 m-85 -75.86 -28.78 58.31 Favored 'General case' 0 N--CA 1.474 0.735 0 CA-C-N 114.101 -1.409 . . . . 0.0 111.83 -175.744 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 11.6 tp10 -68.61 -18.49 64.32 Favored 'General case' 0 N--CA 1.479 1.017 0 C-N-CA 123.12 0.568 . . . . 0.0 112.063 -176.343 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 18.1 p -129.04 -1.42 5.21 Favored 'General case' 0 N--CA 1.479 0.985 0 C-N-CA 123.761 0.824 . . . . 0.0 111.811 -179.722 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 73.1 mmtt 59.57 38.78 22.1 Favored 'General case' 0 N--CA 1.487 1.397 0 C-N-CA 124.558 1.143 . . . . 0.0 111.71 177.301 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 62.2 mtt180 -73.23 -11.04 60.37 Favored 'General case' 0 N--CA 1.49 1.556 0 C-N-CA 123.625 0.77 . . . . 0.0 112.765 -178.232 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 91' ' ' PHE . . . . . 0.49 ' HE1' ' HA ' ' A' ' 86' ' ' PHE . 50.3 p90 -81.88 156.24 24.91 Favored 'General case' 0 C--O 1.242 0.666 0 C-N-CA 123.244 0.618 . . . . 0.0 110.946 171.872 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 33.2 ttpt . . . . . 0 C--O 1.253 1.272 0 N-CA-C 107.425 -1.324 . . . . 0.0 107.425 170.671 . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 20' ' ' MET . . . . . . . . . . . . . 56.2 mtt . . . . . 0 N--CA 1.476 0.836 0 N-CA-C 109.631 -0.507 . . . . 0.0 109.631 . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -91.03 143.4 26.74 Favored 'General case' 0 N--CA 1.474 0.754 0 C-N-CA 123.68 0.792 . . . . 0.0 110.09 178.02 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -70.38 97.07 1.21 Allowed 'General case' 0 N--CA 1.47 0.549 0 N-CA-C 108.547 -0.908 . . . . 0.0 108.547 174.894 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -84.88 49.78 1.79 Allowed 'General case' 0 N--CA 1.477 0.906 0 C-N-CA 123.887 0.875 . . . . 0.0 111.425 -173.231 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 16.4 m -60.51 123.4 73.7 Favored Pre-proline 0 CA--C 1.558 1.274 0 C-N-CA 124.499 1.12 . . . . 0.0 111.307 -177.605 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 58.9 Cg_endo -72.29 107.48 2.28 Favored 'Trans proline' 0 C--N 1.375 1.934 0 C-N-CA 122.125 1.883 . . . . 0.0 112.89 -174.692 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 17.8 pt20 -88.3 150.09 23.43 Favored 'General case' 0 C--O 1.247 0.97 0 N-CA-C 108.043 -1.095 . . . . 0.0 108.043 167.521 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -61.53 132.33 53.03 Favored 'General case' 0 CA--C 1.539 0.529 0 O-C-N 123.455 0.472 . . . . 0.0 110.734 179.129 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -78.82 -31.96 46.02 Favored 'General case' 0 N--CA 1.467 0.412 0 CA-C-N 115.452 -0.795 . . . . 0.0 109.643 176.243 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 29' ' ' TRP . . . . . . . . . . . . . 3.4 m-90 -129.25 142.67 50.78 Favored 'General case' 0 N--CA 1.463 0.192 0 C-N-CA 124.439 1.096 . . . . 0.0 109.043 -175.456 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 42.7 p -82.03 174.75 10.95 Favored 'General case' 0 N--CA 1.473 0.691 0 C-N-CA 123.085 0.554 . . . . 0.0 109.597 173.648 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 7.5 p -58.62 -39.01 74.61 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.328 0 C-N-CA 122.732 0.413 . . . . 0.0 111.423 -176.799 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 11.4 pt-20 -69.32 -39.43 78.21 Favored 'General case' 0 N--CA 1.48 1.074 0 C-N-CA 123.58 0.752 . . . . 0.0 111.53 178.311 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 52.9 mt-30 -63.56 -36.76 84.85 Favored 'General case' 0 N--CA 1.481 1.083 0 C-N-CA 122.888 0.475 . . . . 0.0 110.807 177.963 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 89.7 mt -60.94 -51.48 69.09 Favored 'General case' 0 N--CA 1.48 1.045 0 O-C-N 123.473 0.483 . . . . 0.0 109.866 176.878 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 43.7 mtm105 -65.36 -18.87 65.66 Favored 'General case' 0 C--N 1.353 0.74 0 CA-C-N 114.43 -1.259 . . . . 0.0 111.865 -175.718 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 44.8 t -56.47 123.91 16.38 Favored 'General case' 0 C--N 1.354 0.789 0 N-CA-C 109.649 -0.5 . . . . 0.0 109.649 173.316 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 28.9 mt-10 -57.98 -37.1 73.58 Favored 'General case' 0 N--CA 1.474 0.749 0 C-N-CA 124.452 1.101 . . . . 0.0 111.278 -177.854 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 74.7 mt-30 -64.25 -30.21 71.27 Favored 'General case' 0 N--CA 1.475 0.794 0 C-N-CA 123.79 0.836 . . . . 0.0 111.484 -178.14 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 4.1 tt -81.05 113.0 37.39 Favored Pre-proline 0 CA--C 1.549 0.935 0 N-CA-C 107.553 -1.277 . . . . 0.0 107.553 172.692 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 40' ' ' PRO . . . . . 0.546 ' HB2' ' HG2' ' A' ' 42' ' ' LYS . 11.3 Cg_exo -70.55 147.34 57.59 Favored 'Trans proline' 0 C--N 1.371 1.717 0 C-N-CA 122.906 2.404 . . . . 0.0 112.81 -179.222 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 52.4 mtmt -56.83 -29.11 62.49 Favored 'General case' 0 N--CA 1.478 0.951 0 C-N-CA 124.602 1.161 . . . . 0.0 112.23 177.026 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 42' ' ' LYS . . . . . 0.546 ' HG2' ' HB2' ' A' ' 40' ' ' PRO . 17.4 ptpt -66.3 -36.91 84.16 Favored 'General case' 0 N--CA 1.47 0.533 0 C-N-CA 123.342 0.657 . . . . 0.0 111.71 -179.754 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 43' ' ' ASP . . . . . 0.474 ' HA ' ' HE2' ' A' ' 46' ' ' LYS . 2.3 m-20 -67.16 -35.36 79.52 Favored 'General case' 0 N--CA 1.479 1.009 0 O-C-N 123.293 0.37 . . . . 0.0 111.229 178.948 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 44' ' ' ILE . . . . . 0.4 ' O ' ' HG ' ' A' ' 48' ' ' LEU . 37.6 mt -65.65 -54.12 31.43 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.748 0 O-C-N 123.708 0.63 . . . . 0.0 109.635 177.949 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 68.0 mt -58.02 -39.52 72.62 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.253 0 C-N-CA 123.489 0.716 . . . . 0.0 111.096 177.945 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 46' ' ' LYS . . . . . 0.474 ' HE2' ' HA ' ' A' ' 43' ' ' ASP . 36.5 ttpt -59.92 -43.24 95.0 Favored 'General case' 0 N--CA 1.478 0.956 0 C-N-CA 124.086 0.955 . . . . 0.0 110.88 179.301 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 22.5 t80 -64.4 -47.13 80.36 Favored 'General case' 0 CA--C 1.548 0.889 0 CA-C-N 114.962 -1.017 . . . . 0.0 110.947 176.874 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 48' ' ' LEU . . . . . 0.4 ' HG ' ' O ' ' A' ' 44' ' ' ILE . 87.3 mt -70.82 -30.53 66.99 Favored 'General case' 0 N--CA 1.472 0.665 0 CA-C-N 115.326 -0.852 . . . . 0.0 111.741 -174.723 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 49' ' ' GLN . . . . . 0.507 ' HA ' HD21 ' A' ' 57' ' ' LEU . 3.4 pt20 -84.15 -27.5 28.08 Favored 'General case' 0 N--CA 1.482 1.13 0 C-N-CA 122.639 0.375 . . . . 0.0 110.909 177.748 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 14.4 tp10 -56.72 -37.26 70.71 Favored 'General case' 0 N--CA 1.475 0.816 0 C-N-CA 124.167 0.987 . . . . 0.0 111.505 179.699 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 31.9 m80 -129.99 -21.59 2.98 Favored 'General case' 0 N--CA 1.476 0.83 0 N-CA-C 113.032 0.753 . . . . 0.0 113.032 -177.46 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -60.18 136.34 49.73 Favored Glycine 0 N--CA 1.474 1.204 0 CA-C-N 118.694 0.679 . . . . 0.0 112.818 176.27 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 53' ' ' SER . . . . . 0.425 ' O ' ' HG ' ' A' ' 57' ' ' LEU . 39.7 t -64.08 158.71 22.03 Favored 'General case' 0 N--CA 1.481 1.089 0 C-N-CA 123.618 0.767 . . . . 0.0 110.752 179.133 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 7.2 p-10 -66.14 -29.58 69.9 Favored 'General case' 0 N--CA 1.483 1.181 0 C-N-CA 123.37 0.668 . . . . 0.0 111.396 -171.853 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 42.1 t -71.85 -38.43 70.09 Favored 'General case' 0 N--CA 1.473 0.694 0 C-N-CA 123.555 0.742 . . . . 0.0 110.722 175.397 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 57.4 t80 -63.44 -44.35 94.79 Favored 'General case' 0 N--CA 1.479 0.995 0 N-CA-C 109.14 -0.689 . . . . 0.0 109.14 174.771 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 57' ' ' LEU . . . . . 0.507 HD21 ' HA ' ' A' ' 49' ' ' GLN . 62.0 mt -68.05 -31.65 71.45 Favored 'General case' 0 C--O 1.222 -0.345 0 CA-C-N 115.243 -0.889 . . . . 0.0 111.081 -178.599 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -71.19 -50.06 37.16 Favored 'General case' 0 N--CA 1.472 0.65 0 C-N-CA 123.001 0.52 . . . . 0.0 111.212 177.632 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 27.1 mm-40 -73.79 -16.41 61.16 Favored 'General case' 0 N--CA 1.477 0.912 0 N-CA-C 112.335 0.495 . . . . 0.0 112.335 -176.851 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 44.6 m-70 -114.19 1.18 14.46 Favored 'General case' 0 N--CA 1.489 1.48 0 C-N-CA 123.176 0.59 . . . . 0.0 111.74 176.8 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 74.6 mmtt 58.09 30.51 19.4 Favored 'General case' 0 N--CA 1.493 1.708 0 C-N-CA 124.613 1.165 . . . . 0.0 113.103 174.499 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 0.444 HD11 ' HB1' ' A' ' 81' ' ' ALA . 65.6 mt -90.41 -6.96 54.32 Favored 'General case' 0 N--CA 1.487 1.394 0 C-N-CA 123.755 0.822 . . . . 0.0 111.988 -176.415 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -74.57 173.73 10.0 Favored 'General case' 0 N--CA 1.477 0.923 0 C-N-CA 123.06 0.544 . . . . 0.0 111.699 177.196 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 82.6 -165.84 44.75 Favored Glycine 0 C--O 1.246 0.868 0 CA-C-N 115.353 -0.839 . . . . 0.0 112.919 178.278 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 45.5 t-20 -68.2 125.09 25.28 Favored 'General case' 0 C--O 1.241 0.646 0 N-CA-C 109.014 -0.735 . . . . 0.0 109.014 176.884 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 66' ' ' ILE . . . . . 0.437 HD13 ' HB2' ' A' ' 46' ' ' LYS . 32.5 mt -58.5 -53.22 49.71 Favored 'Isoleucine or valine' 0 C--O 1.214 -0.811 0 O-C-N 124.317 1.01 . . . . 0.0 111.707 -169.885 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 22.9 pttp -59.41 -34.92 73.06 Favored 'General case' 0 N--CA 1.489 1.489 0 C-N-CA 123.886 0.875 . . . . 0.0 112.99 -172.051 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 47.9 t30 -65.4 -45.29 84.55 Favored 'General case' 0 N--CA 1.473 0.692 0 C-N-CA 123.452 0.701 . . . . 0.0 110.115 178.86 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 97.3 t -70.61 -43.44 77.63 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.787 0 CA-C-N 115.162 -0.926 . . . . 0.0 110.91 178.167 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -59.22 -50.56 73.54 Favored 'General case' 0 N--CA 1.479 1.009 0 C-N-CA 124.875 1.27 . . . . 0.0 112.603 -167.121 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 19.4 ptpt -55.53 -45.41 77.19 Favored 'General case' 0 CA--C 1.558 1.26 0 O-C-N 123.863 0.727 . . . . 0.0 112.063 -179.545 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 13.3 t -93.0 -9.72 38.83 Favored 'General case' 0 N--CA 1.479 1.01 0 C-N-CA 123.662 0.785 . . . . 0.0 111.874 -173.981 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -93.41 118.03 30.81 Favored 'General case' 0 N--CA 1.472 0.662 0 N-CA-C 108.62 -0.881 . . . . 0.0 108.62 173.306 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 29.2 p-10 -73.98 148.54 42.0 Favored 'General case' 0 C--O 1.239 0.535 0 N-CA-C 109.78 -0.452 . . . . 0.0 109.78 176.9 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 39.2 ttmt -63.94 -26.71 68.71 Favored 'General case' 0 CA--C 1.541 0.602 0 C-N-CA 123.559 0.744 . . . . 0.0 111.124 -174.435 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 28.3 t70 -59.74 -40.66 88.83 Favored 'General case' 0 CA--C 1.544 0.739 0 C-N-CA 124.272 1.029 . . . . 0.0 111.28 177.758 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 75.0 t60 -66.37 -39.34 89.05 Favored 'General case' 0 N--CA 1.474 0.77 0 C-N-CA 123.955 0.902 . . . . 0.0 110.086 175.66 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 29.7 mt -69.87 -36.46 75.5 Favored 'General case' 0 N--CA 1.481 1.1 0 C-N-CA 123.348 0.659 . . . . 0.0 112.009 -174.693 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 77.2 t -67.83 -42.83 86.3 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.668 0 C-N-CA 123.849 0.859 . . . . 0.0 109.659 177.295 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 51.5 m -61.09 -40.38 93.5 Favored 'General case' 0 CA--C 1.549 0.91 0 C-N-CA 122.882 0.473 . . . . 0.0 110.725 175.046 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 81' ' ' ALA . . . . . 0.444 ' HB1' HD11 ' A' ' 62' ' ' LEU . . . -65.82 -40.64 92.01 Favored 'General case' 0 N--CA 1.474 0.745 0 C-N-CA 123.497 0.719 . . . . 0.0 111.011 177.414 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 82' ' ' TYR . . . . . . . . . . . . . 13.9 t80 -58.59 -55.34 36.32 Favored 'General case' 0 CA--C 1.541 0.629 0 CA-C-N 114.532 -1.213 . . . . 0.0 110.989 179.206 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 83' ' ' ASN . . . . . . . . . . . . . 67.3 m-80 -64.7 -44.08 91.41 Favored 'General case' 0 N--CA 1.483 1.176 0 C-N-CA 122.454 0.302 . . . . 0.0 111.161 -174.129 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 25.2 m-70 -64.3 -26.63 68.57 Favored 'General case' 0 N--CA 1.485 1.315 0 C-N-CA 123.708 0.803 . . . . 0.0 111.845 179.155 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 85' ' ' LEU . . . . . 0.491 HD12 ' HB2' ' A' ' 90' ' ' ARG . 53.6 tp -58.34 -52.95 63.43 Favored 'General case' 0 N--CA 1.482 1.13 0 CA-C-O 121.219 0.533 . . . . 0.0 111.163 177.327 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 45.3 m-85 -75.61 -35.68 60.47 Favored 'General case' 0 N--CA 1.475 0.807 0 CA-C-N 115.041 -0.981 . . . . 0.0 111.65 -178.65 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 17.4 tp10 -60.29 -47.05 87.65 Favored 'General case' 0 N--CA 1.473 0.68 0 C-N-CA 124.162 0.985 . . . . 0.0 111.613 -172.516 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 7.6 p -117.04 11.84 14.38 Favored 'General case' 0 CA--C 1.548 0.87 0 C-N-CA 123.999 0.919 . . . . 0.0 111.236 -179.583 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 27.2 mtpp 55.14 56.8 6.11 Favored 'General case' 0 N--CA 1.486 1.336 0 C-N-CA 125.241 1.416 . . . . 0.0 112.251 168.604 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 90' ' ' ARG . . . . . 0.491 ' HB2' HD12 ' A' ' 85' ' ' LEU . 11.7 mmm180 -73.26 -16.81 61.38 Favored 'General case' 0 N--CA 1.484 1.266 0 CA-C-N 115.163 -0.926 . . . . 0.0 111.864 -176.971 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 91' ' ' PHE . . . . . . . . . . . . . 3.4 p90 -69.08 144.26 53.99 Favored 'General case' 0 CA--C 1.544 0.747 0 CA-C-O 121.631 0.729 . . . . 0.0 111.865 -179.533 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 6.7 mtpm? . . . . . 0 C--O 1.247 0.941 0 C-N-CA 125.379 1.472 . . . . 0.0 108.78 170.675 . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 20' ' ' MET . . . . . . . . . . . . . 25.9 ptt? . . . . . 0 N--CA 1.486 1.344 0 N-CA-C 109.991 -0.374 . . . . 0.0 109.991 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -69.88 89.39 0.58 Allowed 'General case' 0 CA--C 1.542 0.67 0 O-C-N 123.793 0.683 . . . . 0.0 110.22 174.364 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -161.33 15.56 0.1 Allowed 'General case' 0 N--CA 1.476 0.829 0 C-N-CA 124.339 1.056 . . . . 0.0 110.49 -177.291 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -157.11 125.94 5.82 Favored 'General case' 0 CA--C 1.537 0.457 0 C-N-CA 123.916 0.886 . . . . 0.0 109.255 -173.204 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 61.1 t -76.56 122.28 86.34 Favored Pre-proline 0 CA--C 1.546 0.825 0 C-N-CA 123.415 0.686 . . . . 0.0 109.646 178.506 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 90.7 Cg_endo -81.73 131.03 7.02 Favored 'Trans proline' 0 C--N 1.369 1.619 0 C-N-CA 122.636 2.224 . . . . 0.0 113.212 176.146 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 49.2 mt-30 -98.02 148.95 22.98 Favored 'General case' 0 C--O 1.245 0.827 0 N-CA-C 106.049 -1.834 . . . . 0.0 106.049 153.407 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -56.37 128.24 34.95 Favored 'General case' 0 CA--C 1.544 0.737 0 CA-C-O 120.867 0.365 . . . . 0.0 110.515 -178.13 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -85.72 -38.86 17.82 Favored 'General case' 0 N--CA 1.472 0.638 0 CA-C-N 115.841 -0.618 . . . . 0.0 109.372 179.127 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 29' ' ' TRP . . . . . . . . . . . . . 5.1 m-90 -137.34 154.54 50.02 Favored 'General case' 0 N--CA 1.476 0.828 0 C-N-CA 124.669 1.188 . . . . 0.0 108.636 178.649 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 77.2 p -85.82 173.16 10.22 Favored 'General case' 0 N--CA 1.477 0.901 0 N-CA-C 109.683 -0.488 . . . . 0.0 109.683 174.266 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 8.0 p -56.96 -40.8 74.8 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.139 0 C-N-CA 123.762 0.825 . . . . 0.0 111.766 -177.396 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 10.2 pt-20 -71.43 -37.51 71.43 Favored 'General case' 0 N--CA 1.476 0.835 0 C-N-CA 123.782 0.833 . . . . 0.0 111.563 179.377 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 50.9 mt-30 -66.33 -36.06 81.95 Favored 'General case' 0 N--CA 1.474 0.736 0 C-N-CA 123.023 0.529 . . . . 0.0 110.99 175.915 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.459 ' HB3' HG22 ' A' ' 79' ' ' VAL . 84.2 mt -65.05 -50.06 67.69 Favored 'General case' 0 N--CA 1.475 0.812 0 C-N-CA 123.21 0.604 . . . . 0.0 110.941 -179.788 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 35' ' ' ARG . . . . . 0.585 ' HA ' ' HD3' ' A' ' 75' ' ' LYS . 17.8 ptm180 -73.87 -14.89 61.15 Favored 'General case' 0 N--CA 1.477 0.923 0 CA-C-N 115.699 -0.682 . . . . 0.0 111.707 -178.325 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 47.7 t -56.56 129.46 40.96 Favored 'General case' 0 N--CA 1.478 0.944 0 C-N-CA 123.389 0.676 . . . . 0.0 111.043 179.242 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 33.5 mt-10 -67.67 -18.83 65.07 Favored 'General case' 0 N--CA 1.479 1.012 0 C-N-CA 124.353 1.061 . . . . 0.0 111.883 -177.659 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 13.7 mm100 -70.8 -28.29 64.54 Favored 'General case' 0 CA--C 1.542 0.645 0 C-N-CA 123.52 0.728 . . . . 0.0 111.309 175.406 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 4.6 tt -91.99 127.24 50.35 Favored Pre-proline 0 CA--C 1.561 1.38 0 N-CA-C 108.229 -1.026 . . . . 0.0 108.229 178.5 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 24.5 Cg_exo -68.8 -149.06 0.02 OUTLIER 'Trans proline' 0 C--N 1.378 2.117 0 C-N-CA 123.571 2.847 . . . . 0.0 113.524 171.512 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -122.83 -30.65 3.8 Favored 'General case' 0 N--CA 1.482 1.134 0 C-N-CA 123.526 0.731 . . . . 0.0 111.169 177.559 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 42' ' ' LYS . . . . . 0.526 ' HA ' HD12 ' A' ' 45' ' ' ILE . 19.3 pttp -61.03 -39.27 89.15 Favored 'General case' 0 N--CA 1.486 1.335 0 C-N-CA 123.899 0.88 . . . . 0.0 112.776 -171.799 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 15.4 p-10 -69.7 -32.75 71.52 Favored 'General case' 0 CA--C 1.544 0.735 0 C-N-CA 122.697 0.399 . . . . 0.0 111.372 176.678 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 42.3 mt -67.18 -44.1 88.02 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.357 0 C-N-CA 122.315 0.246 . . . . 0.0 110.343 176.378 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 45' ' ' ILE . . . . . 0.526 HD12 ' HA ' ' A' ' 42' ' ' LYS . 67.3 mt -55.33 -44.27 74.74 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.325 0 C-N-CA 123.506 0.722 . . . . 0.0 110.011 175.21 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 46' ' ' LYS . . . . . 0.429 ' O ' ' HB2' ' A' ' 50' ' ' GLU . 55.0 tttp -58.37 -44.63 88.94 Favored 'General case' 0 CA--C 1.542 0.67 0 O-C-N 124.213 0.946 . . . . 0.0 110.845 178.414 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 23.7 t80 -59.63 -49.47 77.63 Favored 'General case' 0 N--CA 1.483 1.218 0 O-C-N 123.773 0.671 . . . . 0.0 111.219 177.318 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 97.7 mt -70.0 -31.8 69.67 Favored 'General case' 0 CA--C 1.544 0.731 0 C-N-CA 123.579 0.752 . . . . 0.0 112.115 -174.472 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 49' ' ' GLN . . . . . 0.418 ' HA ' HD21 ' A' ' 57' ' ' LEU . 3.4 pt20 -84.23 -31.1 25.2 Favored 'General case' 0 N--CA 1.488 1.458 0 CA-C-N 117.711 0.232 . . . . 0.0 111.556 179.004 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 50' ' ' GLU . . . . . 0.429 ' HB2' ' O ' ' A' ' 46' ' ' LYS . 7.1 tp10 -63.9 -27.41 69.13 Favored 'General case' 0 N--CA 1.486 1.363 0 C-N-CA 124.168 0.987 . . . . 0.0 111.539 -175.576 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 52.0 m80 -120.95 -33.02 3.83 Favored 'General case' 0 N--CA 1.469 0.519 0 CA-C-N 115.072 -0.967 . . . . 0.0 111.422 -173.624 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -75.97 156.5 47.55 Favored Glycine 0 C--N 1.352 1.418 0 O-C-N 123.314 0.384 . . . . 0.0 113.597 -174.746 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 20.7 t -87.79 172.06 9.93 Favored 'General case' 0 N--CA 1.476 0.841 0 C-N-CA 123.583 0.753 . . . . 0.0 110.898 177.715 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 14.9 m-20 -60.27 -42.19 94.86 Favored 'General case' 0 N--CA 1.479 0.993 0 C-N-CA 124.436 1.094 . . . . 0.0 112.811 -171.206 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 32.9 t -70.42 -27.92 64.65 Favored 'General case' 0 N--CA 1.477 0.911 0 C-N-CA 123.299 0.64 . . . . 0.0 111.25 -176.545 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 56' ' ' PHE . . . . . 0.475 ' HD1' HH11 ' A' ' 90' ' ' ARG . 32.3 t80 -67.73 -46.22 72.79 Favored 'General case' 0 N--CA 1.482 1.155 0 CA-C-O 121.443 0.64 . . . . 0.0 110.085 174.149 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 57' ' ' LEU . . . . . 0.418 HD21 ' HA ' ' A' ' 49' ' ' GLN . 66.0 mt -69.97 -44.87 68.57 Favored 'General case' 0 CA--C 1.538 0.492 0 CA-C-N 114.81 -1.086 . . . . 0.0 110.577 -175.854 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -54.65 -24.44 21.62 Favored 'General case' 0 N--CA 1.484 1.26 0 C-N-CA 125.674 1.59 . . . . 0.0 113.399 -176.815 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 53.8 mt-10 -54.37 -51.35 65.08 Favored 'General case' 0 N--CA 1.482 1.144 0 C-N-CA 123.512 0.725 . . . . 0.0 111.354 -179.459 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 15.9 t60 -119.03 13.79 13.05 Favored 'General case' 0 N--CA 1.487 1.384 0 C-N-CA 122.697 0.399 . . . . 0.0 111.241 175.778 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 61.7 mttp 56.82 65.29 1.43 Allowed 'General case' 0 N--CA 1.478 0.931 0 C-N-CA 124.417 1.087 . . . . 0.0 111.175 -176.184 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 0.55 ' HA ' HG11 ' A' ' 69' ' ' VAL . 77.9 mt -86.24 -9.5 56.38 Favored 'General case' 0 N--CA 1.477 0.921 0 C-N-CA 123.972 0.909 . . . . 0.0 110.042 176.767 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 1.5 pp -80.43 156.06 26.8 Favored 'General case' 0 CA--C 1.545 0.783 0 C-N-CA 124.303 1.041 . . . . 0.0 110.781 177.201 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 90.03 -149.69 20.51 Favored Glycine 0 C--N 1.34 0.79 0 CA-C-N 115.696 -0.684 . . . . 0.0 112.732 178.327 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 65' ' ' ASN . . . . . 0.451 ' O ' HG23 ' A' ' 69' ' ' VAL . 82.3 m-20 -65.05 113.45 3.92 Favored 'General case' 0 N--CA 1.48 1.025 0 C-N-CA 123.927 0.891 . . . . 0.0 110.427 -177.001 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 70.4 mt -59.44 -42.92 89.24 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.125 0 C-N-CA 123.928 0.891 . . . . 0.0 110.605 -176.591 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 17.9 mtpp -55.61 -47.62 76.24 Favored 'General case' 0 CA--C 1.545 0.757 0 C-N-CA 124.063 0.945 . . . . 0.0 111.208 177.643 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 68' ' ' ASN . . . . . 0.52 ' O ' ' HG2' ' A' ' 71' ' ' LYS . 7.0 t30 -61.8 -42.83 99.5 Favored 'General case' 0 N--CA 1.479 0.984 0 C-N-CA 123.599 0.759 . . . . 0.0 111.336 176.068 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 69' ' ' VAL . . . . . 0.55 HG11 ' HA ' ' A' ' 62' ' ' LEU . 87.9 t -68.93 -30.13 45.76 Favored 'Isoleucine or valine' 0 CA--C 1.554 1.109 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.856 -178.988 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -65.82 -8.12 19.91 Favored 'General case' 0 N--CA 1.492 1.652 0 N-CA-C 114.363 1.246 . . . . 0.0 114.363 -173.929 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 71' ' ' LYS . . . . . 0.52 ' HG2' ' O ' ' A' ' 68' ' ' ASN . 64.7 pttt -91.54 -24.47 19.61 Favored 'General case' 0 N--CA 1.483 1.198 0 C-N-CA 122.88 0.472 . . . . 0.0 111.328 178.593 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 6.9 t -111.9 -27.94 8.25 Favored 'General case' 0 N--CA 1.474 0.772 0 C-N-CA 123.584 0.754 . . . . 0.0 110.996 -176.465 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 73' ' ' ALA . . . . . 0.467 ' HB1' HD21 ' A' ' 78' ' ' LEU . . . -73.39 85.28 1.48 Allowed 'General case' 0 C--O 1.243 0.756 0 N-CA-C 108.586 -0.894 . . . . 0.0 108.586 178.435 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 7.6 p30 -73.92 142.93 45.93 Favored 'General case' 0 C--O 1.239 0.529 0 CA-C-N 113.559 -1.655 . . . . 0.0 109.023 179.347 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 75' ' ' LYS . . . . . 0.585 ' HD3' ' HA ' ' A' ' 35' ' ' ARG . 40.4 ttmt -60.49 -34.16 73.65 Favored 'General case' 0 CA--C 1.538 0.492 0 C-N-CA 124.383 1.073 . . . . 0.0 111.419 -174.294 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 27.8 t70 -58.04 -39.91 79.58 Favored 'General case' 0 N--CA 1.472 0.671 0 C-N-CA 123.626 0.77 . . . . 0.0 111.175 177.922 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 73.6 t60 -71.21 -42.42 68.97 Favored 'General case' 0 C--O 1.213 -0.856 0 C-N-CA 123.633 0.773 . . . . 0.0 110.253 176.186 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 78' ' ' LEU . . . . . 0.467 HD21 ' HB1' ' A' ' 73' ' ' ALA . 98.2 mt -67.36 -31.21 71.3 Favored 'General case' 0 N--CA 1.483 1.187 0 N-CA-C 113.051 0.76 . . . . 0.0 113.051 -170.893 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 79' ' ' VAL . . . . . 0.459 HG22 ' HB3' ' A' ' 34' ' ' LEU . 60.0 t -71.58 -46.55 62.41 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.782 0 C-N-CA 123.407 0.683 . . . . 0.0 109.66 174.335 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 34.9 m -63.73 -32.38 73.86 Favored 'General case' 0 N--CA 1.477 0.877 0 CA-C-N 115.431 -0.804 . . . . 0.0 110.921 176.775 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -74.96 -37.52 61.93 Favored 'General case' 0 N--CA 1.473 0.713 0 C-N-CA 124.183 0.993 . . . . 0.0 110.358 179.639 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 82' ' ' TYR . . . . . . . . . . . . . 35.7 t80 -55.25 -55.22 33.87 Favored 'General case' 0 N--CA 1.472 0.673 0 C-N-CA 124.428 1.091 . . . . 0.0 109.954 173.676 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 83' ' ' ASN . . . . . . . . . . . . . 68.5 m-80 -64.59 -41.68 96.09 Favored 'General case' 0 N--CA 1.482 1.133 0 C-N-CA 122.639 0.376 . . . . 0.0 110.842 -178.396 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 16.6 t-160 -67.47 -27.45 67.03 Favored 'General case' 0 N--CA 1.485 1.28 0 C-N-CA 124.037 0.935 . . . . 0.0 110.787 -178.684 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -59.72 -53.05 62.53 Favored 'General case' 0 N--CA 1.48 1.075 0 C-N-CA 124.182 0.993 . . . . 0.0 109.822 -179.448 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 32.2 m-85 -74.08 -28.28 61.31 Favored 'General case' 0 CA--C 1.547 0.849 0 CA-C-N 114.22 -1.354 . . . . 0.0 111.462 -179.963 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 9.4 tm-20 -73.19 -26.76 61.29 Favored 'General case' 0 N--CA 1.48 1.058 0 C-N-CA 124.149 0.979 . . . . 0.0 111.498 -174.345 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 23.0 p -116.79 -7.16 11.51 Favored 'General case' 0 N--CA 1.479 0.98 0 C-N-CA 123.315 0.646 . . . . 0.0 111.403 178.05 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 41.5 mtmt 59.79 35.29 22.03 Favored 'General case' 0 N--CA 1.487 1.387 0 C-N-CA 124.197 0.999 . . . . 0.0 111.901 175.212 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 90' ' ' ARG . . . . . 0.475 HH11 ' HD1' ' A' ' 56' ' ' PHE . 99.4 mtt180 -62.91 -15.74 56.39 Favored 'General case' 0 N--CA 1.49 1.569 0 N-CA-C 113.562 0.949 . . . . 0.0 113.562 -173.26 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 91' ' ' PHE . . . . . . . . . . . . . 21.9 p90 -71.37 162.08 30.02 Favored 'General case' 0 C--N 1.321 -0.654 0 C-N-CA 123.722 0.809 . . . . 0.0 111.904 172.645 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 1.4 tmtp? . . . . . 0 C--O 1.243 0.734 0 N-CA-C 105.668 -1.975 . . . . 0.0 105.668 167.294 . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 20' ' ' MET . . . . . . . . . . . . . 14.6 tpt . . . . . 0 N--CA 1.48 1.072 0 N-CA-C 110.325 -0.25 . . . . 0.0 110.325 . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -73.85 91.17 1.95 Allowed 'General case' 0 N--CA 1.47 0.545 0 C-N-CA 123.186 0.594 . . . . 0.0 109.602 173.772 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -144.66 88.68 1.93 Allowed 'General case' 0 N--CA 1.468 0.46 0 C-N-CA 123.622 0.769 . . . . 0.0 109.598 -177.941 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -77.6 99.03 5.6 Favored 'General case' 0 N--CA 1.472 0.66 0 N-CA-C 109.289 -0.634 . . . . 0.0 109.289 178.918 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 31.0 m -64.86 132.24 95.4 Favored Pre-proline 0 CA--C 1.555 1.162 0 N-CA-C 109.865 -0.42 . . . . 0.0 109.865 176.568 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 73.8 Cg_endo -68.71 169.16 18.13 Favored 'Trans proline' 0 C--N 1.369 1.61 0 C-N-CA 122.842 2.361 . . . . 0.0 113.085 -173.598 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 29.6 pt20 -119.01 147.86 43.62 Favored 'General case' 0 C--O 1.245 0.827 0 CA-C-N 114.751 -1.113 . . . . 0.0 108.952 -178.941 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 36.0 ttp180 -72.3 108.0 5.2 Favored 'General case' 0 CA--C 1.534 0.334 0 N-CA-C 108.542 -0.91 . . . . 0.0 108.542 169.862 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -89.64 -18.02 27.29 Favored 'General case' 0 CA--C 1.543 0.703 0 CA-C-N 114.324 -1.307 . . . . 0.0 111.751 -172.498 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 29' ' ' TRP . . . . . . . . . . . . . 5.7 m-90 -130.51 139.25 50.51 Favored 'General case' 0 N--CA 1.473 0.718 0 C-N-CA 123.856 0.863 . . . . 0.0 109.792 -174.221 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 73.8 p -80.27 167.31 20.44 Favored 'General case' 0 C--O 1.242 0.702 0 N-CA-C 108.329 -0.989 . . . . 0.0 108.329 171.796 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 31' ' ' VAL . . . . . 0.579 ' HA ' HD12 ' A' ' 34' ' ' LEU . 9.5 p -62.81 -30.04 48.51 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.89 0 CA-C-N 117.572 0.169 . . . . 0.0 111.376 -174.946 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 9.9 pt-20 -68.76 -40.49 79.72 Favored 'General case' 0 C--N 1.359 0.981 0 C-N-CA 123.067 0.547 . . . . 0.0 110.706 175.185 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 52.6 mt-30 -64.14 -41.71 97.09 Favored 'General case' 0 N--CA 1.482 1.148 0 C-N-CA 123.002 0.521 . . . . 0.0 110.599 178.151 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.579 HD12 ' HA ' ' A' ' 31' ' ' VAL . 84.3 mt -60.29 -52.99 62.91 Favored 'General case' 0 N--CA 1.47 0.555 0 O-C-N 124.361 1.038 . . . . 0.0 111.219 -178.539 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 16.6 ptm180 -72.74 -23.19 60.81 Favored 'General case' 0 N--CA 1.475 0.818 0 O-C-N 124.418 1.074 . . . . 0.0 110.768 -175.876 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 24.7 t -63.19 123.3 18.28 Favored 'General case' 0 C--N 1.356 0.853 0 C-N-CA 123.032 0.533 . . . . 0.0 110.291 -177.788 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 12.0 pt-20 -65.01 -21.01 66.78 Favored 'General case' 0 N--CA 1.474 0.754 0 C-N-CA 123.858 0.863 . . . . 0.0 112.521 -177.653 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 94.8 mt-30 -68.56 -26.91 65.65 Favored 'General case' 0 CA--C 1.542 0.655 0 C-N-CA 123.749 0.82 . . . . 0.0 110.905 177.265 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 60.5 tp -83.14 117.97 70.23 Favored Pre-proline 0 N--CA 1.478 0.942 0 N-CA-C 108.363 -0.976 . . . . 0.0 108.363 169.511 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 40' ' ' PRO . . . . . 0.603 ' HB2' ' HG2' ' A' ' 42' ' ' LYS . 30.1 Cg_endo -64.01 141.23 76.21 Favored 'Trans proline' 0 C--N 1.376 2.004 0 C-N-CA 122.175 1.916 . . . . 0.0 112.254 176.414 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 50.5 mtmt -61.24 -32.68 72.47 Favored 'General case' 0 N--CA 1.474 0.748 0 C-N-CA 124.203 1.001 . . . . 0.0 111.026 178.832 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 42' ' ' LYS . . . . . 0.603 ' HG2' ' HB2' ' A' ' 40' ' ' PRO . 17.8 ptpt -65.99 -31.52 72.46 Favored 'General case' 0 N--CA 1.469 0.517 0 C-N-CA 123.858 0.863 . . . . 0.0 111.021 -179.568 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 43' ' ' ASP . . . . . 0.603 ' HB2' ' HG2' ' A' ' 40' ' ' PRO . 2.4 t70 -67.05 -38.05 85.13 Favored 'General case' 0 N--CA 1.481 1.089 0 N-CA-C 109.391 -0.596 . . . . 0.0 109.391 -178.246 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 44' ' ' ILE . . . . . 0.518 ' O ' ' HG ' ' A' ' 48' ' ' LEU . 23.6 mt -67.34 -53.93 28.3 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.765 0 CA-C-N 115.17 -0.923 . . . . 0.0 109.705 177.411 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 73.8 mt -60.09 -36.18 66.03 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.733 0 C-N-CA 123.655 0.782 . . . . 0.0 111.955 -178.453 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 33.8 ttpt -53.86 -45.19 70.91 Favored 'General case' 0 N--CA 1.48 1.052 0 C-N-CA 124.364 1.066 . . . . 0.0 110.479 174.314 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 31.9 t80 -67.51 -45.62 75.26 Favored 'General case' 0 CA--C 1.551 1.0 0 CA-C-N 114.353 -1.294 . . . . 0.0 111.442 177.384 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 48' ' ' LEU . . . . . 0.518 ' HG ' ' O ' ' A' ' 44' ' ' ILE . 73.9 mt -65.55 -34.25 77.81 Favored 'General case' 0 N--CA 1.477 0.923 0 C-N-CA 123.857 0.863 . . . . 0.0 111.673 -172.903 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 49' ' ' GLN . . . . . 0.464 ' HA ' HD21 ' A' ' 57' ' ' LEU . 3.4 pt20 -83.92 -28.03 28.16 Favored 'General case' 0 N--CA 1.481 1.081 0 C-N-CA 122.637 0.375 . . . . 0.0 110.766 176.004 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 11.5 tp10 -61.83 -48.91 78.47 Favored 'General case' 0 N--CA 1.482 1.134 0 C-N-CA 123.699 0.8 . . . . 0.0 110.73 179.1 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 1.1 m80 -140.59 22.86 2.32 Favored 'General case' 0 N--CA 1.482 1.135 0 N-CA-C 113.203 0.816 . . . . 0.0 113.203 -171.23 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -84.99 -144.18 6.76 Favored Glycine 0 CA--C 1.534 1.243 0 N-CA-C 109.375 -1.49 . . . . 0.0 109.375 157.467 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 53' ' ' SER . . . . . 0.461 ' O ' ' HG ' ' A' ' 57' ' ' LEU . 28.1 t -149.67 162.68 39.75 Favored 'General case' 0 N--CA 1.478 0.932 0 CA-C-N 117.59 0.695 . . . . 0.0 109.847 174.77 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 4.0 p30 -52.48 -36.04 54.07 Favored 'General case' 0 N--CA 1.487 1.377 0 C-N-CA 124.485 1.114 . . . . 0.0 112.988 -174.424 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 20.4 m -70.69 -43.43 69.04 Favored 'General case' 0 CA--C 1.546 0.791 0 C-N-CA 123.706 0.802 . . . . 0.0 110.762 179.623 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 56' ' ' PHE . . . . . 0.42 ' HE2' ' HB3' ' A' ' 48' ' ' LEU . 66.2 t80 -60.41 -38.92 85.56 Favored 'General case' 0 N--CA 1.483 1.196 0 C-N-CA 124.16 0.984 . . . . 0.0 110.348 174.474 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 57' ' ' LEU . . . . . 0.464 HD21 ' HA ' ' A' ' 49' ' ' GLN . 51.6 mt -73.9 -32.49 63.6 Favored 'General case' 0 C--O 1.211 -0.936 0 CA-C-N 115.012 -0.994 . . . . 0.0 110.485 -178.983 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -69.92 -47.15 63.55 Favored 'General case' 0 N--CA 1.483 1.18 0 C-N-CA 123.334 0.654 . . . . 0.0 111.391 179.024 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 42.2 mt-10 -55.15 -47.11 75.58 Favored 'General case' 0 N--CA 1.486 1.364 0 C-N-CA 123.631 0.773 . . . . 0.0 111.003 179.196 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 28.6 m80 -107.76 4.68 25.88 Favored 'General case' 0 CA--C 1.543 0.705 0 CA-C-N 115.583 -0.735 . . . . 0.0 111.871 -170.088 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 48.9 mtmt 55.73 39.24 30.81 Favored 'General case' 0 N--CA 1.492 1.639 0 C-N-CA 123.91 0.884 . . . . 0.0 111.824 176.754 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 0.558 ' HA ' HG11 ' A' ' 69' ' ' VAL . 73.2 mt -88.12 -6.48 57.87 Favored 'General case' 0 N--CA 1.479 0.998 0 C-N-CA 123.93 0.892 . . . . 0.0 111.099 -179.723 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 63' ' ' LEU . . . . . 0.417 ' H ' ' HG ' ' A' ' 63' ' ' LEU . 1.8 pp -73.04 159.99 32.75 Favored 'General case' 0 N--CA 1.474 0.771 0 C-N-CA 124.011 0.924 . . . . 0.0 111.513 174.34 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 92.22 -168.46 31.1 Favored Glycine 0 CA--C 1.524 0.621 0 CA-C-N 115.518 -0.764 . . . . 0.0 112.682 179.729 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 16.1 m120 -62.37 126.15 26.35 Favored 'General case' 0 N--CA 1.478 0.948 0 C-N-CA 123.635 0.774 . . . . 0.0 109.831 -179.58 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 54.8 mt -57.09 -48.12 82.53 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.86 0 O-C-N 124.268 0.98 . . . . 0.0 112.434 -168.543 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 22.4 pttp -65.38 -31.55 72.72 Favored 'General case' 0 N--CA 1.482 1.159 0 C-N-CA 123.688 0.795 . . . . 0.0 111.575 -178.137 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 48.9 t30 -66.75 -41.77 87.26 Favored 'General case' 0 N--CA 1.481 1.121 0 C-N-CA 123.372 0.669 . . . . 0.0 109.862 176.458 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 69' ' ' VAL . . . . . 0.558 HG11 ' HA ' ' A' ' 62' ' ' LEU . 38.4 t -69.04 -34.57 64.56 Favored 'Isoleucine or valine' 0 C--O 1.212 -0.889 0 CA-C-N 115.03 -0.986 . . . . 0.0 109.644 175.31 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -75.37 -2.14 27.11 Favored 'General case' 0 N--CA 1.484 1.23 0 C-N-CA 123.683 0.793 . . . . 0.0 111.341 179.372 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 40.2 ttmt -95.06 -49.63 5.44 Favored 'General case' 0 CA--C 1.547 0.83 0 C-N-CA 123.554 0.742 . . . . 0.0 110.347 172.313 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 15.1 t -83.03 -33.63 26.44 Favored 'General case' 0 CA--C 1.555 1.167 0 C-N-CA 123.435 0.694 . . . . 0.0 111.955 -172.679 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -92.41 118.16 30.66 Favored 'General case' 0 N--CA 1.47 0.563 0 C-N-CA 123.972 0.909 . . . . 0.0 109.735 -179.452 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 74' ' ' ASN . . . . . 0.437 ' O ' ' HB3' ' A' ' 77' ' ' HIS . 24.0 p-10 -76.73 168.41 20.13 Favored 'General case' 0 N--CA 1.476 0.835 0 C-N-CA 123.173 0.589 . . . . 0.0 110.042 173.328 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 75' ' ' LYS . . . . . 0.416 ' HD3' ' O ' ' A' ' 34' ' ' LEU . 32.3 ttmt -71.99 -32.3 67.08 Favored 'General case' 0 CA--C 1.543 0.703 0 C-N-CA 122.78 0.432 . . . . 0.0 111.709 -175.184 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 33.9 t70 -60.74 -28.58 68.8 Favored 'General case' 0 N--CA 1.487 1.409 0 C-N-CA 123.283 0.633 . . . . 0.0 111.527 177.354 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 77' ' ' HIS . . . . . 0.474 ' HD2' HD23 ' A' ' 78' ' ' LEU . 42.1 t60 -71.2 -48.91 48.68 Favored 'General case' 0 CA--C 1.552 1.045 0 C-N-CA 125.055 1.342 . . . . 0.0 109.978 172.211 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 78' ' ' LEU . . . . . 0.474 HD23 ' HD2' ' A' ' 77' ' ' HIS . 77.6 mt -67.22 -45.79 75.76 Favored 'General case' 0 N--CA 1.487 1.408 0 N-CA-C 113.454 0.909 . . . . 0.0 113.454 -169.132 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 79' ' ' VAL . . . . . 0.524 HG22 ' HB3' ' A' ' 34' ' ' LEU . 61.9 t -59.53 -42.06 86.83 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.218 0 O-C-N 123.941 0.775 . . . . 0.0 110.207 -177.812 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 24.8 m -62.54 -44.41 96.4 Favored 'General case' 0 N--CA 1.476 0.847 0 CA-C-N 115.203 -0.908 . . . . 0.0 111.496 177.815 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -66.42 -39.35 88.89 Favored 'General case' 0 N--CA 1.48 1.041 0 C-N-CA 123.55 0.74 . . . . 0.0 110.7 -179.803 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 82' ' ' TYR . . . . . 0.455 ' CD2' HD11 ' A' ' 34' ' ' LEU . 86.6 t80 -63.13 -54.56 35.87 Favored 'General case' 0 N--CA 1.471 0.621 0 C-N-CA 124.387 1.075 . . . . 0.0 111.105 -177.328 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 83' ' ' ASN . . . . . . . . . . . . . 67.8 m-80 -68.71 -35.76 77.57 Favored 'General case' 0 N--CA 1.481 1.115 0 C-N-CA 123.055 0.542 . . . . 0.0 110.96 -177.492 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 37.9 t60 -63.97 -30.54 71.61 Favored 'General case' 0 N--CA 1.483 1.218 0 C-N-CA 123.859 0.863 . . . . 0.0 110.647 174.292 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 85' ' ' LEU . . . . . 0.408 ' HA ' ' HG2' ' A' ' 90' ' ' ARG . 1.5 tt -60.1 -51.93 67.53 Favored 'General case' 0 N--CA 1.479 1.018 0 C-N-CA 123.467 0.707 . . . . 0.0 109.522 -176.842 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 35.0 m-85 -73.11 -31.89 64.61 Favored 'General case' 0 N--CA 1.48 1.055 0 CA-C-N 115.499 -0.773 . . . . 0.0 110.991 -179.108 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 9.7 tp10 -60.68 -41.61 95.42 Favored 'General case' 0 N--CA 1.477 0.911 0 C-N-CA 124.345 1.058 . . . . 0.0 111.699 -177.114 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 12.2 p -120.32 3.73 10.81 Favored 'General case' 0 N--CA 1.477 0.916 0 C-N-CA 124.152 0.981 . . . . 0.0 111.779 -175.602 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 56.2 mtpt 53.85 70.17 0.63 Allowed 'General case' 0 N--CA 1.48 1.038 0 C-N-CA 124.673 1.189 . . . . 0.0 111.787 178.634 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 90' ' ' ARG . . . . . 0.408 ' HG2' ' HA ' ' A' ' 85' ' ' LEU . 26.3 mmm180 -80.12 14.33 1.93 Allowed 'General case' 0 N--CA 1.493 1.693 0 C-N-CA 124.241 1.016 . . . . 0.0 112.369 -179.722 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 91' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -65.15 163.25 15.4 Favored 'General case' 0 N--CA 1.479 1.012 0 C-N-CA 123.671 0.788 . . . . 0.0 110.839 -177.854 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 23.1 ttmm . . . . . 0 C--O 1.254 1.338 0 CA-C-N 115.256 -0.884 . . . . 0.0 109.287 174.952 . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 20' ' ' MET . . . . . . . . . . . . . 25.8 ptt? . . . . . 0 N--CA 1.485 1.29 0 N-CA-C 111.112 0.042 . . . . 0.0 111.112 . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -158.33 151.5 22.87 Favored 'General case' 0 N--CA 1.477 0.9 0 C-N-CA 123.849 0.859 . . . . 0.0 109.858 -178.22 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -100.32 137.88 38.15 Favored 'General case' 0 C--O 1.241 0.626 0 N-CA-C 109.513 -0.551 . . . . 0.0 109.513 174.784 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -72.13 88.38 1.11 Allowed 'General case' 0 N--CA 1.473 0.722 0 C-N-CA 123.435 0.694 . . . . 0.0 109.907 179.986 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 6.2 m -117.76 82.06 16.01 Favored Pre-proline 0 N--CA 1.477 0.886 0 C-N-CA 123.751 0.821 . . . . 0.0 109.902 -178.481 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 44.2 Cg_endo -72.25 128.83 14.21 Favored 'Trans proline' 0 C--N 1.37 1.71 0 C-N-CA 122.155 1.903 . . . . 0.0 111.061 179.583 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 45.1 mt-30 -74.84 178.11 5.76 Favored 'General case' 0 C--O 1.244 0.767 0 CA-C-N 115.578 -0.737 . . . . 0.0 109.178 167.309 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 27' ' ' ARG . . . . . 0.419 ' HD3' ' H ' ' A' ' 27' ' ' ARG . 0.0 OUTLIER -57.96 135.53 56.94 Favored 'General case' 0 CA--C 1.545 0.786 0 CA-C-O 121.128 0.49 . . . . 0.0 111.3 175.45 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -78.97 -34.56 44.13 Favored 'General case' 0 CA--C 1.535 0.39 0 N-CA-C 108.697 -0.853 . . . . 0.0 108.697 173.348 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 29' ' ' TRP . . . . . . . . . . . . . 4.7 m-90 -134.13 149.83 51.1 Favored 'General case' 0 N--CA 1.476 0.835 0 C-N-CA 124.679 1.192 . . . . 0.0 108.344 178.782 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 21.6 p -91.72 178.1 6.01 Favored 'General case' 0 N--CA 1.478 0.929 0 C-N-CA 122.814 0.446 . . . . 0.0 110.916 -178.482 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 7.2 p -54.34 -45.78 68.96 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.608 0 N-CA-C 113.441 0.904 . . . . 0.0 113.441 -169.873 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 1.3 pm0 -71.42 -31.3 67.07 Favored 'General case' 0 N--CA 1.476 0.843 0 C-N-CA 123.133 0.573 . . . . 0.0 111.447 179.305 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 23.4 mm-40 -71.28 -32.98 69.33 Favored 'General case' 0 N--CA 1.476 0.844 0 C-N-CA 123.139 0.576 . . . . 0.0 110.613 175.69 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 70.3 mt -81.34 -27.3 35.0 Favored 'General case' 0 N--CA 1.475 0.797 0 C-N-CA 123.79 0.836 . . . . 0.0 111.827 -176.25 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 3.6 ptm180 -82.68 -25.26 33.2 Favored 'General case' 0 N--CA 1.479 0.983 0 CA-C-O 119.669 -0.205 . . . . 0.0 110.829 169.715 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 37.1 t -59.94 125.33 23.23 Favored 'General case' 0 N--CA 1.486 1.36 0 C-N-CA 124.093 0.957 . . . . 0.0 112.111 -172.974 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 10.9 tp10 -65.46 -17.16 64.34 Favored 'General case' 0 CA--C 1.555 1.161 0 C-N-CA 124.487 1.115 . . . . 0.0 111.558 178.534 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 71.3 mt-30 -62.89 -38.59 91.51 Favored 'General case' 0 N--CA 1.476 0.869 0 C-N-CA 123.852 0.861 . . . . 0.0 110.418 173.377 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.512 HD12 ' HD2' ' A' ' 40' ' ' PRO . 51.4 tp -86.52 128.09 58.22 Favored Pre-proline 0 N--CA 1.482 1.134 0 C-N-CA 123.777 0.831 . . . . 0.0 110.016 177.573 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 40' ' ' PRO . . . . . 0.512 ' HD2' HD12 ' A' ' 39' ' ' LEU . 39.0 Cg_endo -70.14 134.26 26.78 Favored 'Trans proline' 0 C--N 1.379 2.144 0 C-N-CA 122.363 2.042 . . . . 0.0 112.318 173.168 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 41' ' ' LYS . . . . . 0.517 ' HB3' ' HD3' ' A' ' 75' ' ' LYS . 21.5 pttp -76.95 -20.01 56.65 Favored 'General case' 0 N--CA 1.48 1.051 0 N-CA-C 113.235 0.828 . . . . 0.0 113.235 -173.213 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 42' ' ' LYS . . . . . 0.567 ' HA ' HD12 ' A' ' 45' ' ' ILE . 60.1 pttt -63.77 -30.76 71.82 Favored 'General case' 0 N--CA 1.478 0.941 0 C-N-CA 122.966 0.507 . . . . 0.0 110.706 171.256 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -73.94 -26.25 60.4 Favored 'General case' 0 N--CA 1.479 0.996 0 C-N-CA 122.967 0.507 . . . . 0.0 111.596 177.692 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 39.3 mt -74.55 -43.99 47.75 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.971 0 N-CA-C 109.438 -0.578 . . . . 0.0 109.438 174.846 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 45' ' ' ILE . . . . . 0.567 HD12 ' HA ' ' A' ' 42' ' ' LYS . 77.9 mt -53.89 -46.85 64.57 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.165 0 C-N-CA 123.358 0.663 . . . . 0.0 109.314 172.119 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 29.0 ttpp -63.79 -39.37 94.1 Favored 'General case' 0 CA--C 1.538 0.519 0 CA-C-N 114.467 -1.242 . . . . 0.0 110.893 -177.948 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 26.5 t80 -64.64 -54.31 33.77 Favored 'General case' 0 N--CA 1.473 0.693 0 O-C-N 123.969 0.793 . . . . 0.0 110.623 177.13 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 95.8 mt -69.03 -29.69 67.91 Favored 'General case' 0 N--CA 1.474 0.726 0 C-N-CA 123.656 0.782 . . . . 0.0 111.846 -173.03 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 3.0 pt20 -79.45 -26.21 41.81 Favored 'General case' 0 N--CA 1.48 1.039 0 C-N-CA 122.222 0.209 . . . . 0.0 110.621 176.646 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 10.7 tp10 -61.23 -37.71 84.03 Favored 'General case' 0 N--CA 1.482 1.159 0 C-N-CA 123.679 0.791 . . . . 0.0 111.269 -179.477 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 31.2 p-80 -124.34 -32.21 3.2 Favored 'General case' 0 N--CA 1.485 1.32 0 N-CA-C 113.253 0.834 . . . . 0.0 113.253 -174.24 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -61.83 139.84 46.78 Favored Glycine 0 C--N 1.348 1.198 0 CA-C-N 118.221 0.464 . . . . 0.0 113.6 178.115 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 53' ' ' SER . . . . . 0.472 ' O ' ' HG ' ' A' ' 57' ' ' LEU . 44.1 t -60.14 148.36 36.33 Favored 'General case' 0 N--CA 1.48 1.057 0 C-N-CA 123.582 0.753 . . . . 0.0 111.597 179.556 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 14.2 m-20 -61.52 -32.9 72.96 Favored 'General case' 0 N--CA 1.487 1.419 0 C-N-CA 123.65 0.78 . . . . 0.0 112.489 -174.181 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 21.5 m -67.42 -41.93 84.05 Favored 'General case' 0 CA--C 1.544 0.716 0 O-C-N 123.607 0.567 . . . . 0.0 110.402 177.827 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 56' ' ' PHE . . . . . 0.52 ' HB2' ' HD3' ' A' ' 90' ' ' ARG . 62.4 t80 -60.98 -43.9 98.14 Favored 'General case' 0 N--CA 1.477 0.882 0 C-N-CA 123.849 0.86 . . . . 0.0 109.934 174.027 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 57' ' ' LEU . . . . . 0.472 ' HG ' ' O ' ' A' ' 53' ' ' SER . 73.1 mt -64.53 -44.49 90.67 Favored 'General case' 0 C--O 1.209 -1.068 0 CA-C-N 115.097 -0.956 . . . . 0.0 110.491 -177.506 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -61.72 -45.28 94.64 Favored 'General case' 0 N--CA 1.482 1.138 0 C-N-CA 123.655 0.782 . . . . 0.0 111.393 -177.39 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 46.7 mt-10 -60.38 -36.58 78.39 Favored 'General case' 0 N--CA 1.482 1.168 0 C-N-CA 123.666 0.787 . . . . 0.0 112.006 177.668 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 53.2 m80 -105.11 6.82 33.51 Favored 'General case' 0 N--CA 1.487 1.393 0 C-N-CA 122.967 0.507 . . . . 0.0 112.132 -177.59 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 68.8 mmtt 59.96 27.22 16.57 Favored 'General case' 0 N--CA 1.488 1.436 0 C-N-CA 125.094 1.358 . . . . 0.0 112.981 175.65 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 70.1 mt -81.92 -21.51 37.3 Favored 'General case' 0 N--CA 1.483 1.198 0 C-N-CA 124.157 0.983 . . . . 0.0 112.669 -174.703 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -78.09 170.04 17.27 Favored 'General case' 0 N--CA 1.485 1.283 0 CA-C-O 120.809 0.337 . . . . 0.0 111.683 179.818 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 90.96 -157.55 25.23 Favored Glycine 0 C--N 1.341 0.848 0 CA-C-N 115.391 -0.822 . . . . 0.0 112.367 177.303 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 65' ' ' ASN . . . . . 0.402 ' O ' HG23 ' A' ' 69' ' ' VAL . 17.8 m120 -69.41 115.93 9.25 Favored 'General case' 0 N--CA 1.47 0.567 0 C-N-CA 123.62 0.768 . . . . 0.0 110.205 -179.437 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 65.7 mt -54.29 -50.35 57.11 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.967 0 C-N-CA 124.515 1.126 . . . . 0.0 112.187 -173.758 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 67' ' ' LYS . . . . . 0.501 ' H ' ' HD2' ' A' ' 67' ' ' LYS . 0.0 OUTLIER -60.92 -41.64 96.59 Favored 'General case' 0 N--CA 1.48 1.049 0 O-C-N 123.774 0.671 . . . . 0.0 109.661 -175.898 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 49.5 t30 -61.35 -47.82 84.11 Favored 'General case' 0 N--CA 1.479 1.008 0 CA-C-N 115.075 -0.966 . . . . 0.0 110.975 176.959 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 69' ' ' VAL . . . . . 0.402 HG23 ' O ' ' A' ' 65' ' ' ASN . 85.8 t -62.28 -32.35 54.57 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.099 0 C-N-CA 123.585 0.754 . . . . 0.0 110.732 178.676 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -70.69 8.02 0.97 Allowed 'General case' 0 CA--C 1.554 1.134 0 C-N-CA 123.738 0.815 . . . . 0.0 112.976 -178.453 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 16.5 ptpt -94.81 -27.4 15.78 Favored 'General case' 0 N--CA 1.484 1.255 0 CA-C-N 119.179 0.9 . . . . 0.0 110.824 169.69 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 10.2 t -109.23 -28.94 8.74 Favored 'General case' 0 N--CA 1.482 1.155 0 C-N-CA 123.732 0.813 . . . . 0.0 111.045 -175.207 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -80.62 86.36 5.89 Favored 'General case' 0 C--O 1.237 0.447 0 C-N-CA 123.511 0.724 . . . . 0.0 109.656 -178.66 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 3.9 p-10 -70.27 160.95 31.26 Favored 'General case' 0 C--O 1.239 0.538 0 CA-C-N 114.489 -1.232 . . . . 0.0 110.389 174.877 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 75' ' ' LYS . . . . . 0.517 ' HD3' ' HB3' ' A' ' 41' ' ' LYS . 13.3 tptm -61.19 -47.73 84.79 Favored 'General case' 0 N--CA 1.471 0.59 0 CA-C-N 115.712 -0.676 . . . . 0.0 111.3 -166.923 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 4.4 p30 -69.43 -29.94 67.76 Favored 'General case' 0 N--CA 1.485 1.3 0 CA-C-N 115.975 -0.557 . . . . 0.0 111.649 -176.304 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 74.5 t60 -59.83 -41.53 91.53 Favored 'General case' 0 N--CA 1.481 1.099 0 C-N-CA 123.883 0.873 . . . . 0.0 110.128 173.094 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 78' ' ' LEU . . . . . 0.452 ' CD1' ' HB2' ' A' ' 41' ' ' LYS . 83.5 mt -74.1 -28.95 61.6 Favored 'General case' 0 N--CA 1.47 0.533 0 CA-C-N 115.242 -0.89 . . . . 0.0 112.24 -176.92 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 79' ' ' VAL . . . . . 0.414 HG23 ' O ' ' A' ' 75' ' ' LYS . 21.3 t -73.73 -39.1 52.49 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.914 0 N-CA-C 109.732 -0.47 . . . . 0.0 109.732 173.553 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 29.2 m -67.5 -36.62 81.44 Favored 'General case' 0 N--CA 1.48 1.061 0 C-N-CA 122.895 0.478 . . . . 0.0 111.098 176.094 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -68.34 -39.65 81.84 Favored 'General case' 0 N--CA 1.473 0.688 0 C-N-CA 123.378 0.671 . . . . 0.0 109.955 175.663 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 82' ' ' TYR . . . . . . . . . . . . . 15.2 t80 -53.57 -58.86 5.67 Favored 'General case' 0 CA--C 1.542 0.65 0 CA-C-N 115.084 -0.962 . . . . 0.0 110.217 174.859 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 83' ' ' ASN . . . . . . . . . . . . . 49.4 m-80 -64.72 -31.19 72.3 Favored 'General case' 0 N--CA 1.481 1.112 0 C-N-CA 122.749 0.42 . . . . 0.0 111.501 -175.513 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 6.4 t60 -65.7 -45.66 81.91 Favored 'General case' 0 CA--C 1.549 0.938 0 C-N-CA 123.471 0.708 . . . . 0.0 110.267 178.218 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 85' ' ' LEU . . . . . 0.418 HD12 ' HB2' ' A' ' 90' ' ' ARG . 20.2 tp -57.13 -54.72 43.57 Favored 'General case' 0 N--CA 1.49 1.531 0 C-N-CA 123.701 0.8 . . . . 0.0 112.34 -172.691 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 83.0 m-85 -74.6 -21.73 59.32 Favored 'General case' 0 CA--C 1.543 0.697 0 CA-C-N 113.625 -1.625 . . . . 0.0 111.409 -174.519 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 7.9 tp10 -82.91 -10.84 58.62 Favored 'General case' 0 N--CA 1.478 0.96 0 C-N-CA 123.165 0.586 . . . . 0.0 111.601 178.524 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 31.4 p -125.5 -3.17 7.34 Favored 'General case' 0 N--CA 1.483 1.211 0 C-N-CA 123.617 0.767 . . . . 0.0 110.94 178.691 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 74.4 mmtt 61.04 23.84 13.99 Favored 'General case' 0 N--CA 1.486 1.359 0 C-N-CA 125.033 1.333 . . . . 0.0 113.125 174.052 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 90' ' ' ARG . . . . . 0.52 ' HD3' ' HB2' ' A' ' 56' ' ' PHE . 51.1 mtt180 -65.15 -18.87 65.67 Favored 'General case' 0 N--CA 1.491 1.605 0 N-CA-C 113.812 1.041 . . . . 0.0 113.812 -170.296 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 91' ' ' PHE . . . . . . . . . . . . . 24.6 p90 -59.68 145.65 44.08 Favored 'General case' 0 N--CA 1.476 0.841 0 C-N-CA 122.688 0.395 . . . . 0.0 111.571 177.56 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 14.1 mmmm . . . . . 0 CA--C 1.554 1.107 0 C-N-CA 124.736 1.214 . . . . 0.0 111.561 -167.27 . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 20' ' ' MET . . . . . . . . . . . . . 12.5 tpt . . . . . 0 N--CA 1.484 1.243 0 N-CA-C 110.276 -0.268 . . . . 0.0 110.276 . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -160.49 117.97 2.48 Favored 'General case' 0 C--O 1.245 0.858 0 C-N-CA 123.723 0.809 . . . . 0.0 109.648 178.502 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -72.14 82.71 0.99 Allowed 'General case' 0 N--CA 1.476 0.863 0 C-N-CA 123.759 0.824 . . . . 0.0 109.51 177.411 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -153.65 123.63 6.88 Favored 'General case' 0 CA--C 1.54 0.566 0 C-N-CA 124.643 1.177 . . . . 0.0 109.297 -173.599 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 35.4 m -102.02 138.97 19.91 Favored Pre-proline 0 N--CA 1.477 0.899 0 C-N-CA 123.211 0.604 . . . . 0.0 110.822 -179.06 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 25' ' ' PRO . . . . . 0.425 ' HD2' ' NH2' ' A' ' 27' ' ' ARG . 56.3 Cg_endo -82.43 160.54 17.2 Favored 'Trans proline' 0 C--N 1.371 1.76 0 C-N-CA 122.909 2.406 . . . . 0.0 111.987 176.886 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 27.1 mt-30 -90.98 61.86 4.74 Favored 'General case' 0 C--O 1.244 0.79 0 N-CA-C 109.484 -0.562 . . . . 0.0 109.484 173.793 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 27' ' ' ARG . . . . . 0.425 ' NH2' ' HD2' ' A' ' 25' ' ' PRO . 0.7 OUTLIER -64.08 138.76 58.61 Favored 'General case' 0 CA--C 1.547 0.858 0 N-CA-C 108.341 -0.985 . . . . 0.0 108.341 176.639 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -128.9 -17.57 3.94 Favored 'General case' 0 N--CA 1.482 1.169 0 N-CA-C 112.543 0.572 . . . . 0.0 112.543 -167.537 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 29' ' ' TRP . . . . . . . . . . . . . 2.1 m-90 -126.27 138.1 53.57 Favored 'General case' 0 N--CA 1.481 1.101 0 C-N-CA 122.606 0.362 . . . . 0.0 110.143 -167.765 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 8.4 m -81.83 161.95 23.02 Favored 'General case' 0 CA--C 1.549 0.935 0 N-CA-C 108.191 -1.04 . . . . 0.0 108.191 171.353 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 31' ' ' VAL . . . . . 0.556 ' HA ' HD12 ' A' ' 34' ' ' LEU . 60.1 t -57.48 -33.3 43.95 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.485 0 C-N-CA 123.003 0.521 . . . . 0.0 110.74 -177.483 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 12.0 pt-20 -68.07 -38.56 82.53 Favored 'General case' 0 N--CA 1.478 0.97 0 C-N-CA 124.558 1.143 . . . . 0.0 111.83 176.026 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 43.2 mt-30 -65.49 -37.76 87.76 Favored 'General case' 0 N--CA 1.48 1.044 0 C-N-CA 122.54 0.336 . . . . 0.0 110.467 176.552 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.556 HD12 ' HA ' ' A' ' 31' ' ' VAL . 72.9 mt -65.15 -56.45 12.83 Favored 'General case' 0 C--N 1.347 0.492 0 O-C-N 123.969 0.793 . . . . 0.0 110.233 -178.516 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 40.2 ptt180 -65.01 -24.47 67.51 Favored 'General case' 0 N--CA 1.481 1.1 0 CA-C-N 115.331 -0.85 . . . . 0.0 111.194 -173.517 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 33.6 t -65.39 116.09 6.33 Favored 'General case' 0 C--O 1.24 0.582 0 N-CA-C 108.599 -0.889 . . . . 0.0 108.599 173.408 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 5.2 tp10 -73.76 -7.01 50.48 Favored 'General case' 0 CA--C 1.553 1.065 0 C-N-CA 123.189 0.596 . . . . 0.0 110.844 -174.668 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 70.8 mt-30 -55.28 -39.29 69.66 Favored 'General case' 0 N--CA 1.479 0.986 0 C-N-CA 124.417 1.087 . . . . 0.0 110.049 167.801 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 3.6 tt -78.88 124.8 84.82 Favored Pre-proline 0 CA--C 1.557 1.221 0 N-CA-C 107.926 -1.139 . . . . 0.0 107.926 173.961 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 40.9 Cg_exo -59.49 -178.54 0.16 Allowed 'Trans proline' 0 C--N 1.379 2.167 0 C-N-CA 123.475 2.783 . . . . 0.0 113.98 171.36 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 52.0 mtmt -106.16 -20.15 13.49 Favored 'General case' 0 N--CA 1.473 0.697 0 CA-C-N 115.901 -0.591 . . . . 0.0 110.808 178.686 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 18.9 ptpt -62.08 -47.21 85.66 Favored 'General case' 0 N--CA 1.474 0.769 0 C-N-CA 123.726 0.811 . . . . 0.0 112.089 -174.764 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 43' ' ' ASP . . . . . 0.525 ' HA ' ' HE2' ' A' ' 46' ' ' LYS . 9.4 p-10 -73.86 -27.95 61.34 Favored 'General case' 0 N--CA 1.472 0.625 0 CA-C-N 116.07 -0.514 . . . . 0.0 111.907 -174.256 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 32.6 mt -68.66 -56.08 13.58 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.944 0 N-CA-C 109.735 -0.469 . . . . 0.0 109.735 175.88 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 79.9 mt -54.77 -38.47 43.96 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.544 0 C-N-CA 123.558 0.743 . . . . 0.0 110.654 175.812 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 46' ' ' LYS . . . . . 0.525 ' HE2' ' HA ' ' A' ' 43' ' ' ASP . 38.6 ttpt -62.63 -45.56 92.28 Favored 'General case' 0 N--CA 1.48 1.054 0 C-N-CA 124.092 0.957 . . . . 0.0 111.721 179.602 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 47' ' ' PHE . . . . . 0.465 ' HE2' ' HZ ' ' A' ' 86' ' ' PHE . 24.3 t80 -66.72 -44.51 81.39 Favored 'General case' 0 N--CA 1.476 0.852 0 CA-C-N 115.719 -0.673 . . . . 0.0 111.295 179.808 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 83.6 mt -71.04 -30.3 66.45 Favored 'General case' 0 CA--C 1.539 0.526 0 CA-C-N 115.516 -0.765 . . . . 0.0 111.2 -175.435 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 49' ' ' GLN . . . . . 0.498 ' HA ' HD21 ' A' ' 57' ' ' LEU . 2.9 pt20 -81.44 -26.76 35.05 Favored 'General case' 0 N--CA 1.479 1.014 0 O-C-N 123.245 0.34 . . . . 0.0 110.764 175.638 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 10.8 tp10 -62.29 -43.4 98.92 Favored 'General case' 0 N--CA 1.477 0.878 0 C-N-CA 123.611 0.764 . . . . 0.0 110.95 179.196 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 0.7 OUTLIER -107.66 -36.17 6.51 Favored 'General case' 0 N--CA 1.476 0.836 0 CA-C-N 115.94 -0.573 . . . . 0.0 111.682 -171.167 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 52' ' ' GLY . . . . . 0.557 ' HA2' ' HA ' ' A' ' 91' ' ' PHE . . . -61.85 143.62 48.71 Favored Glycine 0 C--N 1.353 1.508 0 N-CA-C 114.431 0.532 . . . . 0.0 114.431 -177.757 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 53' ' ' SER . . . . . 0.403 ' O ' ' HG ' ' A' ' 57' ' ' LEU . 92.4 p -78.74 174.7 11.17 Favored 'General case' 0 N--CA 1.485 1.321 0 C-N-CA 123.908 0.883 . . . . 0.0 111.217 -179.081 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 6.8 m-20 -57.24 -44.44 83.85 Favored 'General case' 0 N--CA 1.491 1.585 0 C-N-CA 123.494 0.718 . . . . 0.0 110.95 179.815 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 39.5 t -63.48 -32.68 74.19 Favored 'General case' 0 CA--C 1.548 0.896 0 CA-C-N 115.13 -0.941 . . . . 0.0 111.579 -179.119 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 56' ' ' PHE . . . . . 0.401 ' HB2' ' HB3' ' A' ' 90' ' ' ARG . 54.7 t80 -74.27 -48.88 25.78 Favored 'General case' 0 N--CA 1.477 0.887 0 CA-C-O 120.864 0.364 . . . . 0.0 110.53 175.741 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 57' ' ' LEU . . . . . 0.498 HD21 ' HA ' ' A' ' 49' ' ' GLN . 37.2 mt -70.11 -36.64 74.99 Favored 'General case' 0 N--CA 1.478 0.941 0 CA-C-N 115.427 -0.806 . . . . 0.0 112.398 -169.296 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -71.03 -49.83 40.71 Favored 'General case' 0 N--CA 1.474 0.729 0 C-N-CA 122.919 0.488 . . . . 0.0 111.106 -179.717 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 39.2 mm-40 -69.25 -20.69 63.94 Favored 'General case' 0 N--CA 1.478 0.97 0 N-CA-C 112.745 0.646 . . . . 0.0 112.745 -179.164 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 62.8 m80 -108.77 -3.2 17.95 Favored 'General case' 0 N--CA 1.483 1.213 0 C-N-CA 123.1 0.56 . . . . 0.0 111.459 176.791 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 50.5 mtmt 59.46 28.36 17.72 Favored 'General case' 0 N--CA 1.495 1.79 0 C-N-CA 124.369 1.068 . . . . 0.0 112.732 174.5 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 0.508 HD11 ' HB1' ' A' ' 81' ' ' ALA . 87.3 mt -88.98 -7.46 55.96 Favored 'General case' 0 N--CA 1.486 1.364 0 C-N-CA 123.776 0.831 . . . . 0.0 112.373 -174.232 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 2.2 pp -78.3 176.72 9.04 Favored 'General case' 0 N--CA 1.479 0.985 0 C-N-CA 123.029 0.532 . . . . 0.0 110.952 177.135 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 78.32 -162.13 49.29 Favored Glycine 0 CA--C 1.526 0.724 0 CA-C-N 115.685 -0.689 . . . . 0.0 113.505 176.816 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 65' ' ' ASN . . . . . 0.414 HD22 ' N ' ' A' ' 65' ' ' ASN . 0.8 OUTLIER -64.6 113.38 3.68 Favored 'General case' 0 N--CA 1.477 0.921 0 C-N-CA 123.524 0.73 . . . . 0.0 109.185 -179.621 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 82.4 mt -54.6 -47.45 72.28 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.947 0 O-C-N 124.123 0.89 . . . . 0.0 111.775 -173.77 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -65.68 -30.29 70.96 Favored 'General case' 0 N--CA 1.483 1.186 0 N-CA-C 111.999 0.37 . . . . 0.0 111.999 -177.494 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 68' ' ' ASN . . . . . 0.493 ' O ' ' HG2' ' A' ' 71' ' ' LYS . 60.0 t30 -73.57 -34.58 65.19 Favored 'General case' 0 N--CA 1.483 1.188 0 C-N-CA 123.356 0.662 . . . . 0.0 110.268 178.141 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 67.1 t -72.94 -34.13 45.3 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.875 0 CA-C-N 115.536 -0.756 . . . . 0.0 110.082 172.247 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -75.75 1.86 13.67 Favored 'General case' 0 N--CA 1.484 1.242 0 C-N-CA 124.112 0.965 . . . . 0.0 112.953 -175.481 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 71' ' ' LYS . . . . . 0.493 ' HG2' ' O ' ' A' ' 68' ' ' ASN . 18.0 ptpt -94.7 -17.92 21.78 Favored 'General case' 0 N--CA 1.482 1.166 0 CA-C-N 118.186 0.448 . . . . 0.0 110.666 172.891 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 14.1 t -129.09 -12.98 4.58 Favored 'General case' 0 CA--C 1.547 0.84 0 C-N-CA 123.356 0.662 . . . . 0.0 111.861 -169.707 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -99.87 98.29 9.09 Favored 'General case' 0 N--CA 1.472 0.645 0 N-CA-C 107.999 -1.111 . . . . 0.0 107.999 174.863 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 26.6 p-10 -71.33 169.69 14.72 Favored 'General case' 0 N--CA 1.48 1.039 0 O-C-N 123.331 0.395 . . . . 0.0 110.388 -178.546 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 75' ' ' LYS . . . . . 0.48 ' O ' HG23 ' A' ' 79' ' ' VAL . 3.4 tppp? -61.46 -40.47 94.62 Favored 'General case' 0 CA--C 1.545 0.755 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.911 -175.81 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 23.2 m-20 -58.13 -41.11 82.97 Favored 'General case' 0 N--CA 1.486 1.374 0 C-N-CA 123.485 0.714 . . . . 0.0 111.473 -179.977 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 75.3 t60 -61.44 -40.45 94.52 Favored 'General case' 0 N--CA 1.479 0.993 0 C-N-CA 124.047 0.939 . . . . 0.0 110.827 175.72 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 58.3 mt -75.77 -28.44 58.44 Favored 'General case' 0 N--CA 1.48 1.034 0 C-N-CA 123.234 0.614 . . . . 0.0 112.54 -176.037 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 79' ' ' VAL . . . . . 0.48 HG23 ' O ' ' A' ' 75' ' ' LYS . 61.5 t -67.54 -48.27 77.47 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.704 0 N-CA-C 108.703 -0.851 . . . . 0.0 108.703 172.76 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 53.7 m -60.56 -39.96 89.9 Favored 'General case' 0 CA--C 1.542 0.659 0 CA-C-N 114.828 -1.078 . . . . 0.0 111.124 177.453 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 81' ' ' ALA . . . . . 0.508 ' HB1' HD11 ' A' ' 62' ' ' LEU . . . -70.12 -42.72 72.26 Favored 'General case' 0 CA--C 1.542 0.637 0 C-N-CA 123.049 0.54 . . . . 0.0 111.588 -178.9 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 82' ' ' TYR . . . . . 0.554 ' CD2' HD11 ' A' ' 34' ' ' LEU . 90.2 t80 -62.89 -55.89 22.1 Favored 'General case' 0 N--CA 1.479 0.995 0 C-N-CA 123.982 0.913 . . . . 0.0 110.797 -179.067 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 83' ' ' ASN . . . . . . . . . . . . . 60.8 m-80 -65.1 -46.98 78.83 Favored 'General case' 0 N--CA 1.48 1.041 0 C-N-CA 122.714 0.406 . . . . 0.0 111.589 -175.846 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 26.3 m-70 -67.04 -23.99 65.95 Favored 'General case' 0 N--CA 1.482 1.16 0 C-N-CA 123.511 0.724 . . . . 0.0 112.086 -179.121 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 21.1 tp -59.11 -54.44 47.02 Favored 'General case' 0 N--CA 1.483 1.182 0 CA-C-O 121.205 0.526 . . . . 0.0 110.553 177.5 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 86' ' ' PHE . . . . . 0.465 ' HZ ' ' HE2' ' A' ' 47' ' ' PHE . 6.3 m-85 -75.36 -29.75 60.01 Favored 'General case' 0 N--CA 1.471 0.586 0 CA-C-N 114.242 -1.344 . . . . 0.0 110.874 -176.1 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 22.8 tt0 -54.78 -40.31 69.3 Favored 'General case' 0 N--CA 1.481 1.12 0 C-N-CA 124.732 1.213 . . . . 0.0 111.105 176.378 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 40.7 p -111.62 -7.3 14.28 Favored 'General case' 0 CA--C 1.544 0.719 0 C-N-CA 124.279 1.031 . . . . 0.0 111.381 -176.634 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 8.5 mtpm? 52.84 43.26 31.74 Favored 'General case' 0 N--CA 1.481 1.11 0 C-N-CA 124.778 1.231 . . . . 0.0 111.91 -177.812 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 90' ' ' ARG . . . . . 0.401 ' HB3' ' HB2' ' A' ' 56' ' ' PHE . 94.1 mtt180 -69.59 -9.01 52.29 Favored 'General case' 0 N--CA 1.49 1.528 0 C-N-CA 123.746 0.818 . . . . 0.0 113.004 179.845 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 91' ' ' PHE . . . . . 0.557 ' HA ' ' HA2' ' A' ' 52' ' ' GLY . 21.1 p90 -65.95 133.94 51.91 Favored 'General case' 0 CA--C 1.546 0.79 0 CA-C-O 120.973 0.416 . . . . 0.0 111.492 174.084 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 61.3 tttp . . . . . 0 C--O 1.252 1.216 0 CA-C-N 115.322 -0.853 . . . . 0.0 108.854 173.599 . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 20' ' ' MET . . . . . . . . . . . . . 55.2 tpp . . . . . 0 N--CA 1.478 0.937 0 N-CA-C 109.459 -0.571 . . . . 0.0 109.459 . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -80.77 93.91 6.31 Favored 'General case' 0 C--O 1.236 0.39 0 N-CA-C 107.772 -1.195 . . . . 0.0 107.772 170.817 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -92.35 15.35 14.07 Favored 'General case' 0 N--CA 1.476 0.875 0 C-N-CA 124.197 0.999 . . . . 0.0 112.066 -174.695 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -83.32 59.19 4.89 Favored 'General case' 0 N--CA 1.48 1.057 0 CA-C-O 121.703 0.763 . . . . 0.0 109.776 176.533 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 35.5 m -82.16 131.83 55.18 Favored Pre-proline 0 CA--C 1.546 0.803 0 CA-C-N 115.039 -0.982 . . . . 0.0 109.799 -176.289 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 25' ' ' PRO . . . . . 0.414 ' HB2' ' HE1' ' A' ' 86' ' ' PHE . 73.5 Cg_endo -74.64 97.28 1.04 Allowed 'Trans proline' 0 C--N 1.37 1.7 0 C-N-CA 122.408 2.072 . . . . 0.0 112.32 -179.772 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 89.4 mt-30 -75.6 88.66 2.73 Favored 'General case' 0 C--O 1.238 0.451 0 N-CA-C 106.415 -1.698 . . . . 0.0 106.415 169.913 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 27' ' ' ARG . . . . . 0.508 ' HB2' ' OH ' ' A' ' 82' ' ' TYR . 0.0 OUTLIER -55.76 126.34 25.13 Favored 'General case' 0 C--N 1.353 0.758 0 O-C-N 124.115 0.885 . . . . 0.0 110.918 -172.261 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -91.39 -34.96 14.66 Favored 'General case' 0 N--CA 1.469 0.525 0 CA-C-N 115.099 -0.955 . . . . 0.0 111.436 -169.222 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 29' ' ' TRP . . . . . . . . . . . . . 4.4 m-90 -115.17 149.86 36.98 Favored 'General case' 0 N--CA 1.469 0.48 0 CA-C-N 115.51 -0.768 . . . . 0.0 111.433 -169.443 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 80.8 p -90.74 168.98 11.35 Favored 'General case' 0 CA--C 1.54 0.574 0 CA-C-N 115.275 -0.875 . . . . 0.0 109.223 172.512 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 31' ' ' VAL . . . . . 0.585 ' HA ' HD12 ' A' ' 34' ' ' LEU . 2.6 p -52.17 -41.66 33.8 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.416 0 C-N-CA 123.737 0.815 . . . . 0.0 112.633 -177.214 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 12.7 pt-20 -73.77 -36.44 65.09 Favored 'General case' 0 N--CA 1.478 0.961 0 C-N-CA 124.135 0.974 . . . . 0.0 112.111 -178.398 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 52.7 mt-30 -61.1 -38.58 86.82 Favored 'General case' 0 N--CA 1.49 1.538 0 C-N-CA 122.705 0.402 . . . . 0.0 110.101 175.267 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.585 HD12 ' HA ' ' A' ' 31' ' ' VAL . 36.1 mt -63.03 -41.32 99.5 Favored 'General case' 0 N--CA 1.473 0.699 0 CA-C-N 115.466 -0.788 . . . . 0.0 110.626 178.266 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 32.5 mtp180 -70.44 -30.31 67.13 Favored 'General case' 0 N--CA 1.478 0.939 0 C-N-CA 123.352 0.661 . . . . 0.0 111.518 -179.636 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 34.0 t -66.13 114.07 4.98 Favored 'General case' 0 N--CA 1.473 0.715 0 C-N-CA 123.308 0.643 . . . . 0.0 110.41 -179.949 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 41.0 mt-10 -73.32 -10.98 60.32 Favored 'General case' 0 CA--C 1.55 0.951 0 C-N-CA 123.454 0.702 . . . . 0.0 112.297 -176.642 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 79.1 mm-40 -55.57 -37.81 68.51 Favored 'General case' 0 N--CA 1.488 1.428 0 C-N-CA 123.695 0.798 . . . . 0.0 109.703 166.257 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 4.8 tt -78.44 128.87 76.42 Favored Pre-proline 0 CA--C 1.553 1.065 0 N-CA-C 107.329 -1.36 . . . . 0.0 107.329 170.746 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 47.5 Cg_exo -60.2 172.55 2.41 Favored 'Trans proline' 0 C--N 1.373 1.844 0 C-N-CA 123.259 2.639 . . . . 0.0 114.63 176.464 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 55.9 mtmt -93.36 -32.17 14.37 Favored 'General case' 0 N--CA 1.475 0.786 0 C-N-CA 123.662 0.785 . . . . 0.0 110.706 173.213 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 21.3 ptmt -63.83 -41.39 97.85 Favored 'General case' 0 CA--C 1.545 0.761 0 C-N-CA 123.911 0.884 . . . . 0.0 112.475 -172.801 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 30.4 p-10 -71.2 -32.37 68.76 Favored 'General case' 0 N--CA 1.481 1.103 0 C-N-CA 123.142 0.577 . . . . 0.0 111.912 -175.753 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 33.5 mt -68.85 -48.87 68.39 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.198 0 N-CA-C 109.982 -0.377 . . . . 0.0 109.982 176.079 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 79.6 mt -60.71 -39.97 83.34 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.364 0 C-N-CA 123.102 0.561 . . . . 0.0 110.938 178.005 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 84.7 tttt -62.76 -44.21 96.79 Favored 'General case' 0 CA--C 1.544 0.735 0 CA-C-N 115.436 -0.802 . . . . 0.0 110.784 177.788 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 1.0 OUTLIER -57.94 -52.08 66.99 Favored 'General case' 0 N--CA 1.484 1.256 0 O-C-N 124.248 0.967 . . . . 0.0 109.324 177.518 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 48' ' ' LEU . . . . . 0.492 HD21 ' HA ' ' A' ' 82' ' ' TYR . 96.3 mt -67.4 -31.6 71.92 Favored 'General case' 0 N--CA 1.471 0.612 0 CA-C-N 114.906 -1.043 . . . . 0.0 113.052 -174.732 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 49' ' ' GLN . . . . . 0.551 ' HA ' HD21 ' A' ' 57' ' ' LEU . 3.4 pt20 -84.18 -27.4 28.08 Favored 'General case' 0 N--CA 1.482 1.162 0 CA-C-N 117.886 0.312 . . . . 0.0 111.359 178.483 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 40.3 tt0 -75.19 -36.83 61.4 Favored 'General case' 0 N--CA 1.474 0.754 0 C-N-CA 123.387 0.675 . . . . 0.0 111.346 179.611 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 69.1 m80 -107.87 -35.46 6.64 Favored 'General case' 0 N--CA 1.476 0.855 0 CA-C-N 115.562 -0.745 . . . . 0.0 112.06 -173.163 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -66.67 172.89 27.4 Favored Glycine 0 CA--C 1.528 0.883 0 CA-C-N 117.691 0.223 . . . . 0.0 113.346 176.314 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 53' ' ' SER . . . . . 0.458 ' O ' ' HG ' ' A' ' 57' ' ' LEU . 64.0 p -94.32 161.42 14.25 Favored 'General case' 0 N--CA 1.48 1.033 0 C-N-CA 123.154 0.582 . . . . 0.0 109.825 176.514 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 5.1 p-10 -63.26 -34.27 77.31 Favored 'General case' 0 N--CA 1.485 1.283 0 C-N-CA 122.897 0.479 . . . . 0.0 111.757 -176.384 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 23.1 t -67.86 -39.6 83.75 Favored 'General case' 0 N--CA 1.481 1.076 0 C-N-CA 123.619 0.768 . . . . 0.0 110.44 177.821 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 47.7 t80 -59.78 -37.66 79.68 Favored 'General case' 0 N--CA 1.483 1.208 0 C-N-CA 124.191 0.996 . . . . 0.0 110.161 172.972 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 57' ' ' LEU . . . . . 0.551 HD21 ' HA ' ' A' ' 49' ' ' GLN . 49.0 mt -74.9 -39.01 61.71 Favored 'General case' 0 C--O 1.216 -0.684 0 CA-C-N 115.836 -0.62 . . . . 0.0 112.012 -177.911 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -66.89 -46.74 73.97 Favored 'General case' 0 N--CA 1.481 1.086 0 CA-C-O 121.344 0.592 . . . . 0.0 110.435 -178.444 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 43.4 mt-10 -66.2 -26.11 67.24 Favored 'General case' 0 CA--C 1.55 0.954 0 CA-C-N 114.939 -1.028 . . . . 0.0 112.264 178.942 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 33.1 m80 -116.7 9.18 13.96 Favored 'General case' 0 N--CA 1.493 1.691 0 N-CA-C 112.888 0.699 . . . . 0.0 112.888 -178.862 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 34.1 mmtp 57.81 26.57 13.34 Favored 'General case' 0 N--CA 1.498 1.934 0 C-N-CA 124.224 1.01 . . . . 0.0 113.34 173.11 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 0.425 HD11 ' HB1' ' A' ' 81' ' ' ALA . 73.1 mt -87.36 -9.67 54.19 Favored 'General case' 0 N--CA 1.485 1.303 0 C-N-CA 123.72 0.808 . . . . 0.0 112.187 -176.379 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 1.8 pp -80.13 165.85 22.06 Favored 'General case' 0 N--CA 1.479 0.99 0 C-N-CA 122.725 0.41 . . . . 0.0 111.002 175.923 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 92.9 -162.32 26.25 Favored Glycine 0 C--N 1.339 0.729 0 CA-C-N 115.307 -0.861 . . . . 0.0 111.891 -178.877 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 65' ' ' ASN . . . . . 0.446 ' O ' HG23 ' A' ' 69' ' ' VAL . 28.6 t-20 -69.77 122.25 18.83 Favored 'General case' 0 N--CA 1.467 0.401 0 N-CA-C 109.564 -0.532 . . . . 0.0 109.564 -178.921 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 62.6 mt -60.57 -44.6 97.07 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.376 0 C-N-CA 124.19 0.996 . . . . 0.0 111.305 -169.904 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 41.1 mtpt -57.31 -43.07 82.95 Favored 'General case' 0 CA--C 1.548 0.899 0 C-N-CA 124.495 1.118 . . . . 0.0 111.118 177.201 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 68' ' ' ASN . . . . . 0.452 ' O ' ' HG2' ' A' ' 71' ' ' LYS . 5.9 t30 -72.87 -29.86 63.52 Favored 'General case' 0 CA--C 1.55 0.964 0 CA-C-N 115.31 -0.859 . . . . 0.0 111.09 -178.857 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 69' ' ' VAL . . . . . 0.446 HG23 ' O ' ' A' ' 65' ' ' ASN . 57.7 t -72.11 -39.1 64.98 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.058 0 N-CA-C 109.798 -0.445 . . . . 0.0 109.798 173.527 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -71.18 -8.38 53.14 Favored 'General case' 0 N--CA 1.479 1.011 0 C-N-CA 124.145 0.978 . . . . 0.0 112.903 -175.272 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 71' ' ' LYS . . . . . 0.452 ' HG2' ' O ' ' A' ' 68' ' ' ASN . 53.1 pttt -88.38 -19.93 25.97 Favored 'General case' 0 N--CA 1.481 1.089 0 CA-C-N 117.872 0.305 . . . . 0.0 110.51 177.781 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 10.3 t -128.85 -13.76 4.6 Favored 'General case' 0 N--CA 1.478 0.932 0 C-N-CA 123.587 0.755 . . . . 0.0 111.862 -167.716 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -103.81 100.99 10.8 Favored 'General case' 0 N--CA 1.469 0.508 0 N-CA-C 107.514 -1.291 . . . . 0.0 107.514 175.336 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 25.6 p-10 -71.04 174.2 6.56 Favored 'General case' 0 N--CA 1.478 0.965 0 C-N-CA 122.884 0.474 . . . . 0.0 111.113 -173.249 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 75' ' ' LYS . . . . . 0.477 ' O ' HG23 ' A' ' 79' ' ' VAL . 9.2 tptm -64.57 -38.09 89.8 Favored 'General case' 0 CA--C 1.545 0.778 0 C-N-CA 122.598 0.359 . . . . 0.0 110.846 -173.274 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 28.5 m-20 -64.32 -35.8 82.05 Favored 'General case' 0 N--CA 1.48 1.039 0 C-N-CA 123.508 0.723 . . . . 0.0 111.237 178.849 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 77' ' ' HIS . . . . . 0.4 ' HD2' HD23 ' A' ' 78' ' ' LEU . 18.8 t60 -60.62 -42.32 96.63 Favored 'General case' 0 N--CA 1.482 1.15 0 C-N-CA 124.159 0.984 . . . . 0.0 110.503 176.538 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 78' ' ' LEU . . . . . 0.4 HD23 ' HD2' ' A' ' 77' ' ' HIS . 42.2 mt -68.34 -37.31 80.39 Favored 'General case' 0 N--CA 1.473 0.716 0 CA-C-N 115.159 -0.928 . . . . 0.0 111.528 -175.528 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 79' ' ' VAL . . . . . 0.553 ' HA ' HD13 ' A' ' 34' ' ' LEU . 47.2 t -62.89 -49.12 84.9 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.751 0 C-N-CA 124.025 0.93 . . . . 0.0 110.008 175.495 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 70.7 m -60.81 -46.27 91.17 Favored 'General case' 0 CA--C 1.545 0.761 0 CA-C-N 114.293 -1.321 . . . . 0.0 111.681 -179.045 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 81' ' ' ALA . . . . . 0.425 ' HB1' HD11 ' A' ' 62' ' ' LEU . . . -68.84 -43.32 75.73 Favored 'General case' 0 N--CA 1.478 0.975 0 C-N-CA 123.516 0.727 . . . . 0.0 111.443 -177.639 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 82' ' ' TYR . . . . . 0.578 ' CD2' HD11 ' A' ' 34' ' ' LEU . 86.5 t80 -58.64 -55.31 36.77 Favored 'General case' 0 N--CA 1.476 0.853 0 C-N-CA 124.276 1.03 . . . . 0.0 110.408 -179.334 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 83' ' ' ASN . . . . . . . . . . . . . 93.0 m-20 -64.9 -34.7 79.02 Favored 'General case' 0 N--CA 1.477 0.879 0 C-N-CA 123.43 0.692 . . . . 0.0 111.545 -175.992 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 24.5 m170 -72.29 -26.81 62.12 Favored 'General case' 0 N--CA 1.487 1.419 0 C-N-CA 123.225 0.61 . . . . 0.0 112.354 176.965 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 85' ' ' LEU . . . . . 0.5 ' HG ' ' HD2' ' A' ' 91' ' ' PHE . 43.5 tp -57.1 -53.09 61.99 Favored 'General case' 0 N--CA 1.485 1.31 0 CA-C-O 121.935 0.874 . . . . 0.0 110.768 178.223 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 86' ' ' PHE . . . . . 0.425 ' HA ' ' HE2' ' A' ' 91' ' ' PHE . 31.7 m-85 -74.2 -32.23 62.95 Favored 'General case' 0 CA--C 1.54 0.587 0 CA-C-N 113.532 -1.667 . . . . 0.0 110.974 -177.916 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 34.2 tt0 -61.26 -44.86 96.55 Favored 'General case' 0 N--CA 1.48 1.055 0 C-N-CA 123.928 0.891 . . . . 0.0 111.847 -176.2 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 37.4 p -109.59 6.67 24.12 Favored 'General case' 0 CA--C 1.544 0.743 0 C-N-CA 123.644 0.778 . . . . 0.0 111.418 -176.004 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 13.4 mmmm 57.14 35.09 25.82 Favored 'General case' 0 N--CA 1.492 1.629 0 C-N-CA 124.471 1.108 . . . . 0.0 111.504 173.644 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 47.2 mtt-85 -65.74 -24.02 66.86 Favored 'General case' 0 N--CA 1.491 1.624 0 N-CA-C 113.518 0.933 . . . . 0.0 113.518 -172.146 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 91' ' ' PHE . . . . . 0.5 ' HD2' ' HG ' ' A' ' 85' ' ' LEU . 5.5 p90 -57.51 161.56 3.44 Favored 'General case' 0 CA--C 1.551 0.996 0 N-CA-C 114.351 1.241 . . . . 0.0 114.351 -172.946 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 16.3 ptmt . . . . . 0 CA--C 1.562 1.413 0 C-N-CA 126.101 1.76 . . . . 0.0 113.573 -171.198 . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 20' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.481 1.123 0 CA-C-O 120.988 0.423 . . . . 0.0 110.5 . . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -151.34 91.04 1.63 Allowed 'General case' 0 C--O 1.235 0.341 0 N-CA-C 108.121 -1.066 . . . . 0.0 108.121 174.543 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -71.63 83.07 0.85 Allowed 'General case' 0 N--CA 1.474 0.743 0 C-N-CA 123.341 0.656 . . . . 0.0 110.819 -176.406 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -88.29 83.42 6.91 Favored 'General case' 0 C--O 1.238 0.46 0 C-N-CA 124.063 0.945 . . . . 0.0 108.836 178.689 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 24' ' ' VAL . . . . . 0.419 ' HB ' ' CD2' ' A' ' 91' ' ' PHE . 23.7 m -68.28 134.52 91.23 Favored Pre-proline 0 CA--C 1.548 0.898 0 CA-C-N 115.695 -0.684 . . . . 0.0 110.071 -176.582 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 46.0 Cg_exo -58.74 102.11 0.14 Allowed 'Trans proline' 0 C--N 1.383 2.361 0 C-N-CA 122.739 2.292 . . . . 0.0 112.179 178.372 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 30.0 pt20 -64.68 167.86 6.81 Favored 'General case' 0 C--O 1.24 0.582 0 CA-C-N 114.725 -1.125 . . . . 0.0 110.167 178.03 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -53.53 125.34 17.72 Favored 'General case' 0 CA--C 1.547 0.847 0 CA-C-O 121.391 0.615 . . . . 0.0 111.135 175.865 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -82.0 -29.72 31.94 Favored 'General case' 0 N--CA 1.473 0.695 0 CA-C-N 115.193 -0.912 . . . . 0.0 108.787 176.439 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 29' ' ' TRP . . . . . . . . . . . . . 4.8 m-90 -134.63 146.51 49.63 Favored 'General case' 0 N--CA 1.464 0.274 0 CA-C-N 114.065 -1.425 . . . . 0.0 108.95 -177.28 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 22.7 p -86.59 175.35 8.36 Favored 'General case' 0 N--CA 1.472 0.641 0 N-CA-C 108.967 -0.753 . . . . 0.0 108.967 170.375 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 31' ' ' VAL . . . . . 0.482 ' HA ' HD12 ' A' ' 34' ' ' LEU . 14.8 p -62.21 -31.92 53.07 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.214 0 C-N-CA 122.693 0.397 . . . . 0.0 111.319 -176.157 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 12.5 pt-20 -70.99 -38.78 72.71 Favored 'General case' 0 N--CA 1.48 1.063 0 C-N-CA 124.003 0.921 . . . . 0.0 111.79 176.681 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 53.1 mt-30 -69.11 -38.15 78.76 Favored 'General case' 0 N--CA 1.477 0.92 0 C-N-CA 122.921 0.488 . . . . 0.0 110.554 176.171 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.482 HD12 ' HA ' ' A' ' 31' ' ' VAL . 87.3 mt -63.48 -50.93 67.75 Favored 'General case' 0 N--CA 1.48 1.062 0 C-N-CA 123.482 0.713 . . . . 0.0 111.171 -178.719 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 35' ' ' ARG . . . . . 0.445 HH21 HG22 ' A' ' 31' ' ' VAL . 18.6 ptp180 -69.89 -12.93 61.99 Favored 'General case' 0 CA--C 1.553 1.067 0 O-C-N 124.18 0.925 . . . . 0.0 111.474 -175.97 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 35.7 t -63.23 118.27 7.73 Favored 'General case' 0 N--CA 1.472 0.635 0 C-N-CA 123.387 0.675 . . . . 0.0 109.219 173.721 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 14.1 pt-20 -64.4 -30.21 71.25 Favored 'General case' 0 CA--C 1.548 0.879 0 C-N-CA 123.376 0.67 . . . . 0.0 111.725 -176.893 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 77.6 mt-30 -66.91 -19.06 65.66 Favored 'General case' 0 N--CA 1.484 1.252 0 C-N-CA 123.652 0.781 . . . . 0.0 111.584 179.942 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 1.8 tt -79.12 116.4 59.91 Favored Pre-proline 0 CA--C 1.551 1.008 0 N-CA-C 106.429 -1.693 . . . . 0.0 106.429 170.795 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 19.2 Cg_endo -58.57 119.97 7.55 Favored 'Trans proline' 0 C--N 1.378 2.085 0 C-N-CA 122.722 2.281 . . . . 0.0 111.62 177.011 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 41' ' ' LYS . . . . . 0.412 ' HE3' ' HB1' ' A' ' 70' ' ' ALA . 58.2 pttt -56.65 -30.48 63.4 Favored 'General case' 0 N--CA 1.48 1.068 0 C-N-CA 125.039 1.335 . . . . 0.0 112.67 -177.987 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 42' ' ' LYS . . . . . 0.433 ' HA ' HD12 ' A' ' 45' ' ' ILE . 22.5 pttp -71.41 -31.96 67.84 Favored 'General case' 0 CA--C 1.545 0.755 0 C-N-CA 123.408 0.683 . . . . 0.0 110.796 -179.486 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -73.28 -25.94 60.88 Favored 'General case' 0 N--CA 1.478 0.926 0 C-N-CA 123.028 0.531 . . . . 0.0 110.814 177.624 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 59.9 mt -67.68 -51.18 53.66 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.93 0 N-CA-C 109.294 -0.632 . . . . 0.0 109.294 171.649 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 45' ' ' ILE . . . . . 0.433 HD12 ' HA ' ' A' ' 42' ' ' LYS . 62.8 mt -54.25 -41.84 53.97 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.694 0 C-N-CA 123.827 0.851 . . . . 0.0 110.41 175.911 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 37.1 ttpt -63.45 -41.65 98.65 Favored 'General case' 0 CA--C 1.543 0.68 0 C-N-CA 124.625 1.17 . . . . 0.0 111.419 -178.089 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 27.4 t80 -66.02 -47.63 73.8 Favored 'General case' 0 N--CA 1.479 0.999 0 CA-C-N 115.794 -0.639 . . . . 0.0 111.015 178.116 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 84.9 mt -70.41 -29.83 66.55 Favored 'General case' 0 N--CA 1.471 0.61 0 C-N-CA 123.883 0.873 . . . . 0.0 111.947 -174.287 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 2.9 pt20 -79.57 -26.61 41.31 Favored 'General case' 0 N--CA 1.484 1.248 0 O-C-N 123.13 0.269 . . . . 0.0 110.482 175.163 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 43.5 tt0 -66.14 -26.98 67.69 Favored 'General case' 0 N--CA 1.482 1.153 0 C-N-CA 123.697 0.799 . . . . 0.0 112.003 -177.332 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 51' ' ' HIS . . . . . 0.471 ' NE2' HD13 ' A' ' 85' ' ' LEU . 47.7 p-80 -126.62 -17.01 5.14 Favored 'General case' 0 N--CA 1.486 1.334 0 N-CA-C 112.952 0.723 . . . . 0.0 112.952 -179.645 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -73.19 142.99 32.45 Favored Glycine 0 N--CA 1.472 1.052 0 CA-C-N 118.132 0.424 . . . . 0.0 112.593 176.247 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 53' ' ' SER . . . . . 0.441 ' O ' ' HG ' ' A' ' 57' ' ' LEU . 32.7 t -76.1 155.18 34.96 Favored 'General case' 0 N--CA 1.48 1.039 0 C-N-CA 123.142 0.577 . . . . 0.0 110.26 177.052 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 22.1 m-20 -63.73 -31.83 73.12 Favored 'General case' 0 N--CA 1.492 1.634 0 C-N-CA 123.204 0.602 . . . . 0.0 112.493 -170.473 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 28.9 t -70.05 -28.26 65.31 Favored 'General case' 0 N--CA 1.474 0.76 0 C-N-CA 123.179 0.592 . . . . 0.0 110.869 179.575 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 82.1 t80 -74.92 -48.97 21.86 Favored 'General case' 0 CA--C 1.545 0.759 0 N-CA-C 109.589 -0.523 . . . . 0.0 109.589 170.102 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 57' ' ' LEU . . . . . 0.441 ' HG ' ' O ' ' A' ' 53' ' ' SER . 79.0 mt -60.07 -46.62 88.96 Favored 'General case' 0 C--O 1.213 -0.839 0 CA-C-N 115.144 -0.934 . . . . 0.0 111.867 -169.965 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -64.63 -44.8 89.35 Favored 'General case' 0 N--CA 1.481 1.105 0 C-N-CA 123.729 0.811 . . . . 0.0 111.704 -177.361 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 19.1 mm-40 -62.03 -21.66 65.08 Favored 'General case' 0 N--CA 1.483 1.204 0 C-N-CA 123.186 0.595 . . . . 0.0 112.192 177.39 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 21.3 m80 -113.95 1.15 14.62 Favored 'General case' 0 N--CA 1.488 1.448 0 C-N-CA 123.611 0.764 . . . . 0.0 111.098 179.083 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 38.4 mtmm 56.99 25.68 10.96 Favored 'General case' 0 N--CA 1.483 1.202 0 C-N-CA 125.47 1.508 . . . . 0.0 113.706 -179.91 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 0.45 HD11 ' HB1' ' A' ' 81' ' ' ALA . 90.0 mt -76.09 -14.77 60.18 Favored 'General case' 0 N--CA 1.477 0.886 0 C-N-CA 123.006 0.523 . . . . 0.0 112.344 -178.597 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 2.0 pp -86.08 174.99 8.8 Favored 'General case' 0 N--CA 1.479 1.013 0 CA-C-O 121.018 0.437 . . . . 0.0 110.946 176.109 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 84.53 -163.35 38.76 Favored Glycine 0 C--N 1.344 0.994 0 CA-C-N 115.481 -0.781 . . . . 0.0 112.384 179.473 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 30.4 m-80 -61.92 110.2 1.48 Allowed 'General case' 0 C--N 1.354 0.767 0 N-CA-C 109.139 -0.689 . . . . 0.0 109.139 176.491 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 66' ' ' ILE . . . . . 0.417 HG22 ' HB2' ' A' ' 42' ' ' LYS . 75.0 mt -61.02 -38.91 80.56 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.702 0 O-C-N 124.119 0.887 . . . . 0.0 110.769 -176.42 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 61.9 pttt -59.31 -36.89 76.44 Favored 'General case' 0 CA--C 1.553 1.084 0 C-N-CA 123.503 0.721 . . . . 0.0 111.271 176.483 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 68' ' ' ASN . . . . . 0.411 ' O ' ' HG2' ' A' ' 71' ' ' LYS . 48.3 t-20 -72.22 -44.5 62.83 Favored 'General case' 0 N--CA 1.478 0.97 0 C-N-CA 123.459 0.704 . . . . 0.0 109.726 179.594 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 69' ' ' VAL . . . . . 0.423 HG12 ' HB2' ' A' ' 73' ' ' ALA . 98.0 t -60.58 -39.03 80.09 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.733 0 CA-C-N 115.707 -0.679 . . . . 0.0 110.49 178.457 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 70' ' ' ALA . . . . . 0.435 ' HA ' ' HB3' ' A' ' 73' ' ' ALA . . . -63.29 -17.25 62.32 Favored 'General case' 0 N--CA 1.478 0.967 0 C-N-CA 124.416 1.086 . . . . 0.0 113.282 -175.215 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 71' ' ' LYS . . . . . 0.411 ' HG2' ' O ' ' A' ' 68' ' ' ASN . 16.1 ptpt -75.61 -22.27 57.02 Favored 'General case' 0 N--CA 1.489 1.521 0 CA-C-N 118.49 0.586 . . . . 0.0 110.91 -178.754 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 13.5 t -122.12 -12.31 8.33 Favored 'General case' 0 CA--C 1.543 0.703 0 C-N-CA 124.169 0.987 . . . . 0.0 110.607 -179.135 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 73' ' ' ALA . . . . . 0.526 ' HB1' HD21 ' A' ' 78' ' ' LEU . . . -77.49 86.19 3.85 Favored 'General case' 0 C--N 1.349 0.552 0 CA-C-O 121.461 0.648 . . . . 0.0 109.67 179.673 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 3.4 p30 -73.12 150.36 42.29 Favored 'General case' 0 C--O 1.24 0.58 0 CA-C-N 114.507 -1.224 . . . . 0.0 108.548 174.838 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 2.1 ttmp? -68.96 -26.66 65.16 Favored 'General case' 0 CA--C 1.544 0.72 0 C-N-CA 123.4 0.68 . . . . 0.0 111.482 -167.125 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 28.4 t70 -62.95 -43.24 99.33 Favored 'General case' 0 N--CA 1.478 0.959 0 C-N-CA 123.555 0.742 . . . . 0.0 110.604 173.868 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 61.0 t60 -61.95 -42.39 99.05 Favored 'General case' 0 N--CA 1.482 1.165 0 C-N-CA 124.404 1.082 . . . . 0.0 110.664 175.857 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 78' ' ' LEU . . . . . 0.526 HD21 ' HB1' ' A' ' 73' ' ' ALA . 96.3 mt -65.1 -38.64 91.37 Favored 'General case' 0 N--CA 1.481 1.083 0 C-N-CA 123.571 0.748 . . . . 0.0 112.196 -175.392 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 98.2 t -69.24 -40.33 80.21 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.942 0 CA-C-N 115.606 -0.724 . . . . 0.0 110.503 176.085 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 57.2 m -62.21 -41.47 98.41 Favored 'General case' 0 N--CA 1.48 1.048 0 C-N-CA 123.273 0.629 . . . . 0.0 111.118 177.31 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 81' ' ' ALA . . . . . 0.45 ' HB1' HD11 ' A' ' 62' ' ' LEU . . . -68.74 -42.19 77.92 Favored 'General case' 0 CA--C 1.543 0.699 0 C-N-CA 123.436 0.694 . . . . 0.0 110.659 178.492 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 82' ' ' TYR . . . . . . . . . . . . . 7.5 t80 -52.08 -55.55 20.02 Favored 'General case' 0 N--CA 1.475 0.802 0 C-N-CA 124.434 1.094 . . . . 0.0 110.542 175.61 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 83' ' ' ASN . . . . . . . . . . . . . 28.9 m-80 -64.37 -45.71 86.54 Favored 'General case' 0 N--CA 1.482 1.153 0 C-N-CA 123.31 0.644 . . . . 0.0 111.594 -175.855 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 23.9 m-70 -62.01 -25.37 67.6 Favored 'General case' 0 N--CA 1.481 1.084 0 C-N-CA 123.484 0.714 . . . . 0.0 111.827 -179.541 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 85' ' ' LEU . . . . . 0.471 HD13 ' NE2' ' A' ' 51' ' ' HIS . 2.9 mt -60.85 -52.36 65.38 Favored 'General case' 0 N--CA 1.476 0.857 0 CA-C-O 120.766 0.317 . . . . 0.0 111.126 173.139 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 60.8 m-85 -72.97 -30.68 64.02 Favored 'General case' 0 CA--C 1.553 1.083 0 CA-C-N 115.475 -0.784 . . . . 0.0 111.092 -176.837 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 37.4 tt0 -48.36 -48.55 36.43 Favored 'General case' 0 N--CA 1.491 1.597 0 C-N-CA 126.055 1.742 . . . . 0.0 113.83 -173.532 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 27.3 p -120.62 -4.04 9.79 Favored 'General case' 0 CA--C 1.538 0.492 0 C-N-CA 124.342 1.057 . . . . 0.0 109.99 -178.71 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 32.1 mtmm 62.23 69.88 0.6 Allowed 'General case' 0 C--N 1.357 0.922 0 C-N-CA 124.402 1.081 . . . . 0.0 109.783 -173.843 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 44.6 mtt85 -86.01 15.02 5.36 Favored 'General case' 0 N--CA 1.489 1.524 0 C-N-CA 125.244 1.417 . . . . 0.0 111.837 175.816 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 91' ' ' PHE . . . . . 0.419 ' CD2' ' HB ' ' A' ' 24' ' ' VAL . 1.8 m-30 -56.67 160.11 3.51 Favored 'General case' 0 N--CA 1.477 0.901 0 C-N-CA 124.646 1.178 . . . . 0.0 111.331 171.356 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 92' ' ' LYS . . . . . 0.437 ' HE3' ' HA ' ' A' ' 53' ' ' SER . 40.7 ttmt . . . . . 0 C--O 1.249 1.058 0 N-CA-C 108.106 -1.072 . . . . 0.0 108.106 -179.617 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.541 0.612 0 CA-C-O 121.6 0.714 . . . . 0.0 111.056 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -76.24 -37.39 57.74 Favored 'General case' 0 N--CA 1.472 0.627 0 CA-C-N 114.53 -1.214 . . . . 0.0 109.919 -176.859 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 29' ' ' TRP . . . . . . . . . . . . . 2.5 m-90 -120.94 148.13 44.5 Favored 'General case' 0 N--CA 1.471 0.6 0 CA-C-N 114.932 -1.031 . . . . 0.0 109.1 -177.279 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 76.3 p -87.18 175.33 8.11 Favored 'General case' 0 CA--C 1.54 0.596 0 C-N-CA 123.073 0.549 . . . . 0.0 110.006 176.167 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . 0.436 HG12 ' HE ' ' A' ' 35' ' ' ARG . 51.8 t -55.87 -46.26 80.07 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.052 0 C-N-CA 123.687 0.795 . . . . 0.0 111.484 -178.732 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 12.7 pt-20 -66.94 -41.51 86.87 Favored 'General case' 0 N--CA 1.475 0.782 0 C-N-CA 123.335 0.654 . . . . 0.0 111.403 -179.245 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 55.3 mt-30 -60.17 -36.52 77.76 Favored 'General case' 0 N--CA 1.479 0.995 0 C-N-CA 123.196 0.598 . . . . 0.0 110.974 178.329 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 85.0 mt -70.19 -51.43 31.1 Favored 'General case' 0 N--CA 1.469 0.497 0 C-N-CA 122.74 0.416 . . . . 0.0 110.427 178.864 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 35' ' ' ARG . . . . . 0.436 ' HE ' HG12 ' A' ' 31' ' ' VAL . 50.5 mtm180 -57.27 -28.45 62.99 Favored 'General case' 0 N--CA 1.484 1.251 0 C-N-CA 123.913 0.885 . . . . 0.0 111.755 -179.371 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 44.6 t -53.93 122.19 9.56 Favored 'General case' 0 CA--C 1.541 0.619 0 C-N-CA 124.262 1.025 . . . . 0.0 110.941 174.848 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 10.9 pt-20 -71.14 -8.82 56.07 Favored 'General case' 0 CA--C 1.549 0.939 0 C-N-CA 123.973 0.909 . . . . 0.0 111.482 179.038 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 95.7 mt-30 -65.89 -47.92 73.2 Favored 'General case' 0 N--CA 1.472 0.667 0 C-N-CA 123.914 0.886 . . . . 0.0 109.712 168.753 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 3.8 tt -76.89 116.92 61.25 Favored Pre-proline 0 CA--C 1.553 1.085 0 N-CA-C 108.126 -1.065 . . . . 0.0 108.126 179.509 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 32.4 Cg_exo -61.63 165.45 13.58 Favored 'Trans proline' 0 C--N 1.38 2.187 0 C-N-CA 123.479 2.786 . . . . 0.0 114.126 176.763 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 36.6 mtmm -81.54 -25.94 35.48 Favored 'General case' 0 N--CA 1.475 0.82 0 CA-C-N 115.722 -0.672 . . . . 0.0 111.004 179.536 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 18.5 ptpt -64.77 -48.11 75.68 Favored 'General case' 0 CA--C 1.547 0.865 0 C-N-CA 123.524 0.73 . . . . 0.0 112.797 -171.394 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 13.6 p-10 -73.28 -23.65 60.33 Favored 'General case' 0 N--CA 1.478 0.936 0 C-N-CA 122.666 0.386 . . . . 0.0 111.852 -176.794 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 54.2 mt -66.89 -52.69 41.76 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.084 0 C-N-CA 123.071 0.549 . . . . 0.0 110.1 171.496 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 80.3 mt -60.13 -34.73 57.92 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.17 0 C-N-CA 123.132 0.573 . . . . 0.0 110.416 177.545 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 2.7 tmtp? -59.77 -50.29 74.41 Favored 'General case' 0 N--CA 1.474 0.761 0 C-N-CA 123.714 0.806 . . . . 0.0 109.075 175.498 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 24.0 t80 -58.77 -45.16 90.39 Favored 'General case' 0 N--CA 1.485 1.319 0 C-N-CA 124.035 0.934 . . . . 0.0 111.627 179.978 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . 0.486 ' HB3' ' HE2' ' A' ' 56' ' ' PHE . 92.4 mt -72.01 -32.3 67.05 Favored 'General case' 0 CA--C 1.545 0.782 0 CA-C-N 115.277 -0.874 . . . . 0.0 111.816 -175.879 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . 0.559 ' HA ' HD21 ' A' ' 57' ' ' LEU . 3.0 pt20 -85.53 -23.86 27.52 Favored 'General case' 0 N--CA 1.491 1.594 0 C-N-CA 122.724 0.41 . . . . 0.0 112.013 175.051 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 8.5 tp10 -58.36 -39.04 78.47 Favored 'General case' 0 N--CA 1.482 1.165 0 C-N-CA 124.458 1.103 . . . . 0.0 111.24 -179.759 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 2.0 m80 -132.59 -30.23 1.47 Allowed 'General case' 0 N--CA 1.479 0.98 0 CA-C-O 119.034 -0.508 . . . . 0.0 112.169 -175.004 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -59.31 120.16 21.41 Favored Glycine 0 N--CA 1.478 1.434 0 CA-C-O 119.489 -0.617 . . . . 0.0 111.949 175.758 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 22.8 t -70.97 176.44 4.35 Favored 'General case' 0 N--CA 1.484 1.246 0 C-N-CA 123.607 0.763 . . . . 0.0 112.17 -171.251 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 5.6 p-10 -58.57 -36.49 74.02 Favored 'General case' 0 N--CA 1.48 1.056 0 C-N-CA 124.292 1.037 . . . . 0.0 113.429 -168.16 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 27.8 t -69.38 -40.7 77.26 Favored 'General case' 0 N--CA 1.476 0.827 0 C-N-CA 122.839 0.456 . . . . 0.0 110.096 -178.998 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 56' ' ' PHE . . . . . 0.64 ' HB2' ' HB3' ' A' ' 90' ' ' ARG . 65.7 t80 -59.69 -49.29 78.33 Favored 'General case' 0 N--CA 1.477 0.906 0 CA-C-O 121.378 0.609 . . . . 0.0 110.368 175.454 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . 0.559 HD21 ' HA ' ' A' ' 49' ' ' GLN . 68.7 mt -67.71 -31.78 71.96 Favored 'General case' 0 C--O 1.221 -0.424 0 CA-C-N 114.626 -1.17 . . . . 0.0 112.082 -176.128 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -73.68 -49.97 23.2 Favored 'General case' 0 N--CA 1.478 0.943 0 C-N-CA 122.798 0.439 . . . . 0.0 111.647 179.345 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 43.6 mt-10 -67.17 -36.59 82.12 Favored 'General case' 0 N--CA 1.485 1.301 0 C-N-CA 123.58 0.752 . . . . 0.0 111.612 -177.782 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 42.6 m-70 -98.77 -4.96 32.22 Favored 'General case' 0 N--CA 1.478 0.972 0 C-N-CA 123.122 0.569 . . . . 0.0 111.892 -177.85 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 62.9 mttp 58.56 41.35 22.54 Favored 'General case' 0 N--CA 1.496 1.849 0 C-N-CA 124.482 1.113 . . . . 0.0 112.641 175.736 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 85.1 mt -102.73 0.94 33.72 Favored 'General case' 0 N--CA 1.479 1.0 0 C-N-CA 123.592 0.757 . . . . 0.0 111.487 -178.749 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . 0.433 ' HB3' ' HB3' ' A' ' 57' ' ' LEU . 1.1 pp -77.07 160.73 28.85 Favored 'General case' 0 N--CA 1.483 1.206 0 C-N-CA 122.95 0.5 . . . . 0.0 111.369 174.651 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 89.28 -158.67 27.99 Favored Glycine 0 C--N 1.338 0.666 0 CA-C-N 115.167 -0.924 . . . . 0.0 112.942 173.79 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 36.8 m-80 -61.91 118.3 7.05 Favored 'General case' 0 CA--C 1.539 0.541 0 C-N-CA 123.573 0.749 . . . . 0.0 110.423 179.957 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 84.4 mt -50.05 -51.89 15.7 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.117 0 C-N-CA 124.136 0.975 . . . . 0.0 111.398 -177.617 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 67' ' ' LYS . . . . . 0.44 ' HD3' ' H ' ' A' ' 67' ' ' LYS . 0.0 OUTLIER -61.76 -38.55 88.44 Favored 'General case' 0 CA--C 1.552 1.047 0 C-N-CA 123.47 0.708 . . . . 0.0 112.148 -178.399 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 23.9 t-20 -61.54 -38.34 87.06 Favored 'General case' 0 N--CA 1.485 1.311 0 C-N-CA 123.411 0.684 . . . . 0.0 110.777 175.841 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 99.2 t -73.5 -39.72 54.75 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.786 0 CA-C-N 115.183 -0.917 . . . . 0.0 110.355 175.141 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -69.35 -26.71 64.82 Favored 'General case' 0 N--CA 1.484 1.232 0 C-N-CA 124.388 1.075 . . . . 0.0 112.589 -171.902 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 22.1 ptmt -76.82 -17.13 59.2 Favored 'General case' 0 N--CA 1.477 0.91 0 C-N-CA 122.425 0.29 . . . . 0.0 111.523 -179.94 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 9.1 t -120.98 2.29 10.46 Favored 'General case' 0 CA--C 1.55 0.966 0 C-N-CA 123.94 0.896 . . . . 0.0 110.452 177.801 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . 0.423 ' HB1' HD21 ' A' ' 78' ' ' LEU . . . -91.95 121.16 33.28 Favored 'General case' 0 N--CA 1.47 0.55 0 C-N-CA 123.148 0.579 . . . . 0.0 109.932 175.063 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 12.5 p-10 -93.42 145.92 24.13 Favored 'General case' 0 N--CA 1.473 0.678 0 N-CA-C 108.493 -0.929 . . . . 0.0 108.493 168.829 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 4.6 tppp? -59.64 -42.3 92.45 Favored 'General case' 0 N--CA 1.477 0.88 0 C-N-CA 123.842 0.857 . . . . 0.0 112.143 -169.839 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 6.2 p-10 -64.5 -32.45 74.08 Favored 'General case' 0 N--CA 1.477 0.893 0 C-N-CA 123.265 0.626 . . . . 0.0 111.833 -177.102 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 47.5 t60 -68.37 -34.91 76.91 Favored 'General case' 0 N--CA 1.487 1.376 0 C-N-CA 123.484 0.713 . . . . 0.0 110.465 174.046 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . 0.423 HD21 ' HB1' ' A' ' 73' ' ' ALA . 84.4 mt -70.23 -35.33 73.79 Favored 'General case' 0 N--CA 1.479 0.977 0 C-N-CA 122.892 0.477 . . . . 0.0 111.465 -179.174 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 53.4 t -71.71 -37.95 64.54 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.788 0 O-C-N 124.084 0.865 . . . . 0.0 110.045 176.748 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 63.6 m -61.49 -47.17 86.87 Favored 'General case' 0 CA--C 1.545 0.756 0 CA-C-N 115.625 -0.716 . . . . 0.0 110.265 173.216 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -63.48 -41.63 98.58 Favored 'General case' 0 N--CA 1.476 0.825 0 C-N-CA 123.606 0.762 . . . . 0.0 110.951 -179.608 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 82' ' ' TYR . . . . . . . . . . . . . 7.8 t80 -55.77 -55.49 31.72 Favored 'General case' 0 CA--C 1.543 0.711 0 C-N-CA 124.954 1.302 . . . . 0.0 111.11 175.964 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 83' ' ' ASN . . . . . . . . . . . . . 70.7 m-20 -65.17 -41.09 94.98 Favored 'General case' 0 N--CA 1.486 1.36 0 C-N-CA 123.302 0.641 . . . . 0.0 111.683 -175.924 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 22.2 m-70 -68.79 -25.58 64.77 Favored 'General case' 0 N--CA 1.479 0.979 0 C-N-CA 123.878 0.871 . . . . 0.0 111.567 178.171 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 85' ' ' LEU . . . . . 0.519 ' HG ' ' HD2' ' A' ' 91' ' ' PHE . 51.2 tp -57.57 -53.95 52.42 Favored 'General case' 0 N--CA 1.487 1.405 0 CA-C-O 121.831 0.824 . . . . 0.0 111.069 178.872 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 43.4 m-85 -73.11 -30.9 63.97 Favored 'General case' 0 CA--C 1.538 0.506 0 CA-C-N 113.787 -1.551 . . . . 0.0 110.889 -177.174 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 44.9 tt0 -66.51 -30.33 70.62 Favored 'General case' 0 CA--C 1.548 0.871 0 C-N-CA 124.141 0.976 . . . . 0.0 111.774 -176.221 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 11.6 p -116.98 2.58 12.74 Favored 'General case' 0 N--CA 1.48 1.071 0 C-N-CA 123.421 0.688 . . . . 0.0 111.618 179.153 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 27.2 mtpp 58.21 30.97 20.2 Favored 'General case' 0 N--CA 1.485 1.285 0 C-N-CA 123.92 0.888 . . . . 0.0 111.815 177.461 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 90' ' ' ARG . . . . . 0.64 ' HB3' ' HB2' ' A' ' 56' ' ' PHE . 53.2 mtt85 -62.8 -12.36 23.88 Favored 'General case' 0 N--CA 1.489 1.513 0 C-N-CA 124.14 0.976 . . . . 0.0 113.095 -175.748 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 91' ' ' PHE . . . . . 0.519 ' HD2' ' HG ' ' A' ' 85' ' ' LEU . 6.9 p90 -77.15 161.66 28.05 Favored 'General case' 0 CA--C 1.542 0.644 0 C-N-CA 123.462 0.705 . . . . 0.0 112.046 174.997 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 19.4 ptmt . . . . . 0 CA--C 1.557 1.218 0 N-CA-C 108.127 -1.064 . . . . 0.0 108.127 169.047 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 38.0 ttp180 . . . . . 0 CA--C 1.537 0.473 0 N-CA-C 109.279 -0.638 . . . . 0.0 109.279 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -93.83 -15.95 24.58 Favored 'General case' 0 N--CA 1.47 0.53 0 CA-C-N 114.485 -1.234 . . . . 0.0 110.847 -174.898 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 29' ' ' TRP . . . . . . . . . . . . . 4.1 m0 -130.57 132.31 45.48 Favored 'General case' 0 N--CA 1.466 0.357 0 C-N-CA 123.791 0.836 . . . . 0.0 108.9 -174.062 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 64.7 p -80.4 174.1 11.94 Favored 'General case' 0 C--O 1.245 0.844 0 N-CA-C 108.912 -0.773 . . . . 0.0 108.912 167.927 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . 0.433 ' HA ' HD12 ' A' ' 34' ' ' LEU . 13.5 p -57.35 -35.38 48.97 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.262 0 C-N-CA 122.565 0.346 . . . . 0.0 111.38 -174.724 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 14.8 pt-20 -73.73 -37.75 65.0 Favored 'General case' 0 CA--C 1.551 0.99 0 C-N-CA 123.963 0.905 . . . . 0.0 111.635 178.879 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 33' ' ' GLN . . . . . 0.413 ' O ' HD13 ' A' ' 39' ' ' LEU . 15.4 mm100 -67.49 -33.49 75.22 Favored 'General case' 0 N--CA 1.479 1.014 0 C-N-CA 123.311 0.644 . . . . 0.0 110.666 179.998 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.509 HD11 ' CD2' ' A' ' 82' ' ' TYR . 83.2 mt -59.02 -48.83 80.16 Favored 'General case' 0 N--CA 1.473 0.721 0 N-CA-C 109.256 -0.646 . . . . 0.0 109.256 171.738 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 29.6 mtp180 -68.09 -12.93 61.74 Favored 'General case' 0 N--CA 1.487 1.422 0 CA-C-N 114.638 -1.164 . . . . 0.0 113.221 -176.949 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 46.1 t -56.85 117.64 4.14 Favored 'General case' 0 N--CA 1.48 1.032 0 C-N-CA 123.67 0.788 . . . . 0.0 109.929 176.784 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 12.4 pt-20 -65.58 -33.93 77.06 Favored 'General case' 0 N--CA 1.48 1.044 0 C-N-CA 123.427 0.691 . . . . 0.0 112.06 -172.248 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 18.0 mm-40 -74.07 -22.53 59.49 Favored 'General case' 0 N--CA 1.471 0.597 0 C-N-CA 123.309 0.643 . . . . 0.0 111.19 179.65 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . 0.413 HD13 ' O ' ' A' ' 33' ' ' GLN . 5.3 tt -76.2 116.97 60.77 Favored Pre-proline 0 CA--C 1.545 0.781 0 N-CA-C 107.281 -1.377 . . . . 0.0 107.281 171.002 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 17.9 Cg_exo -66.62 136.14 41.4 Favored 'Trans proline' 0 C--N 1.375 1.963 0 C-N-CA 122.831 2.354 . . . . 0.0 111.831 -177.895 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 41' ' ' LYS . . . . . 0.404 ' HB2' ' CD1' ' A' ' 78' ' ' LEU . 16.7 ptpt -64.72 -33.4 75.87 Favored 'General case' 0 CA--C 1.548 0.899 0 C-N-CA 122.963 0.505 . . . . 0.0 110.036 177.365 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 55.0 pttt -71.19 -27.06 63.24 Favored 'General case' 0 N--CA 1.478 0.956 0 C-N-CA 123.946 0.898 . . . . 0.0 111.356 179.912 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 14.9 t70 -63.34 -36.72 84.65 Favored 'General case' 0 CA--C 1.552 1.022 0 C-N-CA 122.97 0.508 . . . . 0.0 109.702 172.561 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 42.8 mt -73.28 -47.17 47.66 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.923 0 C-N-CA 123.902 0.881 . . . . 0.0 110.183 177.818 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 82.7 mt -56.82 -39.53 65.12 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.707 0 C-N-CA 123.553 0.741 . . . . 0.0 110.953 178.973 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 37.8 ttmt -62.96 -44.52 95.84 Favored 'General case' 0 N--CA 1.476 0.865 0 C-N-CA 123.254 0.622 . . . . 0.0 110.679 178.702 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 22.8 t80 -59.34 -46.39 88.74 Favored 'General case' 0 N--CA 1.478 0.951 0 CA-C-N 115.269 -0.878 . . . . 0.0 110.42 177.274 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . 0.407 ' HB3' ' HE2' ' A' ' 56' ' ' PHE . 96.6 mt -72.47 -30.76 64.84 Favored 'General case' 0 CA--C 1.539 0.555 0 CA-C-N 114.625 -1.171 . . . . 0.0 112.212 -175.187 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . 0.542 ' HA ' HD21 ' A' ' 57' ' ' LEU . 3.0 pt20 -84.08 -34.24 24.21 Favored 'General case' 0 N--CA 1.483 1.176 0 CA-C-N 117.895 0.316 . . . . 0.0 111.42 179.796 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 43.0 tt0 -67.89 -39.67 83.63 Favored 'General case' 0 N--CA 1.48 1.056 0 CA-C-O 121.403 0.621 . . . . 0.0 110.569 -179.913 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 76.7 m80 -96.37 -49.8 5.03 Favored 'General case' 0 N--CA 1.469 0.503 0 CA-C-N 114.865 -1.061 . . . . 0.0 111.297 -175.584 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . 0.542 ' HA2' ' HA ' ' A' ' 91' ' ' PHE . . . -60.77 141.31 48.1 Favored Glycine 0 C--N 1.345 1.063 0 O-C-N 123.396 0.435 . . . . 0.0 113.698 178.505 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 16.8 t -88.54 174.03 8.31 Favored 'General case' 0 N--CA 1.479 1.016 0 C-N-CA 122.737 0.415 . . . . 0.0 111.296 -176.842 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 3.2 m-20 -48.29 -45.43 34.78 Favored 'General case' 0 N--CA 1.489 1.477 0 C-N-CA 125.839 1.656 . . . . 0.0 113.831 -170.187 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 42.0 t -66.35 -43.09 87.03 Favored 'General case' 0 N--CA 1.478 0.975 0 C-N-CA 123.402 0.681 . . . . 0.0 110.855 -178.386 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 56' ' ' PHE . . . . . 0.543 ' HB2' ' HB3' ' A' ' 90' ' ' ARG . 85.1 t80 -62.08 -40.2 95.01 Favored 'General case' 0 N--CA 1.48 1.037 0 C-N-CA 123.324 0.65 . . . . 0.0 110.316 176.499 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . 0.542 HD21 ' HA ' ' A' ' 49' ' ' GLN . 32.0 mt -73.01 -35.68 66.86 Favored 'General case' 0 C--O 1.218 -0.591 0 CA-C-N 115.095 -0.957 . . . . 0.0 111.906 -175.532 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -73.54 -49.32 27.07 Favored 'General case' 0 N--CA 1.473 0.69 0 C-N-CA 122.64 0.376 . . . . 0.0 110.785 179.416 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 27.2 mm-40 -55.15 -36.89 66.29 Favored 'General case' 0 N--CA 1.481 1.114 0 C-N-CA 123.756 0.822 . . . . 0.0 112.253 178.586 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 57.9 m80 -108.11 1.5 22.33 Favored 'General case' 0 CA--C 1.55 0.978 0 C-N-CA 123.022 0.529 . . . . 0.0 112.338 -177.117 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 57.4 mtpt 54.93 35.31 24.19 Favored 'General case' 0 N--CA 1.496 1.857 0 C-N-CA 124.405 1.082 . . . . 0.0 112.796 177.375 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . 0.441 ' HA ' HG11 ' A' ' 69' ' ' VAL . 92.3 mt -90.13 -6.62 55.19 Favored 'General case' 0 N--CA 1.482 1.133 0 C-N-CA 123.483 0.713 . . . . 0.0 111.931 -176.319 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . 0.418 ' H ' ' HG ' ' A' ' 63' ' ' LEU . 1.2 pp -73.51 162.65 29.03 Favored 'General case' 0 N--CA 1.481 1.079 0 C-N-CA 123.749 0.82 . . . . 0.0 111.75 179.146 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 81.23 -148.26 28.05 Favored Glycine 0 CA--C 1.528 0.864 0 CA-C-N 115.353 -0.84 . . . . 0.0 113.613 174.614 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -68.0 113.96 6.13 Favored 'General case' 0 N--CA 1.478 0.949 0 C-N-CA 123.269 0.628 . . . . 0.0 109.505 -178.465 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 41.4 mt -55.02 -45.33 76.75 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.874 0 O-C-N 124.822 1.326 . . . . 0.0 110.968 -177.063 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 62.6 pttt -60.71 -37.44 81.69 Favored 'General case' 0 CA--C 1.554 1.114 0 C-N-CA 123.994 0.917 . . . . 0.0 111.93 179.459 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 68' ' ' ASN . . . . . 0.404 ' O ' ' HG2' ' A' ' 71' ' ' LYS . 61.5 t30 -72.75 -36.68 67.75 Favored 'General case' 0 N--CA 1.48 1.056 0 C-N-CA 123.376 0.67 . . . . 0.0 110.456 179.485 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 69' ' ' VAL . . . . . 0.441 HG11 ' HA ' ' A' ' 62' ' ' LEU . 57.8 t -66.25 -36.4 77.31 Favored 'Isoleucine or valine' 0 C--O 1.214 -0.789 0 CA-C-N 115.562 -0.745 . . . . 0.0 109.621 173.017 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -67.52 -15.42 63.65 Favored 'General case' 0 N--CA 1.478 0.962 0 C-N-CA 123.963 0.905 . . . . 0.0 113.349 -174.317 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . 0.404 ' HG2' ' O ' ' A' ' 68' ' ' ASN . 21.2 ptmt -94.65 -19.99 19.95 Favored 'General case' 0 N--CA 1.481 1.077 0 O-C-N 121.617 -0.677 . . . . 0.0 111.872 177.691 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 9.0 t -112.84 -15.07 12.99 Favored 'General case' 0 N--CA 1.484 1.23 0 C-N-CA 123.155 0.582 . . . . 0.0 111.716 -176.574 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -110.91 101.56 10.13 Favored 'General case' 0 C--O 1.24 0.56 0 C-N-CA 124.139 0.976 . . . . 0.0 108.41 178.892 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 26.1 p-10 -72.06 160.76 31.93 Favored 'General case' 0 CA--C 1.534 0.353 0 CA-C-N 116.242 -0.436 . . . . 0.0 110.277 177.009 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . 0.461 ' HD3' ' O ' ' A' ' 34' ' ' LEU . 36.8 ttmt -63.84 -33.28 75.34 Favored 'General case' 0 CA--C 1.543 0.704 0 C-N-CA 123.549 0.74 . . . . 0.0 111.708 -173.883 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 21.6 t70 -62.81 -33.18 74.69 Favored 'General case' 0 N--CA 1.485 1.321 0 C-N-CA 123.638 0.775 . . . . 0.0 110.857 178.985 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 40.9 t60 -70.63 -36.89 73.7 Favored 'General case' 0 N--CA 1.477 0.912 0 C-N-CA 124.603 1.161 . . . . 0.0 110.468 174.499 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . 0.404 ' CD1' ' HB2' ' A' ' 41' ' ' LYS . 60.8 mt -71.03 -31.24 67.67 Favored 'General case' 0 N--CA 1.483 1.179 0 C-N-CA 123.137 0.575 . . . . 0.0 111.577 -177.561 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 79' ' ' VAL . . . . . 0.42 HG23 ' O ' ' A' ' 75' ' ' LYS . 99.5 t -64.03 -44.27 97.74 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.759 0 O-C-N 123.959 0.787 . . . . 0.0 109.355 173.641 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 24.6 m -61.62 -42.79 99.38 Favored 'General case' 0 N--CA 1.474 0.746 0 CA-C-N 115.16 -0.927 . . . . 0.0 110.982 176.304 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -67.4 -39.97 85.58 Favored 'General case' 0 N--CA 1.473 0.698 0 C-N-CA 123.085 0.554 . . . . 0.0 111.04 178.271 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 82' ' ' TYR . . . . . 0.509 ' CD2' HD11 ' A' ' 34' ' ' LEU . 64.5 t80 -62.96 -56.97 12.46 Favored 'General case' 0 N--CA 1.472 0.658 0 C-N-CA 124.047 0.939 . . . . 0.0 110.419 -175.363 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 83' ' ' ASN . . . . . . . . . . . . . 27.8 m-80 -62.83 -40.69 98.2 Favored 'General case' 0 N--CA 1.482 1.141 0 C-N-CA 123.293 0.637 . . . . 0.0 111.25 -176.129 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 84' ' ' HIS . . . . . 0.409 ' HA ' ' HB3' ' A' ' 87' ' ' GLU . 13.2 m170 -70.08 -25.49 63.55 Favored 'General case' 0 N--CA 1.481 1.114 0 C-N-CA 123.773 0.829 . . . . 0.0 111.954 -179.465 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 85' ' ' LEU . . . . . 0.426 ' HG ' ' HD2' ' A' ' 91' ' ' PHE . 57.7 tp -56.71 -54.22 48.68 Favored 'General case' 0 N--CA 1.486 1.359 0 CA-C-O 121.912 0.863 . . . . 0.0 110.763 178.809 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 20.1 m-85 -73.88 -32.06 63.43 Favored 'General case' 0 CA--C 1.554 1.114 0 CA-C-N 113.483 -1.689 . . . . 0.0 110.16 -178.605 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 87' ' ' GLU . . . . . 0.409 ' HB3' ' HA ' ' A' ' 84' ' ' HIS . 9.7 tp10 -68.85 -23.33 64.23 Favored 'General case' 0 N--CA 1.485 1.292 0 C-N-CA 124.718 1.207 . . . . 0.0 112.285 -174.352 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 19.9 p -128.39 5.24 5.71 Favored 'General case' 0 N--CA 1.487 1.415 0 C-N-CA 123.289 0.636 . . . . 0.0 111.867 179.694 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 14.3 mmmm 60.6 29.71 19.21 Favored 'General case' 0 N--CA 1.487 1.408 0 C-N-CA 124.109 0.964 . . . . 0.0 111.869 175.665 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 90' ' ' ARG . . . . . 0.543 ' HB3' ' HB2' ' A' ' 56' ' ' PHE . 52.2 mtt85 -66.81 -11.19 54.42 Favored 'General case' 0 N--CA 1.496 1.838 0 N-CA-C 114.403 1.26 . . . . 0.0 114.403 -171.079 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 91' ' ' PHE . . . . . 0.542 ' HA ' ' HA2' ' A' ' 52' ' ' GLY . 16.6 p90 -67.74 138.44 56.24 Favored 'General case' 0 CA--C 1.54 0.573 0 N-CA-C 112.484 0.55 . . . . 0.0 112.484 176.852 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 3.8 tmtp? . . . . . 0 CA--C 1.552 1.048 0 C-N-CA 125.153 1.381 . . . . 0.0 109.639 -178.796 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.473 0.69 0 CA-C-O 122.002 0.906 . . . . 0.0 111.592 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -84.36 -21.25 30.96 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 114.28 -1.327 . . . . 0.0 110.118 -178.691 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 29' ' ' TRP . . . . . . . . . . . . . 4.5 m-90 -140.94 147.6 39.06 Favored 'General case' 0 N--CA 1.476 0.833 0 C-N-CA 124.439 1.096 . . . . 0.0 109.614 -176.297 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 36.3 p -83.02 174.29 11.01 Favored 'General case' 0 N--CA 1.476 0.857 0 N-CA-C 109.629 -0.508 . . . . 0.0 109.629 169.098 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . 0.584 HG13 HG11 ' A' ' 79' ' ' VAL . 45.5 t -52.26 -45.52 43.85 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.022 0 C-N-CA 123.821 0.848 . . . . 0.0 111.743 179.781 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -66.31 -42.81 87.75 Favored 'General case' 0 N--CA 1.48 1.059 0 C-N-CA 123.238 0.615 . . . . 0.0 111.395 179.051 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 15.7 mm-40 -64.7 -29.07 70.06 Favored 'General case' 0 N--CA 1.482 1.146 0 C-N-CA 123.253 0.621 . . . . 0.0 110.94 179.883 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.449 ' HA ' HD23 ' A' ' 39' ' ' LEU . 79.0 mt -69.53 -53.67 17.9 Favored 'General case' 0 N--CA 1.469 0.522 0 C-N-CA 123.129 0.572 . . . . 0.0 109.772 172.984 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 35' ' ' ARG . . . . . 0.406 ' HG3' ' O ' ' A' ' 31' ' ' VAL . 83.0 mtp180 -65.05 -15.15 62.02 Favored 'General case' 0 N--CA 1.485 1.321 0 C-N-CA 123.937 0.895 . . . . 0.0 112.125 -173.706 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 47.8 t -59.72 117.65 5.21 Favored 'General case' 0 CA--C 1.54 0.587 0 N-CA-C 109.29 -0.633 . . . . 0.0 109.29 169.61 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 11.5 pt-20 -65.65 -16.29 63.59 Favored 'General case' 0 N--CA 1.477 0.884 0 C-N-CA 124.3 1.04 . . . . 0.0 111.893 178.954 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 12.7 mm100 -68.64 -25.68 64.95 Favored 'General case' 0 CA--C 1.545 0.753 0 C-N-CA 123.945 0.898 . . . . 0.0 110.639 173.822 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . 0.449 HD23 ' HA ' ' A' ' 34' ' ' LEU . 26.0 tp -88.65 117.77 68.67 Favored Pre-proline 0 CA--C 1.545 0.755 0 N-CA-C 108.252 -1.018 . . . . 0.0 108.252 171.082 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 34.6 Cg_exo -62.08 143.35 94.73 Favored 'Trans proline' 0 C--N 1.374 1.892 0 C-N-CA 122.776 2.318 . . . . 0.0 112.571 177.522 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 54.3 mtmt -60.61 -36.65 79.1 Favored 'General case' 0 N--CA 1.471 0.613 0 CA-C-N 115.538 -0.756 . . . . 0.0 110.693 174.915 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 61.5 pttt -65.51 -33.98 77.19 Favored 'General case' 0 N--CA 1.473 0.698 0 C-N-CA 123.34 0.656 . . . . 0.0 111.152 178.878 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 27.9 t0 -69.1 -31.63 70.48 Favored 'General case' 0 N--CA 1.476 0.868 0 CA-C-O 121.288 0.566 . . . . 0.0 110.696 -178.775 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 53.7 mt -73.59 -47.12 46.09 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.736 0 CA-C-N 115.667 -0.697 . . . . 0.0 110.351 176.125 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 73.5 mt -59.95 -35.24 59.62 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.184 0 C-N-CA 123.507 0.723 . . . . 0.0 110.498 177.225 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 88.0 tttt -60.27 -42.59 95.69 Favored 'General case' 0 CA--C 1.548 0.896 0 C-N-CA 124.308 1.043 . . . . 0.0 110.708 176.822 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 22.3 t80 -67.03 -47.27 71.9 Favored 'General case' 0 CA--C 1.547 0.841 0 CA-C-N 114.1 -1.409 . . . . 0.0 111.231 176.313 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . 0.541 ' HB3' ' HE2' ' A' ' 56' ' ' PHE . 87.4 mt -70.38 -36.95 74.43 Favored 'General case' 0 N--CA 1.473 0.709 0 C-N-CA 124.056 0.942 . . . . 0.0 112.414 -173.921 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 3.1 pt20 -80.56 -32.24 36.69 Favored 'General case' 0 N--CA 1.478 0.959 0 C-N-CA 122.457 0.303 . . . . 0.0 111.059 -175.556 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 44.4 tt0 -59.87 -37.0 78.08 Favored 'General case' 0 N--CA 1.478 0.96 0 C-N-CA 123.278 0.631 . . . . 0.0 111.053 -176.8 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 81.8 m-70 -106.19 -37.13 6.68 Favored 'General case' 0 N--CA 1.476 0.852 0 CA-C-N 115.609 -0.723 . . . . 0.0 111.247 -176.355 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . 0.486 ' HA2' ' HA ' ' A' ' 91' ' ' PHE . . . -60.26 127.31 43.55 Favored Glycine 0 C--N 1.346 1.128 0 O-C-N 123.924 0.765 . . . . 0.0 113.841 -178.349 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 25.7 t -68.28 168.09 13.11 Favored 'General case' 0 CA--C 1.548 0.88 0 C-N-CA 124.274 1.03 . . . . 0.0 110.948 -179.906 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 19.5 m-20 -57.25 -27.79 62.38 Favored 'General case' 0 N--CA 1.486 1.371 0 C-N-CA 124.156 0.983 . . . . 0.0 112.801 -172.877 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 19.6 p -64.57 -50.62 66.52 Favored 'General case' 0 CA--C 1.548 0.878 0 C-N-CA 123.723 0.809 . . . . 0.0 110.925 174.426 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 56' ' ' PHE . . . . . 0.554 ' HB2' ' HB3' ' A' ' 90' ' ' ARG . 58.9 t80 -61.23 -37.22 82.28 Favored 'General case' 0 N--CA 1.482 1.128 0 C-N-CA 123.959 0.904 . . . . 0.0 110.905 178.398 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 84.9 mt -66.41 -41.79 88.74 Favored 'General case' 0 CA--C 1.54 0.578 0 CA-C-N 114.357 -1.292 . . . . 0.0 110.976 176.85 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -71.08 -27.03 63.32 Favored 'General case' 0 N--CA 1.479 1.011 0 C-N-CA 123.894 0.878 . . . . 0.0 112.5 -179.64 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -61.72 -50.24 73.21 Favored 'General case' 0 CA--C 1.547 0.838 0 C-N-CA 123.675 0.79 . . . . 0.0 112.521 -177.467 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 22.4 t-80 -119.07 14.26 13.1 Favored 'General case' 0 N--CA 1.487 1.411 0 N-CA-C 112.568 0.581 . . . . 0.0 112.568 -179.761 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 50.5 mtpt 55.31 49.51 16.9 Favored 'General case' 0 N--CA 1.482 1.175 0 C-N-CA 123.7 0.8 . . . . 0.0 110.962 -172.917 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . 0.446 ' HA ' HG11 ' A' ' 69' ' ' VAL . 86.7 mt -79.69 -6.99 58.3 Favored 'General case' 0 N--CA 1.48 1.05 0 C-N-CA 123.759 0.824 . . . . 0.0 110.76 176.349 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . 0.406 ' HG ' ' H ' ' A' ' 63' ' ' LEU . 1.2 pp -76.12 159.86 30.32 Favored 'General case' 0 N--CA 1.475 0.805 0 C-N-CA 123.945 0.898 . . . . 0.0 110.936 173.225 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 86.14 -160.5 33.56 Favored Glycine 0 C--N 1.343 0.947 0 CA-C-N 115.524 -0.762 . . . . 0.0 113.2 179.212 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 16.5 m120 -63.5 123.56 19.09 Favored 'General case' 0 N--CA 1.474 0.73 0 C-N-CA 123.209 0.604 . . . . 0.0 110.4 179.622 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 53.3 mt -56.49 -46.29 82.24 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.657 0 C-N-CA 124.599 1.16 . . . . 0.0 111.73 -175.006 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 62.7 pttt -58.84 -37.43 76.44 Favored 'General case' 0 CA--C 1.556 1.182 0 C-N-CA 123.855 0.862 . . . . 0.0 111.537 178.516 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 68' ' ' ASN . . . . . 0.4 ' O ' ' HG2' ' A' ' 71' ' ' LYS . 5.9 m-20 -70.42 -31.22 68.32 Favored 'General case' 0 N--CA 1.481 1.088 0 C-N-CA 124.201 1.0 . . . . 0.0 110.62 179.695 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 69' ' ' VAL . . . . . 0.446 HG11 ' HA ' ' A' ' 62' ' ' LEU . 30.7 t -74.28 -37.19 45.09 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.937 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.064 172.289 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -68.3 -21.66 64.77 Favored 'General case' 0 N--CA 1.484 1.256 0 C-N-CA 124.059 0.944 . . . . 0.0 112.765 -174.608 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . 0.4 ' HG2' ' O ' ' A' ' 68' ' ' ASN . 20.9 ptmt -83.0 -18.14 40.9 Favored 'General case' 0 N--CA 1.482 1.163 0 C-N-CA 122.758 0.423 . . . . 0.0 111.442 179.714 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 8.9 t -114.11 -5.67 13.08 Favored 'General case' 0 N--CA 1.478 0.969 0 C-N-CA 123.762 0.825 . . . . 0.0 110.605 179.471 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -95.35 131.7 41.17 Favored 'General case' 0 N--CA 1.47 0.537 0 C-N-CA 123.504 0.722 . . . . 0.0 110.378 177.555 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 30.7 t30 -97.14 145.04 26.4 Favored 'General case' 0 C--O 1.242 0.677 0 N-CA-C 108.169 -1.048 . . . . 0.0 108.169 170.37 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 4.6 tppp? -55.85 -43.94 77.56 Favored 'General case' 0 N--CA 1.474 0.748 0 C-N-CA 124.044 0.938 . . . . 0.0 111.754 -178.693 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 22.3 t70 -57.97 -44.03 86.84 Favored 'General case' 0 N--CA 1.479 0.98 0 C-N-CA 123.758 0.823 . . . . 0.0 111.633 -177.842 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 26.2 t60 -75.38 -26.37 58.41 Favored 'General case' 0 N--CA 1.473 0.702 0 C-N-CA 122.639 0.375 . . . . 0.0 111.085 179.729 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 67.6 mt -68.16 -31.11 70.44 Favored 'General case' 0 N--CA 1.486 1.332 0 CA-C-N 118.225 0.466 . . . . 0.0 111.931 176.026 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 79' ' ' VAL . . . . . 0.584 HG11 HG13 ' A' ' 31' ' ' VAL . 97.0 t -69.65 -39.73 78.55 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.734 0 CA-C-N 115.565 -0.743 . . . . 0.0 109.66 171.169 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 37.4 m -63.37 -40.25 96.74 Favored 'General case' 0 CA--C 1.547 0.848 0 C-N-CA 123.524 0.73 . . . . 0.0 111.204 176.576 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -71.44 -40.64 70.25 Favored 'General case' 0 N--CA 1.476 0.833 0 C-N-CA 123.895 0.878 . . . . 0.0 109.592 178.988 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 82' ' ' TYR . . . . . . . . . . . . . 11.7 t80 -54.49 -54.75 36.84 Favored 'General case' 0 N--CA 1.474 0.731 0 C-N-CA 124.648 1.179 . . . . 0.0 110.762 175.741 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 83' ' ' ASN . . . . . . . . . . . . . 45.1 m-80 -67.46 -40.67 85.36 Favored 'General case' 0 N--CA 1.478 0.933 0 C-N-CA 122.475 0.31 . . . . 0.0 110.997 -176.712 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 38.6 m170 -66.65 -24.62 66.31 Favored 'General case' 0 N--CA 1.483 1.21 0 C-N-CA 123.535 0.734 . . . . 0.0 111.663 178.608 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 85' ' ' LEU . . . . . 0.455 ' HG ' ' HD2' ' A' ' 91' ' ' PHE . 35.4 tp -58.6 -53.83 53.93 Favored 'General case' 0 N--CA 1.482 1.148 0 C-N-CA 123.793 0.837 . . . . 0.0 110.653 177.042 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 36.6 m-85 -74.85 -29.78 61.15 Favored 'General case' 0 N--CA 1.474 0.729 0 CA-C-N 114.593 -1.185 . . . . 0.0 111.428 -178.896 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 40.7 tt0 -58.78 -47.69 83.85 Favored 'General case' 0 N--CA 1.477 0.887 0 C-N-CA 125.013 1.325 . . . . 0.0 112.831 -173.367 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 30.2 p -120.18 8.59 10.94 Favored 'General case' 0 N--CA 1.477 0.91 0 C-N-CA 123.634 0.774 . . . . 0.0 111.271 -178.043 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 96.6 mttt 54.78 61.78 2.82 Favored 'General case' 0 N--CA 1.477 0.915 0 C-N-CA 124.277 1.031 . . . . 0.0 111.072 -177.108 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 90' ' ' ARG . . . . . 0.554 ' HB3' ' HB2' ' A' ' 56' ' ' PHE . 44.5 mtt85 -75.63 -8.53 57.02 Favored 'General case' 0 N--CA 1.476 0.831 0 CA-C-N 114.06 -1.427 . . . . 0.0 111.807 178.403 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 91' ' ' PHE . . . . . 0.486 ' HA ' ' HA2' ' A' ' 52' ' ' GLY . 23.2 p90 -81.49 162.02 23.41 Favored 'General case' 0 N--CA 1.469 0.524 0 C-N-CA 124.164 0.986 . . . . 0.0 111.11 172.131 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 6.5 tmtm? . . . . . 0 C--O 1.253 1.265 0 CA-C-N 115.045 -0.98 . . . . 0.0 109.003 175.016 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 27' ' ' ARG . . . . . 0.665 HH21 HG22 ' A' ' 30' ' ' THR . 15.4 ttt180 . . . . . 0 CA--C 1.549 0.905 0 CA-C-O 121.279 0.561 . . . . 0.0 110.522 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -90.09 -60.01 2.04 Favored 'General case' 0 CA--C 1.549 0.924 0 CA-C-N 114.589 -1.187 . . . . 0.0 109.456 174.852 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 29' ' ' TRP . . . . . . . . . . . . . 3.8 m-90 -89.67 149.54 22.74 Favored 'General case' 0 N--CA 1.474 0.762 0 C-N-CA 124.121 0.969 . . . . 0.0 111.896 -175.672 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 30' ' ' THR . . . . . 0.665 HG22 HH21 ' A' ' 27' ' ' ARG . 66.8 p -82.07 173.67 11.94 Favored 'General case' 0 N--CA 1.471 0.611 0 C-N-CA 123.328 0.651 . . . . 0.0 109.854 168.494 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . 0.532 ' HA ' HD12 ' A' ' 34' ' ' LEU . 69.3 t -58.99 -38.28 72.81 Favored 'Isoleucine or valine' 0 CA--C 1.554 1.1 0 C-N-CA 123.581 0.753 . . . . 0.0 111.381 -179.013 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 11.6 pt-20 -73.49 -36.25 65.75 Favored 'General case' 0 N--CA 1.482 1.158 0 CA-C-N 116.112 -0.494 . . . . 0.0 111.743 178.402 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 99.5 mt-30 -67.13 -28.17 67.92 Favored 'General case' 0 N--CA 1.482 1.134 0 C-N-CA 123.156 0.582 . . . . 0.0 111.33 175.667 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.584 HD13 ' HA ' ' A' ' 79' ' ' VAL . 89.2 mt -68.04 -52.48 34.93 Favored 'General case' 0 N--CA 1.477 0.918 0 C-N-CA 123.355 0.662 . . . . 0.0 110.963 175.463 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 15.5 ptm180 -74.7 -10.92 59.99 Favored 'General case' 0 N--CA 1.485 1.308 0 C-N-CA 123.154 0.582 . . . . 0.0 111.654 -177.606 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 33.3 t -53.7 121.23 7.43 Favored 'General case' 0 N--CA 1.478 0.965 0 C-N-CA 123.619 0.767 . . . . 0.0 110.719 171.302 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 44.1 mt-10 -67.55 -25.82 66.0 Favored 'General case' 0 N--CA 1.477 0.881 0 C-N-CA 124.234 1.014 . . . . 0.0 111.927 -174.634 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 94.8 mt-30 -65.93 -29.45 69.86 Favored 'General case' 0 N--CA 1.479 0.981 0 C-N-CA 123.812 0.845 . . . . 0.0 110.838 177.004 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 44.0 tp -83.05 117.1 67.54 Favored Pre-proline 0 CA--C 1.549 0.905 0 N-CA-C 107.749 -1.204 . . . . 0.0 107.749 170.88 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 15.9 Cg_exo -70.99 163.73 38.21 Favored 'Trans proline' 0 C--N 1.372 1.791 0 C-N-CA 122.844 2.363 . . . . 0.0 113.272 177.864 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 37.1 mtmm -68.24 -42.48 79.66 Favored 'General case' 0 N--CA 1.475 0.775 0 CA-C-N 115.537 -0.756 . . . . 0.0 110.587 175.984 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 55.2 pttt -61.41 -28.95 69.62 Favored 'General case' 0 N--CA 1.48 1.048 0 C-N-CA 123.947 0.899 . . . . 0.0 111.505 -179.216 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 6.5 t70 -70.81 -43.37 68.76 Favored 'General case' 0 CA--C 1.545 0.779 0 C-N-CA 122.598 0.359 . . . . 0.0 110.469 -179.158 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 27.9 mt -72.3 -45.68 60.08 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.122 0 C-N-CA 122.678 0.391 . . . . 0.0 110.388 179.941 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 45' ' ' ILE . . . . . 0.47 HD12 ' HB2' ' A' ' 70' ' ' ALA . 98.2 mt -58.89 -39.54 77.91 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.556 0 C-N-CA 123.366 0.667 . . . . 0.0 110.915 177.757 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 46' ' ' LYS . . . . . 0.414 ' O ' ' HB2' ' A' ' 50' ' ' GLU . 62.6 tttm -62.28 -46.72 87.54 Favored 'General case' 0 N--CA 1.473 0.723 0 C-N-CA 123.057 0.543 . . . . 0.0 110.347 175.887 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 20.5 t80 -58.56 -51.11 71.26 Favored 'General case' 0 N--CA 1.476 0.866 0 O-C-N 124.362 1.039 . . . . 0.0 110.569 -179.752 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . 0.416 HD21 ' CD1' ' A' ' 82' ' ' TYR . 95.3 mt -70.87 -31.33 67.97 Favored 'General case' 0 N--CA 1.468 0.466 0 CA-C-N 115.536 -0.756 . . . . 0.0 112.084 -173.746 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 1.9 pt20 -81.2 -26.35 36.02 Favored 'General case' 0 N--CA 1.481 1.093 0 N-CA-C 110.079 -0.341 . . . . 0.0 110.079 176.871 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . 0.414 ' HB2' ' O ' ' A' ' 46' ' ' LYS . 7.6 tp10 -59.68 -33.57 71.74 Favored 'General case' 0 N--CA 1.474 0.758 0 C-N-CA 123.694 0.798 . . . . 0.0 110.964 -178.057 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 54.8 p-80 -132.09 -20.18 2.48 Favored 'General case' 0 N--CA 1.479 0.983 0 CA-C-O 117.858 -1.068 . . . . 0.0 113.573 -176.29 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . 0.461 ' HA2' ' HA ' ' A' ' 91' ' ' PHE . . . -67.24 144.97 45.39 Favored Glycine 0 N--CA 1.48 1.575 0 CA-C-N 119.447 1.022 . . . . 0.0 112.362 177.876 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 53.7 m -77.73 163.08 26.47 Favored 'General case' 0 N--CA 1.486 1.344 0 CA-C-N 117.546 0.673 . . . . 0.0 111.92 -177.114 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 9.1 m-20 -54.29 -43.41 71.04 Favored 'General case' 0 N--CA 1.485 1.295 0 C-N-CA 124.533 1.133 . . . . 0.0 113.199 -170.42 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 34.5 t -68.21 -40.71 82.04 Favored 'General case' 0 N--CA 1.479 1.019 0 C-N-CA 123.38 0.672 . . . . 0.0 111.223 -176.224 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 89.8 t80 -63.49 -48.08 79.1 Favored 'General case' 0 N--CA 1.478 0.954 0 C-N-CA 123.257 0.623 . . . . 0.0 109.713 177.386 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 63.6 mt -65.02 -32.45 74.18 Favored 'General case' 0 C--O 1.22 -0.487 0 CA-C-N 115.173 -0.921 . . . . 0.0 111.18 -178.205 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -70.17 -48.43 57.32 Favored 'General case' 0 N--CA 1.475 0.82 0 C-N-CA 123.313 0.645 . . . . 0.0 110.813 179.276 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 55.2 mt-10 -61.66 -36.59 81.26 Favored 'General case' 0 N--CA 1.481 1.078 0 C-N-CA 123.23 0.612 . . . . 0.0 111.947 -179.866 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 94.5 m-70 -99.27 -4.05 32.77 Favored 'General case' 0 N--CA 1.481 1.093 0 C-N-CA 122.517 0.327 . . . . 0.0 111.866 -178.444 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 33.8 mmtp 61.18 30.34 19.26 Favored 'General case' 0 N--CA 1.495 1.807 0 C-N-CA 124.177 0.991 . . . . 0.0 112.108 179.747 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 80.4 mt -80.3 -13.49 59.15 Favored 'General case' 0 N--CA 1.482 1.165 0 C-N-CA 124.177 0.991 . . . . 0.0 111.564 179.653 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -74.33 179.78 4.37 Favored 'General case' 0 N--CA 1.485 1.317 0 C-N-CA 123.484 0.713 . . . . 0.0 111.822 177.644 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 76.43 -160.0 50.51 Favored Glycine 0 C--N 1.342 0.891 0 CA-C-N 115.362 -0.835 . . . . 0.0 113.239 175.734 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 13.3 m120 -67.98 113.51 5.74 Favored 'General case' 0 N--CA 1.479 0.992 0 C-N-CA 123.087 0.555 . . . . 0.0 109.928 -178.88 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 44.2 mt -51.99 -53.06 19.62 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.116 0 C-N-CA 125.313 1.445 . . . . 0.0 112.287 -172.159 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 41.8 mtmt -64.25 -38.41 90.94 Favored 'General case' 0 N--CA 1.482 1.14 0 C-N-CA 124.257 1.023 . . . . 0.0 111.428 -175.674 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 50.6 t30 -66.02 -39.86 90.58 Favored 'General case' 0 N--CA 1.481 1.091 0 C-N-CA 124.113 0.965 . . . . 0.0 110.894 178.49 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 69' ' ' VAL . . . . . 0.417 HG12 HD13 ' A' ' 45' ' ' ILE . 97.5 t -67.39 -39.53 82.86 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.878 0 CA-C-N 115.853 -0.612 . . . . 0.0 109.597 174.129 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 70' ' ' ALA . . . . . 0.47 ' HB2' HD12 ' A' ' 45' ' ' ILE . . . -81.77 12.23 4.15 Favored 'General case' 0 N--CA 1.483 1.209 0 C-N-CA 124.216 1.006 . . . . 0.0 111.743 179.568 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 65.4 tttp -94.43 -31.03 14.15 Favored 'General case' 0 CA--C 1.544 0.731 0 C-N-CA 124.148 0.979 . . . . 0.0 110.123 170.985 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 8.8 t -122.28 -19.86 6.35 Favored 'General case' 0 N--CA 1.482 1.167 0 N-CA-C 112.667 0.618 . . . . 0.0 112.667 -170.759 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -77.89 148.41 34.61 Favored 'General case' 0 N--CA 1.477 0.893 0 C-N-CA 122.794 0.438 . . . . 0.0 109.848 176.771 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 9.4 p30 -98.76 163.87 12.45 Favored 'General case' 0 N--CA 1.483 1.203 0 C-N-CA 122.587 0.355 . . . . 0.0 110.4 176.422 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 19.0 tptm -71.59 -39.39 70.58 Favored 'General case' 0 N--CA 1.478 0.953 0 C-N-CA 123.658 0.783 . . . . 0.0 111.357 -172.75 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 25.2 t70 -63.69 -33.08 74.84 Favored 'General case' 0 N--CA 1.483 1.217 0 C-N-CA 124.412 1.085 . . . . 0.0 111.088 -176.435 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 69.5 t60 -58.43 -43.82 88.88 Favored 'General case' 0 N--CA 1.475 0.786 0 C-N-CA 124.891 1.276 . . . . 0.0 110.26 173.416 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 56.7 mt -68.56 -31.53 70.81 Favored 'General case' 0 N--CA 1.476 0.834 0 CA-C-N 115.389 -0.823 . . . . 0.0 112.076 -174.907 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 79' ' ' VAL . . . . . 0.584 ' HA ' HD13 ' A' ' 34' ' ' LEU . 53.7 t -65.1 -48.45 83.77 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.883 0 O-C-N 124.114 0.884 . . . . 0.0 109.775 177.263 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 56.8 m -62.8 -44.52 95.95 Favored 'General case' 0 N--CA 1.474 0.771 0 CA-C-N 115.193 -0.912 . . . . 0.0 111.58 178.309 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -64.39 -48.24 76.17 Favored 'General case' 0 N--CA 1.476 0.838 0 C-N-CA 123.37 0.668 . . . . 0.0 110.557 -179.137 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 82' ' ' TYR . . . . . 0.535 ' CD2' HD11 ' A' ' 34' ' ' LEU . 74.0 t80 -53.59 -57.44 10.74 Favored 'General case' 0 N--CA 1.471 0.59 0 C-N-CA 124.288 1.035 . . . . 0.0 111.136 -178.133 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 83' ' ' ASN . . . . . . . . . . . . . 46.5 m-80 -66.76 -28.25 68.25 Favored 'General case' 0 N--CA 1.478 0.966 0 CA-C-N 115.359 -0.837 . . . . 0.0 111.913 -172.652 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 10.6 m170 -77.47 -28.47 52.31 Favored 'General case' 0 N--CA 1.482 1.129 0 C-N-CA 123.155 0.582 . . . . 0.0 111.927 177.6 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 34.2 tp -59.89 -53.03 62.69 Favored 'General case' 0 N--CA 1.492 1.657 0 CA-C-O 121.571 0.701 . . . . 0.0 111.21 -177.518 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 86' ' ' PHE . . . . . 0.404 ' HA ' ' HE2' ' A' ' 91' ' ' PHE . 34.5 m-85 -73.9 -29.82 62.26 Favored 'General case' 0 N--CA 1.47 0.556 0 CA-C-N 113.993 -1.458 . . . . 0.0 110.743 -176.074 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 13.9 tp10 -69.19 -36.99 77.9 Favored 'General case' 0 N--CA 1.471 0.616 0 C-N-CA 123.532 0.733 . . . . 0.0 110.957 -176.7 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 60.5 p -106.92 0.49 23.87 Favored 'General case' 0 N--CA 1.478 0.935 0 C-N-CA 123.967 0.907 . . . . 0.0 111.683 -177.561 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 74.4 mmtt 61.88 27.15 16.51 Favored 'General case' 0 N--CA 1.489 1.475 0 C-N-CA 124.49 1.116 . . . . 0.0 112.24 174.919 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 54.2 mtt180 -73.46 4.58 4.62 Favored 'General case' 0 N--CA 1.492 1.628 0 N-CA-C 114.056 1.132 . . . . 0.0 114.056 -172.967 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 91' ' ' PHE . . . . . 0.461 ' HA ' ' HA2' ' A' ' 52' ' ' GLY . 5.8 p90 -70.43 141.92 52.05 Favored 'General case' 0 CA--C 1.551 0.995 0 CA-C-O 121.343 0.592 . . . . 0.0 111.783 169.955 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 13.6 tptp . . . . . 0 C--O 1.25 1.097 0 C-N-CA 127.753 2.421 . . . . 0.0 112.688 -176.856 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 27' ' ' ARG . . . . . 0.441 ' HB3' ' CZ ' ' A' ' 86' ' ' PHE . 0.0 OUTLIER . . . . . 0 CA--C 1.537 0.462 0 CA-C-O 121.54 0.686 . . . . 0.0 109.941 . . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -79.05 -35.08 43.14 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 114.605 -1.18 . . . . 0.0 110.613 -174.14 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 29' ' ' TRP . . . . . 0.519 ' HB3' ' HB2' ' A' ' 33' ' ' GLN . 3.2 m-90 -115.0 145.89 41.8 Favored 'General case' 0 N--CA 1.472 0.666 0 CA-C-N 115.16 -0.927 . . . . 0.0 110.57 -172.618 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 49.2 p -93.07 174.58 7.16 Favored 'General case' 0 CA--C 1.544 0.729 0 C-N-CA 123.68 0.792 . . . . 0.0 108.865 168.438 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . 0.515 ' HA ' HD12 ' A' ' 34' ' ' LEU . 7.1 p -58.89 -35.66 57.53 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.277 0 C-N-CA 122.907 0.483 . . . . 0.0 112.19 -174.471 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 9.0 pt-20 -66.07 -42.16 89.77 Favored 'General case' 0 N--CA 1.48 1.051 0 C-N-CA 123.657 0.783 . . . . 0.0 111.262 176.695 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 33' ' ' GLN . . . . . 0.519 ' HB2' ' HB3' ' A' ' 29' ' ' TRP . 12.4 mm100 -63.9 -42.34 97.46 Favored 'General case' 0 N--CA 1.477 0.918 0 C-N-CA 123.021 0.528 . . . . 0.0 110.085 178.209 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.515 HD12 ' HA ' ' A' ' 31' ' ' VAL . 70.2 mt -63.23 -49.57 73.65 Favored 'General case' 0 N--CA 1.472 0.649 0 O-C-N 124.485 1.116 . . . . 0.0 111.17 -176.943 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 11.5 ptp180 -73.07 -16.84 61.47 Favored 'General case' 0 N--CA 1.48 1.052 0 O-C-N 124.046 0.841 . . . . 0.0 111.636 -175.166 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 13.4 t -69.46 122.46 19.04 Favored 'General case' 0 CA--C 1.55 0.965 0 N-CA-C 109.514 -0.55 . . . . 0.0 109.514 -178.825 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . 0.407 ' HA ' ' HE2' ' A' ' 75' ' ' LYS . 60.1 mm-40 -63.65 -22.16 66.76 Favored 'General case' 0 N--CA 1.481 1.094 0 C-N-CA 123.903 0.881 . . . . 0.0 113.017 -174.833 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 29.3 pt20 -68.15 -21.69 64.9 Favored 'General case' 0 N--CA 1.482 1.125 0 C-N-CA 123.292 0.637 . . . . 0.0 111.636 179.541 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 2.4 tt -81.26 121.56 80.44 Favored Pre-proline 0 CA--C 1.553 1.091 0 N-CA-C 107.005 -1.48 . . . . 0.0 107.005 174.103 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_exo -56.78 126.1 21.17 Favored 'Trans proline' 0 C--N 1.381 2.254 0 C-N-CA 122.804 2.336 . . . . 0.0 111.972 173.399 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 41' ' ' LYS . . . . . 0.455 ' HB2' HD11 ' A' ' 78' ' ' LEU . 9.6 ptpp? -58.74 -34.24 71.16 Favored 'General case' 0 N--CA 1.48 1.029 0 C-N-CA 123.261 0.624 . . . . 0.0 111.194 179.925 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 21.3 ptmt -66.49 -33.17 75.08 Favored 'General case' 0 N--CA 1.472 0.669 0 C-N-CA 124.183 0.993 . . . . 0.0 111.849 179.538 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 32.5 t70 -68.1 -33.12 73.92 Favored 'General case' 0 N--CA 1.476 0.871 0 C-N-CA 123.599 0.76 . . . . 0.0 110.33 -178.007 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 53.8 mt -70.17 -46.86 70.65 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.079 0 CA-C-N 115.657 -0.701 . . . . 0.0 109.916 175.266 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 74.6 mt -57.86 -35.77 52.88 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.492 0 C-N-CA 123.199 0.599 . . . . 0.0 110.872 176.882 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 88.6 tttt -65.79 -41.85 91.44 Favored 'General case' 0 CA--C 1.546 0.79 0 C-N-CA 123.306 0.642 . . . . 0.0 110.983 178.756 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 27.2 t80 -57.21 -48.43 78.81 Favored 'General case' 0 N--CA 1.489 1.52 0 C-N-CA 123.278 0.631 . . . . 0.0 110.085 172.892 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . 0.438 ' HB3' ' HE2' ' A' ' 56' ' ' PHE . 96.4 mt -66.77 -35.4 80.0 Favored 'General case' 0 CA--C 1.539 0.553 0 CA-C-N 114.259 -1.337 . . . . 0.0 112.144 -174.111 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . 0.444 ' HA ' ' CD2' ' A' ' 57' ' ' LEU . 3.5 pt20 -82.75 -34.77 27.05 Favored 'General case' 0 N--CA 1.482 1.133 0 CA-C-N 117.903 0.32 . . . . 0.0 111.234 179.25 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 44.5 tt0 -67.47 -37.51 83.01 Favored 'General case' 0 N--CA 1.477 0.895 0 C-N-CA 123.108 0.563 . . . . 0.0 111.247 -177.642 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 97.1 m-70 -108.16 -40.43 5.2 Favored 'General case' 0 N--CA 1.48 1.032 0 CA-C-N 115.679 -0.691 . . . . 0.0 111.822 -171.75 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . 0.538 ' HA2' ' HA ' ' A' ' 91' ' ' PHE . . . -63.88 136.54 41.05 Favored Glycine 0 C--N 1.345 1.031 0 O-C-N 123.596 0.56 . . . . 0.0 113.016 175.178 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 53' ' ' SER . . . . . 0.426 ' O ' ' HG ' ' A' ' 57' ' ' LEU . 9.1 t -73.09 172.64 10.67 Favored 'General case' 0 N--CA 1.476 0.851 0 C-N-CA 123.553 0.741 . . . . 0.0 110.309 -177.988 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 4.3 m-20 -55.0 -39.46 69.07 Favored 'General case' 0 N--CA 1.488 1.467 0 C-N-CA 123.845 0.858 . . . . 0.0 111.356 -177.625 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 22.7 t -63.85 -30.72 71.78 Favored 'General case' 0 N--CA 1.479 1.002 0 CA-C-N 114.932 -1.031 . . . . 0.0 111.71 -179.269 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 56' ' ' PHE . . . . . 0.581 ' HB2' ' HB3' ' A' ' 90' ' ' ARG . 46.3 t80 -75.48 -41.9 54.33 Favored 'General case' 0 N--CA 1.473 0.677 0 C-N-CA 123.102 0.561 . . . . 0.0 110.947 176.449 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . 0.444 ' CD2' ' HA ' ' A' ' 49' ' ' GLN . 20.8 mt -74.24 -49.09 24.73 Favored 'General case' 0 N--CA 1.472 0.629 0 CA-C-N 115.094 -0.957 . . . . 0.0 112.077 -168.541 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -61.4 -48.15 82.56 Favored 'General case' 0 N--CA 1.478 0.95 0 C-N-CA 123.383 0.673 . . . . 0.0 111.319 -177.346 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 14.1 mm-40 -60.37 -30.15 69.39 Favored 'General case' 0 N--CA 1.484 1.26 0 C-N-CA 123.521 0.728 . . . . 0.0 112.768 -178.997 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 35.3 m80 -113.18 0.9 15.06 Favored 'General case' 0 N--CA 1.488 1.426 0 N-CA-C 112.331 0.493 . . . . 0.0 112.331 -175.802 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 75.4 mmtt 55.71 44.68 25.93 Favored 'General case' 0 N--CA 1.486 1.34 0 C-N-CA 124.591 1.156 . . . . 0.0 111.729 178.761 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 85.2 mt -95.33 -11.23 28.15 Favored 'General case' 0 N--CA 1.481 1.094 0 C-N-CA 123.994 0.918 . . . . 0.0 111.455 179.605 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -79.96 171.97 14.39 Favored 'General case' 0 N--CA 1.482 1.14 0 C-N-CA 123.176 0.59 . . . . 0.0 111.42 176.657 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 85.62 -153.42 27.29 Favored Glycine 0 C--N 1.34 0.796 0 CA-C-N 114.751 -1.113 . . . . 0.0 112.53 178.418 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 12.5 m120 -69.79 118.52 12.75 Favored 'General case' 0 N--CA 1.469 0.483 0 N-CA-C 108.948 -0.76 . . . . 0.0 108.948 175.364 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 59.0 mt -55.43 -39.19 51.92 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.066 0 C-N-CA 123.94 0.896 . . . . 0.0 110.813 -177.883 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 58.2 pttt -53.74 -42.88 68.62 Favored 'General case' 0 N--CA 1.485 1.311 0 C-N-CA 124.145 0.978 . . . . 0.0 112.48 178.175 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 3.8 m-20 -59.64 -41.62 90.91 Favored 'General case' 0 N--CA 1.489 1.477 0 C-N-CA 123.997 0.919 . . . . 0.0 110.404 179.257 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 21.5 t -71.22 -44.86 73.13 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.073 0 CA-C-N 113.893 -1.503 . . . . 0.0 109.996 179.307 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -82.1 7.12 14.27 Favored 'General case' 0 N--CA 1.485 1.317 0 C-N-CA 124.726 1.211 . . . . 0.0 113.441 -168.242 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 21.1 ptmt -95.26 -18.69 20.64 Favored 'General case' 0 N--CA 1.482 1.137 0 O-C-N 121.907 -0.496 . . . . 0.0 111.079 172.109 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 13.0 t -133.05 -14.09 2.71 Favored 'General case' 0 CA--C 1.553 1.077 0 C-N-CA 123.257 0.623 . . . . 0.0 112.53 -173.668 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -84.17 99.85 10.78 Favored 'General case' 0 C--O 1.244 0.796 0 N-CA-C 108.692 -0.855 . . . . 0.0 108.692 176.827 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 32.4 p30 -68.65 163.45 23.76 Favored 'General case' 0 CA--C 1.539 0.53 0 CA-C-N 115.826 -0.624 . . . . 0.0 110.132 178.819 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . 0.426 ' HB2' ' NZ ' ' A' ' 75' ' ' LYS . 3.5 ttmp? -67.61 -26.75 66.41 Favored 'General case' 0 CA--C 1.548 0.883 0 C-N-CA 123.053 0.541 . . . . 0.0 110.985 -173.686 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 20.8 t70 -61.9 -41.37 97.82 Favored 'General case' 0 CA--C 1.552 1.037 0 C-N-CA 124.463 1.105 . . . . 0.0 110.966 173.741 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 17.4 t60 -62.84 -36.76 84.28 Favored 'General case' 0 N--CA 1.484 1.249 0 C-N-CA 125.292 1.437 . . . . 0.0 109.653 -179.075 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . 0.455 HD11 ' HB2' ' A' ' 41' ' ' LYS . 48.3 mt -75.06 -36.64 61.8 Favored 'General case' 0 N--CA 1.47 0.537 0 CA-C-N 114.584 -1.189 . . . . 0.0 111.922 -172.863 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 61.9 t -67.39 -41.97 86.86 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.899 0 O-C-N 123.82 0.7 . . . . 0.0 109.699 173.182 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 22.9 m -60.22 -43.56 95.92 Favored 'General case' 0 N--CA 1.482 1.132 0 C-N-CA 123.237 0.615 . . . . 0.0 110.936 177.171 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -69.73 -43.94 71.32 Favored 'General case' 0 N--CA 1.473 0.705 0 C-N-CA 123.523 0.729 . . . . 0.0 111.019 179.077 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 82' ' ' TYR . . . . . . . . . . . . . 18.0 t80 -53.62 -55.93 21.54 Favored 'General case' 0 N--CA 1.479 1.017 0 C-N-CA 124.202 1.001 . . . . 0.0 110.598 178.765 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 83' ' ' ASN . . . . . . . . . . . . . 34.2 m-80 -66.28 -41.54 89.71 Favored 'General case' 0 N--CA 1.476 0.849 0 C-N-CA 122.627 0.371 . . . . 0.0 110.822 -175.948 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 84' ' ' HIS . . . . . 0.485 ' HA ' ' HB3' ' A' ' 87' ' ' GLU . 46.1 m170 -64.5 -26.72 68.55 Favored 'General case' 0 N--CA 1.479 0.993 0 C-N-CA 123.169 0.588 . . . . 0.0 111.837 178.779 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 85' ' ' LEU . . . . . 0.403 ' HG ' ' HD2' ' A' ' 91' ' ' PHE . 56.4 tp -58.33 -54.45 46.84 Favored 'General case' 0 N--CA 1.48 1.056 0 CA-C-O 121.711 0.767 . . . . 0.0 110.179 177.796 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 86' ' ' PHE . . . . . 0.441 ' CZ ' ' HB3' ' A' ' 27' ' ' ARG . 27.1 m-85 -75.63 -26.5 57.83 Favored 'General case' 0 CA--C 1.546 0.821 0 CA-C-N 114.273 -1.33 . . . . 0.0 111.308 179.876 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 87' ' ' GLU . . . . . 0.485 ' HB3' ' HA ' ' A' ' 84' ' ' HIS . 14.9 tp10 -69.55 -25.67 64.12 Favored 'General case' 0 N--CA 1.484 1.262 0 C-N-CA 124.204 1.002 . . . . 0.0 111.745 -176.523 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 39.0 p -123.89 0.86 8.65 Favored 'General case' 0 N--CA 1.474 0.75 0 C-N-CA 123.385 0.674 . . . . 0.0 110.837 179.215 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 34.5 mmtp 54.57 40.05 31.58 Favored 'General case' 0 N--CA 1.483 1.213 0 C-N-CA 124.083 0.953 . . . . 0.0 110.606 -177.109 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 90' ' ' ARG . . . . . 0.581 ' HB3' ' HB2' ' A' ' 56' ' ' PHE . 28.5 mtt180 -73.08 -7.69 52.42 Favored 'General case' 0 N--CA 1.487 1.381 0 C-N-CA 125.323 1.449 . . . . 0.0 113.352 -174.544 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 91' ' ' PHE . . . . . 0.538 ' HA ' ' HA2' ' A' ' 52' ' ' GLY . 3.2 p90 -68.75 164.72 21.13 Favored 'General case' 0 N--CA 1.476 0.86 0 C-N-CA 123.398 0.679 . . . . 0.0 111.347 168.377 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 24.2 ttpp . . . . . 0 CA--C 1.556 1.19 0 O-C-N 124.567 1.167 . . . . 0.0 110.451 171.896 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 40.4 ttp180 . . . . . 0 CA--C 1.549 0.935 0 CA-C-O 121.351 0.596 . . . . 0.0 110.779 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -94.99 -19.6 20.07 Favored 'General case' 0 CA--C 1.549 0.925 0 CA-C-N 114.664 -1.153 . . . . 0.0 111.604 178.621 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 29' ' ' TRP . . . . . . . . . . . . . 2.9 m-90 -135.98 135.0 39.18 Favored 'General case' 0 N--CA 1.483 1.182 0 C-N-CA 124.187 0.995 . . . . 0.0 108.949 -172.705 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 82.1 p -75.63 170.34 16.36 Favored 'General case' 0 CA--C 1.545 0.783 0 N-CA-C 109.804 -0.443 . . . . 0.0 109.804 178.161 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . 0.486 HG22 HD21 ' A' ' 83' ' ' ASN . 91.2 t -59.17 -37.52 68.96 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.273 0 C-N-CA 122.391 0.276 . . . . 0.0 111.186 -177.042 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 10.7 pt-20 -69.09 -34.24 74.79 Favored 'General case' 0 N--CA 1.48 1.072 0 C-N-CA 123.49 0.716 . . . . 0.0 110.918 178.15 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 79.4 mt-30 -70.16 -33.81 72.23 Favored 'General case' 0 N--CA 1.477 0.892 0 C-N-CA 123.005 0.522 . . . . 0.0 110.397 176.233 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.487 HD11 ' CD2' ' A' ' 82' ' ' TYR . 76.2 mt -64.36 -53.7 44.57 Favored 'General case' 0 N--CA 1.477 0.901 0 N-CA-C 109.305 -0.628 . . . . 0.0 109.305 175.651 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 75.9 mtp180 -71.01 -12.02 61.3 Favored 'General case' 0 N--CA 1.477 0.889 0 CA-C-N 114.468 -1.242 . . . . 0.0 111.466 -177.469 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 44.0 t -57.83 143.2 43.2 Favored 'General case' 0 C--N 1.354 0.777 0 C-N-CA 123.482 0.713 . . . . 0.0 111.468 175.496 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 35.7 mt-10 -80.02 -8.31 59.3 Favored 'General case' 0 CA--C 1.55 0.97 0 CA-C-N 114.765 -1.107 . . . . 0.0 111.205 -178.707 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 28.1 mm-40 -86.36 -38.06 17.82 Favored 'General case' 0 N--CA 1.474 0.746 0 C-N-CA 124.038 0.935 . . . . 0.0 110.676 179.509 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 1.3 tt -82.61 112.93 41.07 Favored Pre-proline 0 N--CA 1.476 0.84 0 N-CA-C 108.328 -0.99 . . . . 0.0 108.328 179.096 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 40' ' ' PRO . . . . . 0.522 ' HB2' ' HG2' ' A' ' 42' ' ' LYS . 79.0 Cg_endo -73.81 148.7 41.52 Favored 'Trans proline' 0 C--N 1.372 1.809 0 C-N-CA 121.933 1.755 . . . . 0.0 111.406 -179.638 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 18.8 ptpt -64.52 -28.27 69.54 Favored 'General case' 0 N--CA 1.472 0.669 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.871 -178.429 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . 0.522 ' HG2' ' HB2' ' A' ' 40' ' ' PRO . 19.8 ptpt -65.08 -33.89 77.11 Favored 'General case' 0 N--CA 1.472 0.653 0 C-N-CA 123.453 0.701 . . . . 0.0 111.387 179.571 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 43' ' ' ASP . . . . . 0.412 ' HB2' ' HG2' ' A' ' 40' ' ' PRO . 25.1 t70 -75.37 -31.53 60.52 Favored 'General case' 0 N--CA 1.476 0.845 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.642 -177.515 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 49.4 mt -69.06 -50.18 55.69 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.779 0 N-CA-C 109.657 -0.497 . . . . 0.0 109.657 176.068 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 72.9 mt -57.62 -41.89 80.17 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.335 0 C-N-CA 123.497 0.719 . . . . 0.0 110.468 176.521 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 46' ' ' LYS . . . . . 0.42 ' HD3' HD11 ' A' ' 66' ' ' ILE . 23.1 tptm -53.46 -46.92 70.09 Favored 'General case' 0 N--CA 1.485 1.307 0 C-N-CA 124.555 1.142 . . . . 0.0 110.85 176.53 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 11.9 t80 -66.49 -47.58 72.56 Favored 'General case' 0 N--CA 1.473 0.686 0 CA-C-N 114.916 -1.038 . . . . 0.0 110.897 -179.478 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 93.2 mt -68.12 -33.44 74.5 Favored 'General case' 0 CA--C 1.541 0.627 0 C-N-CA 122.922 0.489 . . . . 0.0 111.842 -173.225 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 3.6 pt20 -83.5 -25.5 31.04 Favored 'General case' 0 N--CA 1.484 1.271 0 C-N-CA 122.464 0.306 . . . . 0.0 111.592 177.623 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 4.2 tm-20 -54.21 -42.5 69.83 Favored 'General case' 0 N--CA 1.49 1.526 0 C-N-CA 124.327 1.051 . . . . 0.0 111.846 -178.919 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 4.0 p80 -138.74 -20.73 1.01 Allowed 'General case' 0 N--CA 1.481 1.123 0 CA-C-N 116.28 -0.418 . . . . 0.0 112.09 -172.755 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -60.26 135.2 50.18 Favored Glycine 0 C--N 1.352 1.43 0 CA-C-O 119.714 -0.492 . . . . 0.0 112.006 172.032 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 53' ' ' SER . . . . . 0.423 ' O ' ' HG ' ' A' ' 57' ' ' LEU . 32.4 t -62.98 148.09 48.66 Favored 'General case' 0 N--CA 1.471 0.622 0 C-N-CA 123.349 0.66 . . . . 0.0 111.868 -175.495 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 25.5 t70 -59.12 -36.95 76.08 Favored 'General case' 0 N--CA 1.481 1.125 0 C-N-CA 124.005 0.922 . . . . 0.0 112.197 -176.038 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 38.4 m -64.0 -37.53 87.74 Favored 'General case' 0 CA--C 1.549 0.931 0 C-N-CA 123.516 0.726 . . . . 0.0 111.367 177.591 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 52.4 t80 -66.5 -47.26 73.53 Favored 'General case' 0 N--CA 1.481 1.085 0 C-N-CA 123.498 0.719 . . . . 0.0 109.593 173.253 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . 0.423 ' HG ' ' O ' ' A' ' 53' ' ' SER . 76.3 mt -60.16 -33.47 72.22 Favored 'General case' 0 N--CA 1.476 0.874 0 CA-C-N 115.203 -0.908 . . . . 0.0 111.377 -175.427 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -65.03 -48.4 73.98 Favored 'General case' 0 N--CA 1.476 0.839 0 C-N-CA 123.626 0.771 . . . . 0.0 111.538 178.646 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 40.2 mt-10 -62.34 -26.47 68.46 Favored 'General case' 0 N--CA 1.482 1.128 0 CA-C-N 115.222 -0.899 . . . . 0.0 112.039 -178.262 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 72.8 m80 -114.37 1.76 14.51 Favored 'General case' 0 N--CA 1.483 1.197 0 C-N-CA 123.3 0.64 . . . . 0.0 112.241 -176.754 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 49.1 mtmt 62.37 22.82 13.48 Favored 'General case' 0 N--CA 1.497 1.881 0 C-N-CA 125.268 1.427 . . . . 0.0 112.6 178.073 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 89.6 mt -80.1 -10.97 59.8 Favored 'General case' 0 N--CA 1.478 0.926 0 C-N-CA 124.186 0.994 . . . . 0.0 112.312 -177.033 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 1.4 pp -74.4 162.48 28.81 Favored 'General case' 0 N--CA 1.48 1.035 0 CA-C-O 121.322 0.582 . . . . 0.0 111.207 175.298 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 89.23 -159.96 29.09 Favored Glycine 0 C--O 1.242 0.649 0 CA-C-N 115.02 -0.991 . . . . 0.0 112.267 178.683 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 65' ' ' ASN . . . . . 0.46 ' OD1' ' HG2' ' A' ' 67' ' ' LYS . 14.0 t-20 -75.63 139.34 41.96 Favored 'General case' 0 N--CA 1.469 0.481 0 N-CA-C 109.441 -0.578 . . . . 0.0 109.441 -179.447 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 66' ' ' ILE . . . . . 0.42 HD11 ' HD3' ' A' ' 46' ' ' LYS . 59.7 mt -61.0 -46.41 96.71 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.797 0 O-C-N 123.69 0.619 . . . . 0.0 112.568 -171.261 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 67' ' ' LYS . . . . . 0.46 ' HG2' ' OD1' ' A' ' 65' ' ' ASN . 8.9 ptpp? -60.48 -36.29 77.95 Favored 'General case' 0 N--CA 1.491 1.617 0 CA-C-N 118.334 0.515 . . . . 0.0 110.83 -178.344 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 7.0 t30 -61.42 -40.5 94.63 Favored 'General case' 0 N--CA 1.48 1.028 0 C-N-CA 124.543 1.137 . . . . 0.0 110.975 176.692 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 32.8 t -73.13 -40.22 57.9 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.808 0 CA-C-N 115.223 -0.899 . . . . 0.0 110.441 175.984 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -72.82 -5.89 41.21 Favored 'General case' 0 N--CA 1.484 1.229 0 C-N-CA 124.614 1.166 . . . . 0.0 113.221 -170.332 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -90.34 -18.94 24.65 Favored 'General case' 0 CA--C 1.548 0.867 0 C-N-CA 122.209 0.203 . . . . 0.0 110.765 176.278 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 10.1 t -120.08 -15.16 8.78 Favored 'General case' 0 N--CA 1.477 0.876 0 C-N-CA 123.927 0.891 . . . . 0.0 111.354 -178.022 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -90.32 97.37 11.14 Favored 'General case' 0 N--CA 1.475 0.777 0 C-N-CA 123.243 0.617 . . . . 0.0 110.317 179.407 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 74' ' ' ASN . . . . . 0.403 ' ND2' ' HB3' ' A' ' 76' ' ' ASP . 54.4 t30 -66.3 156.7 33.64 Favored 'General case' 0 N--CA 1.477 0.876 0 CA-C-N 115.431 -0.804 . . . . 0.0 109.125 173.077 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . 0.442 ' O ' HG23 ' A' ' 79' ' ' VAL . 2.9 tppp? -64.32 -38.76 92.18 Favored 'General case' 0 CA--C 1.548 0.892 0 N-CA-C 110.186 -0.302 . . . . 0.0 110.186 179.734 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 76' ' ' ASP . . . . . 0.403 ' HB3' ' ND2' ' A' ' 74' ' ' ASN . 31.0 t70 -64.53 -34.82 79.12 Favored 'General case' 0 N--CA 1.484 1.253 0 C-N-CA 124.156 0.982 . . . . 0.0 111.28 175.783 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 17.3 t60 -66.45 -38.63 87.77 Favored 'General case' 0 N--CA 1.487 1.386 0 C-N-CA 123.967 0.907 . . . . 0.0 109.376 174.232 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 71.8 mt -74.42 -26.62 60.18 Favored 'General case' 0 N--CA 1.475 0.793 0 C-N-CA 123.401 0.68 . . . . 0.0 112.326 -178.536 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 79' ' ' VAL . . . . . 0.442 HG23 ' O ' ' A' ' 75' ' ' LYS . 88.1 t -68.79 -44.02 82.34 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.018 0 N-CA-C 109.271 -0.64 . . . . 0.0 109.271 172.79 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 59.9 m -58.11 -51.77 68.33 Favored 'General case' 0 CA--C 1.546 0.79 0 CA-C-N 115.041 -0.981 . . . . 0.0 110.783 175.847 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -65.49 -45.88 81.87 Favored 'General case' 0 N--CA 1.475 0.786 0 C-N-CA 123.483 0.713 . . . . 0.0 111.779 -176.864 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 82' ' ' TYR . . . . . 0.487 ' CD2' HD11 ' A' ' 34' ' ' LEU . 79.8 t80 -58.82 -57.34 13.45 Favored 'General case' 0 N--CA 1.474 0.75 0 C-N-CA 124.289 1.036 . . . . 0.0 110.307 -177.712 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 83' ' ' ASN . . . . . 0.486 HD21 HG22 ' A' ' 31' ' ' VAL . 18.2 m-80 -60.56 -42.1 95.91 Favored 'General case' 0 CA--C 1.549 0.913 0 CA-C-N 115.677 -0.692 . . . . 0.0 111.65 -176.037 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 63.5 m-70 -68.22 -25.24 65.11 Favored 'General case' 0 N--CA 1.481 1.097 0 CA-C-O 118.733 -0.651 . . . . 0.0 112.66 178.78 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 57.1 tp -62.08 -53.5 54.55 Favored 'General case' 0 N--CA 1.49 1.553 0 CA-C-N 118.76 0.709 . . . . 0.0 110.876 178.643 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 24.4 m-85 -75.33 -20.64 58.93 Favored 'General case' 0 N--CA 1.477 0.898 0 CA-C-N 114.613 -1.176 . . . . 0.0 110.868 -177.54 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 34.4 tt0 -69.36 -26.6 64.75 Favored 'General case' 0 N--CA 1.479 1.004 0 C-N-CA 123.316 0.647 . . . . 0.0 111.062 175.988 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 26.3 p -112.26 -21.93 11.18 Favored 'General case' 0 N--CA 1.477 0.92 0 C-N-CA 123.897 0.879 . . . . 0.0 110.914 179.385 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 97.3 mttt 55.1 46.87 23.16 Favored 'General case' 0 N--CA 1.481 1.09 0 C-N-CA 124.985 1.314 . . . . 0.0 112.292 -176.131 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 99.2 mtt180 -71.5 -16.05 62.33 Favored 'General case' 0 N--CA 1.493 1.697 0 C-N-CA 124.144 0.978 . . . . 0.0 112.095 177.973 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 91' ' ' PHE . . . . . . . . . . . . . 54.3 p90 -72.57 161.14 31.17 Favored 'General case' 0 CA--C 1.543 0.681 0 C-N-CA 123.631 0.773 . . . . 0.0 111.904 178.435 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 49.2 pttt . . . . . 0 C--O 1.254 1.294 0 N-CA-C 108.313 -0.995 . . . . 0.0 108.313 165.959 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 CA--C 1.544 0.736 0 CA-C-O 120.837 0.351 . . . . 0.0 110.209 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -77.56 -41.76 37.77 Favored 'General case' 0 N--CA 1.47 0.574 0 N-CA-C 109.101 -0.703 . . . . 0.0 109.101 178.192 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 29' ' ' TRP . . . . . 0.4 ' CH2' ' HB3' ' A' ' 43' ' ' ASP . 10.7 m-90 -138.32 159.68 41.44 Favored 'General case' 0 N--CA 1.477 0.9 0 C-N-CA 124.717 1.207 . . . . 0.0 108.236 175.462 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 67.9 p -85.42 168.55 14.5 Favored 'General case' 0 N--CA 1.483 1.218 0 N-CA-C 108.662 -0.866 . . . . 0.0 108.662 176.525 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 7.2 p -61.0 -39.34 81.86 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.197 0 CA-C-N 118.052 0.387 . . . . 0.0 111.425 -174.859 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -64.26 -35.74 81.83 Favored 'General case' 0 N--CA 1.479 1.015 0 C-N-CA 123.836 0.855 . . . . 0.0 111.42 177.775 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 51.0 mt-30 -69.66 -42.37 74.31 Favored 'General case' 0 C--N 1.353 0.746 0 C-N-CA 123.28 0.632 . . . . 0.0 110.757 175.045 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.442 ' HA ' HD13 ' A' ' 39' ' ' LEU . 89.2 mt -63.51 -53.61 49.23 Favored 'General case' 0 N--CA 1.478 0.974 0 C-N-CA 123.237 0.615 . . . . 0.0 111.094 -175.697 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 8.0 ptm180 -65.01 -22.45 67.0 Favored 'General case' 0 N--CA 1.473 0.719 0 O-C-N 124.176 0.923 . . . . 0.0 112.003 -172.718 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 23.3 t -60.2 132.3 53.49 Favored 'General case' 0 CA--C 1.545 0.756 0 C-N-CA 123.552 0.741 . . . . 0.0 110.457 177.917 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 3.1 mp0 -66.72 -21.15 66.08 Favored 'General case' 0 CA--C 1.546 0.819 0 C-N-CA 123.658 0.783 . . . . 0.0 111.718 -173.395 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 13.8 pt20 -69.47 -29.18 66.79 Favored 'General case' 0 N--CA 1.479 1.011 0 C-N-CA 122.823 0.449 . . . . 0.0 111.211 177.456 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . 0.442 HD13 ' HA ' ' A' ' 34' ' ' LEU . 4.0 tt -86.33 113.09 50.54 Favored Pre-proline 0 N--CA 1.475 0.775 0 N-CA-C 107.967 -1.123 . . . . 0.0 107.967 177.728 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 40' ' ' PRO . . . . . 0.451 ' HB2' ' HG2' ' A' ' 42' ' ' LYS . 98.6 Cg_endo -73.03 149.26 46.41 Favored 'Trans proline' 0 C--N 1.375 1.963 0 C-N-CA 122.509 2.14 . . . . 0.0 112.015 -178.92 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 46.2 mtmt -68.27 -21.12 64.82 Favored 'General case' 0 N--CA 1.472 0.65 0 CA-C-N 114.868 -1.06 . . . . 0.0 112.043 -175.572 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . 0.451 ' HG2' ' HB2' ' A' ' 40' ' ' PRO . 17.3 ptpt -65.08 -34.16 77.76 Favored 'General case' 0 CA--C 1.544 0.747 0 C-N-CA 123.97 0.908 . . . . 0.0 111.149 178.462 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 43' ' ' ASP . . . . . 0.4 ' HB3' ' CH2' ' A' ' 29' ' ' TRP . 0.8 OUTLIER -69.79 -38.79 76.8 Favored 'General case' 0 C--O 1.241 0.616 0 C-N-CA 123.617 0.767 . . . . 0.0 111.161 179.015 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 43.1 mt -68.74 -50.88 51.05 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.596 0 CA-C-N 115.49 -0.777 . . . . 0.0 110.164 -178.457 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 75.7 mt -59.81 -36.09 64.17 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.163 0 C-N-CA 123.277 0.631 . . . . 0.0 110.872 177.471 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 13.4 ttmm -59.48 -48.45 81.62 Favored 'General case' 0 N--CA 1.479 0.996 0 C-N-CA 122.788 0.435 . . . . 0.0 111.023 174.384 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 20.9 t80 -54.88 -45.96 74.71 Favored 'General case' 0 N--CA 1.484 1.254 0 CA-C-O 121.259 0.552 . . . . 0.0 110.73 176.115 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . 0.421 ' HB3' ' HE2' ' A' ' 56' ' ' PHE . 90.8 mt -70.58 -37.93 74.01 Favored 'General case' 0 CA--C 1.544 0.73 0 CA-C-N 115.045 -0.98 . . . . 0.0 112.163 -175.152 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . 0.418 ' HA ' HD11 ' A' ' 57' ' ' LEU . 3.3 pt20 -85.6 -36.43 20.39 Favored 'General case' 0 N--CA 1.489 1.503 0 N-CA-C 113.121 0.786 . . . . 0.0 113.121 -175.935 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 32.5 tt0 -69.1 -37.42 78.41 Favored 'General case' 0 N--CA 1.479 0.991 0 C-N-CA 123.802 0.841 . . . . 0.0 111.599 -170.303 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -141.04 14.0 2.25 Favored 'General case' 0 N--CA 1.48 1.064 0 N-CA-C 113.107 0.78 . . . . 0.0 113.107 -178.93 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -103.9 150.38 17.45 Favored Glycine 0 N--CA 1.478 1.472 0 N-CA-C 110.639 -0.984 . . . . 0.0 110.639 162.564 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 53' ' ' SER . . . . . 0.485 ' O ' ' HG ' ' A' ' 57' ' ' LEU . 80.1 p -68.09 159.25 31.28 Favored 'General case' 0 N--CA 1.485 1.308 0 N-CA-C 113.353 0.871 . . . . 0.0 113.353 -170.137 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 22.1 t70 -66.21 -38.85 88.96 Favored 'General case' 0 N--CA 1.48 1.062 0 C-N-CA 124.514 1.126 . . . . 0.0 111.409 -177.331 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 13.3 t -67.49 -31.06 70.93 Favored 'General case' 0 N--CA 1.478 0.965 0 C-N-CA 123.544 0.738 . . . . 0.0 110.992 -179.364 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 56' ' ' PHE . . . . . 0.455 ' HD1' HH11 ' A' ' 90' ' ' ARG . 27.2 t80 -65.56 -48.81 71.14 Favored 'General case' 0 CA--C 1.548 0.874 0 CA-C-N 115.435 -0.802 . . . . 0.0 110.246 170.753 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . 0.485 ' HG ' ' O ' ' A' ' 53' ' ' SER . 72.1 mt -60.97 -45.4 94.9 Favored 'General case' 0 N--CA 1.481 1.122 0 C-N-CA 122.884 0.473 . . . . 0.0 111.347 -177.674 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -52.74 -26.24 13.53 Favored 'General case' 0 CA--C 1.545 0.752 0 C-N-CA 125.918 1.687 . . . . 0.0 113.734 -175.033 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 57.0 mt-10 -57.08 -49.09 76.93 Favored 'General case' 0 N--CA 1.481 1.118 0 C-N-CA 123.812 0.845 . . . . 0.0 111.789 179.81 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 58.7 t-80 -109.93 -5.2 15.55 Favored 'General case' 0 N--CA 1.485 1.276 0 C-N-CA 123.379 0.672 . . . . 0.0 111.013 177.563 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 24.9 mtpp 64.84 59.43 0.9 Allowed 'General case' 0 CA--C 1.545 0.763 0 C-N-CA 124.578 1.151 . . . . 0.0 109.908 -170.692 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . 0.507 ' HA ' HG11 ' A' ' 69' ' ' VAL . 84.6 mt -83.49 -0.34 49.78 Favored 'General case' 0 N--CA 1.489 1.518 0 C-N-CA 124.11 0.964 . . . . 0.0 110.848 175.771 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -82.47 158.83 23.07 Favored 'General case' 0 C--O 1.242 0.672 0 C-N-CA 124.631 1.172 . . . . 0.0 110.751 176.093 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 85.67 -146.92 21.76 Favored Glycine 0 C--N 1.337 0.6 0 CA-C-N 115.038 -0.983 . . . . 0.0 113.466 175.91 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 78.1 m-20 -65.36 111.21 2.93 Favored 'General case' 0 N--CA 1.473 0.698 0 C-N-CA 124.182 0.993 . . . . 0.0 109.83 -175.691 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 55.1 mt -56.1 -51.45 61.95 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.107 0 O-C-N 124.31 1.006 . . . . 0.0 112.678 -169.015 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 67' ' ' LYS . . . . . 0.566 ' H ' ' HD2' ' A' ' 67' ' ' LYS . 0.0 OUTLIER -71.69 -32.07 67.44 Favored 'General case' 0 N--CA 1.485 1.293 0 C-N-CA 123.183 0.593 . . . . 0.0 110.28 -174.634 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 49.0 t30 -62.82 -35.67 80.66 Favored 'General case' 0 N--CA 1.482 1.127 0 CA-C-N 115.277 -0.874 . . . . 0.0 110.846 175.326 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 69' ' ' VAL . . . . . 0.507 HG11 ' HA ' ' A' ' 62' ' ' LEU . 64.6 t -73.85 -41.28 53.76 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.859 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.145 172.058 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 70' ' ' ALA . . . . . 0.526 ' HA ' ' HB3' ' A' ' 73' ' ' ALA . . . -69.94 -1.94 11.04 Favored 'General case' 0 N--CA 1.487 1.393 0 C-N-CA 124.377 1.071 . . . . 0.0 113.417 -174.172 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 64.0 pttt -75.91 -33.71 59.91 Favored 'General case' 0 N--CA 1.478 0.966 0 CA-C-N 118.06 0.391 . . . . 0.0 110.131 174.081 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 10.0 t -115.16 -13.92 11.77 Favored 'General case' 0 N--CA 1.472 0.641 0 C-N-CA 123.988 0.915 . . . . 0.0 110.626 -176.906 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . 0.526 ' HB3' ' HA ' ' A' ' 70' ' ' ALA . . . -78.25 94.19 4.75 Favored 'General case' 0 C--N 1.343 0.317 0 N-CA-C 108.976 -0.75 . . . . 0.0 108.976 174.16 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 27.8 p-10 -74.25 155.54 38.17 Favored 'General case' 0 C--O 1.244 0.79 0 N-CA-C 109.372 -0.603 . . . . 0.0 109.372 176.33 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 4.6 tppp? -56.54 -39.05 72.76 Favored 'General case' 0 CA--C 1.549 0.916 0 C-N-CA 123.82 0.848 . . . . 0.0 111.846 -174.476 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 25.9 t70 -59.42 -49.5 77.54 Favored 'General case' 0 N--CA 1.476 0.869 0 C-N-CA 124.055 0.942 . . . . 0.0 112.333 -177.215 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 8.7 t60 -70.76 -28.12 64.45 Favored 'General case' 0 N--CA 1.476 0.869 0 C-N-CA 123.327 0.651 . . . . 0.0 110.696 -176.717 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . 0.463 HD21 ' HB1' ' A' ' 73' ' ' ALA . 82.4 mt -68.72 -33.61 74.23 Favored 'General case' 0 N--CA 1.478 0.925 0 C-N-CA 122.824 0.449 . . . . 0.0 111.972 176.266 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 57.1 t -66.03 -45.48 90.63 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.702 0 O-C-N 124.031 0.832 . . . . 0.0 109.653 171.227 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 33.8 m -58.63 -40.1 82.41 Favored 'General case' 0 N--CA 1.479 1.004 0 C-N-CA 123.855 0.862 . . . . 0.0 111.209 177.571 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -69.55 -46.66 65.93 Favored 'General case' 0 N--CA 1.469 0.514 0 C-N-CA 123.858 0.863 . . . . 0.0 110.527 178.142 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 82' ' ' TYR . . . . . . . . . . . . . 10.6 t80 -52.05 -54.8 25.75 Favored 'General case' 0 N--CA 1.475 0.816 0 C-N-CA 124.857 1.263 . . . . 0.0 110.997 179.349 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 83' ' ' ASN . . . . . . . . . . . . . 62.3 m-80 -65.0 -38.16 90.05 Favored 'General case' 0 N--CA 1.478 0.953 0 C-N-CA 122.825 0.45 . . . . 0.0 111.511 -177.609 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 32.1 m170 -66.64 -26.14 66.92 Favored 'General case' 0 N--CA 1.484 1.269 0 C-N-CA 123.729 0.811 . . . . 0.0 112.054 177.993 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 37.9 tp -58.52 -52.67 64.66 Favored 'General case' 0 N--CA 1.478 0.959 0 CA-C-O 121.386 0.613 . . . . 0.0 110.538 176.948 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 28.6 m-85 -75.44 -32.56 60.72 Favored 'General case' 0 N--CA 1.47 0.562 0 CA-C-N 114.261 -1.336 . . . . 0.0 111.771 -179.11 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 35.9 tt0 -55.99 -45.58 78.95 Favored 'General case' 0 N--CA 1.484 1.229 0 C-N-CA 123.941 0.896 . . . . 0.0 112.306 -172.664 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 16.5 p -112.77 3.41 16.46 Favored 'General case' 0 N--CA 1.477 0.908 0 C-N-CA 123.91 0.884 . . . . 0.0 111.393 178.194 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 47.9 mtpt 52.75 64.66 1.77 Allowed 'General case' 0 N--CA 1.479 0.977 0 C-N-CA 124.664 1.186 . . . . 0.0 110.612 179.182 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 90' ' ' ARG . . . . . 0.455 HH11 ' HD1' ' A' ' 56' ' ' PHE . 99.3 mtt180 -78.5 -33.19 48.27 Favored 'General case' 0 N--CA 1.473 0.701 0 CA-C-N 114.561 -1.199 . . . . 0.0 112.099 -172.374 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 91' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -51.41 160.73 0.54 Allowed 'General case' 0 N--CA 1.483 1.188 0 C-N-CA 124.116 0.966 . . . . 0.0 113.436 178.353 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 92' ' ' LYS . . . . . 0.588 ' HA ' ' HE2' ' A' ' 92' ' ' LYS . 11.0 mmpt? . . . . . 0 C--O 1.254 1.305 0 C-N-CA 124.33 1.052 . . . . 0.0 111.825 178.421 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 27' ' ' ARG . . . . . 0.535 ' HB2' ' OH ' ' A' ' 82' ' ' TYR . 0.0 OUTLIER . . . . . 0 N--CA 1.477 0.895 0 CA-C-O 120.889 0.376 . . . . 0.0 111.521 . . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -101.51 -43.3 5.95 Favored 'General case' 0 N--CA 1.475 0.818 0 C-N-CA 123.591 0.756 . . . . 0.0 110.878 -174.489 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 29' ' ' TRP . . . . . . . . . . . . . 3.7 m-90 -101.76 152.64 20.63 Favored 'General case' 0 N--CA 1.474 0.731 0 C-N-CA 124.554 1.142 . . . . 0.0 111.605 -169.43 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 64.9 p -92.09 174.16 7.46 Favored 'General case' 0 CA--C 1.542 0.657 0 C-N-CA 123.511 0.724 . . . . 0.0 109.505 170.963 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . 0.428 ' HA ' HD12 ' A' ' 34' ' ' LEU . 12.4 p -56.11 -37.97 51.58 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.36 0 C-N-CA 123.379 0.672 . . . . 0.0 111.973 -177.674 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . 0.41 ' HA ' ' HG2' ' A' ' 35' ' ' ARG . 10.0 pt-20 -73.61 -35.92 65.41 Favored 'General case' 0 N--CA 1.474 0.727 0 C-N-CA 123.666 0.787 . . . . 0.0 111.843 -178.994 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 2.7 mp0 -66.64 -33.42 75.61 Favored 'General case' 0 N--CA 1.482 1.149 0 C-N-CA 122.839 0.455 . . . . 0.0 110.652 176.144 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.543 HD13 ' HA ' ' A' ' 79' ' ' VAL . 79.4 mt -65.48 -50.72 64.28 Favored 'General case' 0 N--CA 1.48 1.041 0 CA-C-O 121.302 0.572 . . . . 0.0 111.127 177.131 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 35' ' ' ARG . . . . . 0.41 ' HG2' ' HA ' ' A' ' 32' ' ' GLU . 13.8 ptm180 -74.34 -11.51 60.28 Favored 'General case' 0 CA--C 1.548 0.892 0 CA-C-N 114.727 -1.124 . . . . 0.0 112.073 -175.786 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 48.3 t -64.73 143.98 57.55 Favored 'General case' 0 CA--C 1.553 1.079 0 C-N-CA 123.497 0.719 . . . . 0.0 111.113 173.65 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 13.9 pt-20 -73.71 -27.99 61.49 Favored 'General case' 0 N--CA 1.481 1.078 0 C-N-CA 123.307 0.643 . . . . 0.0 110.489 175.816 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 92.9 mt-30 -63.16 -31.16 72.24 Favored 'General case' 0 N--CA 1.474 0.773 0 C-N-CA 124.982 1.313 . . . . 0.0 110.868 -177.18 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . 0.44 HD23 ' HA ' ' A' ' 34' ' ' LEU . 48.7 tp -92.04 109.16 35.54 Favored Pre-proline 0 CA--C 1.549 0.92 0 N-CA-C 108.362 -0.977 . . . . 0.0 108.362 170.713 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 40' ' ' PRO . . . . . 0.498 ' HG2' ' HB2' ' A' ' 43' ' ' ASP . 47.3 Cg_endo -68.61 151.11 75.23 Favored 'Trans proline' 0 C--N 1.378 2.081 0 C-N-CA 122.821 2.347 . . . . 0.0 112.466 -178.587 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 49.7 mtmt -58.21 -42.72 86.84 Favored 'General case' 0 N--CA 1.477 0.883 0 C-N-CA 123.983 0.913 . . . . 0.0 111.325 -179.806 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 17.8 ptpt -63.52 -34.34 77.57 Favored 'General case' 0 CA--C 1.542 0.669 0 CA-C-N 114.442 -1.254 . . . . 0.0 111.763 -176.274 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 43' ' ' ASP . . . . . 0.498 ' HB2' ' HG2' ' A' ' 40' ' ' PRO . 14.0 t70 -73.99 -30.83 62.69 Favored 'General case' 0 N--CA 1.48 1.048 0 O-C-N 123.109 0.256 . . . . 0.0 110.847 -176.941 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 44' ' ' ILE . . . . . 0.605 HD12 HD13 ' A' ' 78' ' ' LEU . 42.8 mt -70.22 -52.16 32.54 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.973 0 C-N-CA 122.827 0.451 . . . . 0.0 110.033 177.036 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 69.5 mt -55.64 -41.84 66.43 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.537 0 C-N-CA 123.612 0.765 . . . . 0.0 110.581 177.008 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 35.1 ttmt -56.25 -48.38 76.64 Favored 'General case' 0 N--CA 1.474 0.763 0 C-N-CA 124.737 1.215 . . . . 0.0 111.241 178.036 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 15.9 t80 -61.37 -46.48 90.02 Favored 'General case' 0 N--CA 1.474 0.74 0 CA-C-N 115.045 -0.979 . . . . 0.0 110.903 178.021 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 88.5 mt -69.42 -32.56 71.61 Favored 'General case' 0 N--CA 1.473 0.705 0 C-N-CA 123.544 0.738 . . . . 0.0 112.14 -174.704 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 3.1 pt20 -82.29 -26.33 33.19 Favored 'General case' 0 N--CA 1.479 0.979 0 CA-C-O 120.779 0.323 . . . . 0.0 110.716 178.788 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 11.3 tp10 -63.43 -26.27 68.66 Favored 'General case' 0 N--CA 1.48 1.046 0 C-N-CA 124.068 0.947 . . . . 0.0 112.07 -176.933 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 51' ' ' HIS . . . . . 0.462 ' O ' ' HG2' ' A' ' 92' ' ' LYS . 0.4 OUTLIER -136.22 -24.94 1.22 Allowed 'General case' 0 N--CA 1.487 1.404 0 N-CA-C 113.428 0.899 . . . . 0.0 113.428 178.764 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -58.04 131.68 52.17 Favored Glycine 0 C--N 1.346 1.089 0 CA-C-N 118.426 0.557 . . . . 0.0 112.761 174.118 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 48.2 t -64.36 160.14 19.63 Favored 'General case' 0 N--CA 1.477 0.914 0 C-N-CA 123.014 0.525 . . . . 0.0 111.34 -177.51 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 4.8 m-20 -56.95 -38.19 72.6 Favored 'General case' 0 N--CA 1.482 1.167 0 C-N-CA 124.111 0.964 . . . . 0.0 111.003 -178.587 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 28.2 t -65.98 -36.45 83.34 Favored 'General case' 0 CA--C 1.548 0.891 0 CA-C-N 114.175 -1.375 . . . . 0.0 110.847 -179.468 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 88.5 t80 -70.75 -51.12 29.23 Favored 'General case' 0 N--CA 1.476 0.862 0 C-N-CA 123.102 0.561 . . . . 0.0 110.099 175.791 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . 0.449 HD22 ' HB2' ' A' ' 62' ' ' LEU . 73.1 mt -62.78 -31.8 72.84 Favored 'General case' 0 N--CA 1.474 0.771 0 CA-C-N 115.19 -0.913 . . . . 0.0 111.561 -173.633 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -62.09 -49.5 75.68 Favored 'General case' 0 N--CA 1.476 0.862 0 C-N-CA 123.587 0.755 . . . . 0.0 111.443 177.286 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 36.1 mt-10 -57.4 -48.74 78.29 Favored 'General case' 0 N--CA 1.483 1.224 0 C-N-CA 123.81 0.844 . . . . 0.0 110.555 179.357 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 64.2 m80 -95.67 1.95 53.79 Favored 'General case' 0 N--CA 1.477 0.876 0 CA-C-N 114.86 -1.064 . . . . 0.0 111.974 -170.532 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 39.4 mtmm 57.34 27.46 13.8 Favored 'General case' 0 N--CA 1.492 1.666 0 C-N-CA 124.496 1.118 . . . . 0.0 112.797 176.951 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . 0.456 HD11 ' HB1' ' A' ' 81' ' ' ALA . 85.1 mt -82.32 -11.61 58.5 Favored 'General case' 0 N--CA 1.483 1.183 0 C-N-CA 123.298 0.639 . . . . 0.0 111.671 -176.012 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 2.9 pp -79.54 158.45 27.17 Favored 'General case' 0 N--CA 1.475 0.806 0 CA-C-O 121.103 0.478 . . . . 0.0 110.724 175.347 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 93.42 -168.52 29.58 Favored Glycine 0 C--N 1.339 0.74 0 CA-C-N 115.313 -0.858 . . . . 0.0 112.774 179.76 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 65' ' ' ASN . . . . . 0.416 ' O ' HG23 ' A' ' 69' ' ' VAL . 51.5 t-20 -59.7 111.87 1.6 Allowed 'General case' 0 N--CA 1.478 0.974 0 C-N-CA 124.08 0.952 . . . . 0.0 109.593 -177.521 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 39.8 mt -55.36 -42.69 68.18 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.58 0 C-N-CA 123.873 0.869 . . . . 0.0 111.307 -171.652 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 17.5 mtpp -55.96 -45.73 78.8 Favored 'General case' 0 CA--C 1.545 0.781 0 C-N-CA 124.466 1.106 . . . . 0.0 111.156 178.277 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 2.1 m-20 -74.13 -33.09 63.43 Favored 'General case' 0 N--CA 1.481 1.083 0 C-N-CA 123.31 0.644 . . . . 0.0 111.121 -178.909 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 69' ' ' VAL . . . . . 0.416 HG23 ' O ' ' A' ' 65' ' ' ASN . 89.8 t -63.03 -44.06 99.4 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.061 0 C-N-CA 123.367 0.667 . . . . 0.0 109.936 174.393 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -67.04 -5.18 12.01 Favored 'General case' 0 N--CA 1.484 1.268 0 C-N-CA 124.742 1.217 . . . . 0.0 112.709 -176.101 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 85.6 tttt -72.27 -50.68 25.34 Favored 'General case' 0 CA--C 1.545 0.754 0 C-N-CA 122.738 0.415 . . . . 0.0 109.912 173.908 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 14.5 t -91.53 -21.33 20.93 Favored 'General case' 0 N--CA 1.473 0.716 0 C-N-CA 123.374 0.67 . . . . 0.0 110.889 179.56 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -85.44 85.31 7.44 Favored 'General case' 0 C--O 1.241 0.653 0 CA-C-O 121.681 0.753 . . . . 0.0 109.407 178.428 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 74' ' ' ASN . . . . . 0.455 ' O ' ' HG ' ' A' ' 78' ' ' LEU . 28.0 p-10 -74.92 172.83 11.55 Favored 'General case' 0 N--CA 1.474 0.763 0 CA-C-N 114.494 -1.23 . . . . 0.0 109.885 176.854 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . 0.501 ' HA ' HD12 ' A' ' 78' ' ' LEU . 1.9 tpmt? -54.27 -40.73 68.1 Favored 'General case' 0 CA--C 1.552 1.05 0 C-N-CA 123.867 0.867 . . . . 0.0 111.519 -176.056 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 34.8 t70 -64.68 -40.38 95.3 Favored 'General case' 0 N--CA 1.478 0.943 0 C-N-CA 124.293 1.037 . . . . 0.0 112.122 179.457 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 34.5 t60 -59.35 -42.89 92.58 Favored 'General case' 0 N--CA 1.485 1.32 0 C-N-CA 124.076 0.951 . . . . 0.0 110.363 178.974 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . 0.605 HD13 HD12 ' A' ' 44' ' ' ILE . 34.0 mt -60.32 -46.26 90.51 Favored 'General case' 0 C--O 1.218 -0.578 0 CA-C-N 114.296 -1.32 . . . . 0.0 111.377 -176.174 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 79' ' ' VAL . . . . . 0.543 ' HA ' HD13 ' A' ' 34' ' ' LEU . 60.2 t -63.68 -46.84 93.59 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.631 0 O-C-N 124.367 1.042 . . . . 0.0 110.743 -178.728 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 34.5 m -60.05 -50.51 73.44 Favored 'General case' 0 N--CA 1.478 0.94 0 CA-C-N 115.61 -0.723 . . . . 0.0 111.259 179.392 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 81' ' ' ALA . . . . . 0.456 ' HB1' HD11 ' A' ' 62' ' ' LEU . . . -66.4 -43.55 85.51 Favored 'General case' 0 N--CA 1.474 0.747 0 C-N-CA 123.767 0.827 . . . . 0.0 111.31 -177.286 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 82' ' ' TYR . . . . . 0.535 ' OH ' ' HB2' ' A' ' 27' ' ' ARG . 78.6 t80 -58.22 -58.93 6.3 Favored 'General case' 0 N--CA 1.473 0.721 0 C-N-CA 124.024 0.93 . . . . 0.0 110.379 -178.262 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 83' ' ' ASN . . . . . . . . . . . . . 16.6 m-80 -59.47 -39.69 84.51 Favored 'General case' 0 N--CA 1.48 1.063 0 C-N-CA 123.546 0.738 . . . . 0.0 111.011 -175.042 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 3.7 m-70 -65.07 -33.89 77.11 Favored 'General case' 0 N--CA 1.478 0.943 0 C-N-CA 123.765 0.826 . . . . 0.0 112.605 179.969 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 40.6 tp -59.18 -52.1 67.16 Favored 'General case' 0 N--CA 1.479 1.021 0 CA-C-O 121.519 0.676 . . . . 0.0 110.847 -176.811 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 86' ' ' PHE . . . . . 0.431 ' HA ' ' HE2' ' A' ' 91' ' ' PHE . 21.6 m-85 -76.27 -29.47 57.44 Favored 'General case' 0 N--CA 1.473 0.702 0 CA-C-N 114.106 -1.406 . . . . 0.0 111.165 -177.933 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 11.2 tp10 -61.01 -27.65 68.47 Favored 'General case' 0 N--CA 1.48 1.045 0 C-N-CA 124.734 1.214 . . . . 0.0 111.981 -179.905 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 31.5 p -128.46 -4.37 5.4 Favored 'General case' 0 N--CA 1.484 1.231 0 C-N-CA 123.74 0.816 . . . . 0.0 111.613 -177.761 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 44.7 mtmt 58.05 50.15 10.54 Favored 'General case' 0 N--CA 1.485 1.317 0 C-N-CA 124.614 1.166 . . . . 0.0 112.168 178.687 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 99.5 mtt180 -80.93 -5.43 57.45 Favored 'General case' 0 N--CA 1.481 1.077 0 CA-C-N 115.698 -0.683 . . . . 0.0 111.627 178.208 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 91' ' ' PHE . . . . . 0.431 ' HE2' ' HA ' ' A' ' 86' ' ' PHE . 48.9 p90 -71.98 163.61 27.56 Favored 'General case' 0 N--CA 1.474 0.763 0 C-N-CA 123.53 0.732 . . . . 0.0 110.674 167.416 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 92' ' ' LYS . . . . . 0.462 ' HG2' ' O ' ' A' ' 51' ' ' HIS . 32.2 mmmt . . . . . 0 C--O 1.252 1.194 0 C-N-CA 123.466 0.707 . . . . 0.0 110.674 -176.226 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 CA--C 1.542 0.664 0 CA-C-O 120.845 0.355 . . . . 0.0 111.177 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -85.1 -42.4 14.83 Favored 'General case' 0 N--CA 1.474 0.753 0 C-N-CA 123.5 0.72 . . . . 0.0 109.423 178.197 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 29' ' ' TRP . . . . . . . . . . . . . 6.6 m-90 -123.48 153.7 40.14 Favored 'General case' 0 N--CA 1.476 0.835 0 C-N-CA 124.571 1.148 . . . . 0.0 108.935 177.966 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 30' ' ' THR . . . . . 0.426 ' O ' ' HG ' ' A' ' 34' ' ' LEU . 55.9 p -87.49 170.59 11.21 Favored 'General case' 0 N--CA 1.475 0.812 0 C-N-CA 123.007 0.523 . . . . 0.0 110.095 -178.92 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 8.1 p -56.13 -46.23 80.98 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.312 0 C-N-CA 123.909 0.884 . . . . 0.0 113.206 -168.435 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 1.2 pm0 -75.77 -29.85 58.93 Favored 'General case' 0 N--CA 1.48 1.035 0 C-N-CA 123.615 0.766 . . . . 0.0 111.416 178.553 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 43.1 mt-30 -62.63 -29.04 70.33 Favored 'General case' 0 N--CA 1.491 1.605 0 CA-C-N 118.227 0.467 . . . . 0.0 110.705 172.538 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.43 ' HA ' HD23 ' A' ' 39' ' ' LEU . 42.1 mt -72.85 -39.61 66.38 Favored 'General case' 0 N--CA 1.472 0.662 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.49 174.798 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 47.5 mtm105 -71.68 -20.23 61.96 Favored 'General case' 0 N--CA 1.478 0.945 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.967 176.444 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 46.9 t -64.23 123.25 18.63 Favored 'General case' 0 C--O 1.238 0.494 0 C-N-CA 123.455 0.702 . . . . 0.0 110.334 179.819 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 33.4 mt-10 -62.58 -19.22 63.48 Favored 'General case' 0 CA--C 1.547 0.836 0 C-N-CA 124.484 1.114 . . . . 0.0 111.512 178.909 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 82.9 mt-30 -61.8 -50.29 72.91 Favored 'General case' 0 N--CA 1.472 0.633 0 C-N-CA 124.37 1.068 . . . . 0.0 110.341 176.487 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . 0.43 HD23 ' HA ' ' A' ' 34' ' ' LEU . 62.1 tp -72.62 123.67 89.83 Favored Pre-proline 0 CA--C 1.55 0.948 0 CA-C-N 115.396 -0.82 . . . . 0.0 109.783 -178.917 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 39.9 Cg_exo -61.7 149.43 89.97 Favored 'Trans proline' 0 C--N 1.378 2.095 0 C-N-CA 123.157 2.571 . . . . 0.0 113.532 175.105 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 41' ' ' LYS . . . . . 0.633 ' HG2' ' HD3' ' A' ' 75' ' ' LYS . 42.4 mtpt -67.01 -43.51 82.68 Favored 'General case' 0 N--CA 1.477 0.897 0 C-N-CA 124.321 1.048 . . . . 0.0 110.211 179.05 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 11.9 ptmm? -56.18 -36.63 68.57 Favored 'General case' 0 N--CA 1.476 0.859 0 C-N-CA 125.193 1.397 . . . . 0.0 112.864 179.458 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -64.87 -41.08 95.94 Favored 'General case' 0 N--CA 1.476 0.871 0 O-C-N 123.753 0.658 . . . . 0.0 111.281 179.888 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 43.8 mt -67.35 -48.23 78.46 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.961 0 C-N-CA 122.927 0.491 . . . . 0.0 110.085 179.206 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 82.1 mt -59.5 -43.96 91.86 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.05 0 CA-C-N 115.529 -0.76 . . . . 0.0 110.795 -179.875 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 88.3 tttt -63.81 -37.61 88.03 Favored 'General case' 0 N--CA 1.476 0.864 0 O-C-N 123.972 0.795 . . . . 0.0 111.159 -179.859 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 37.8 t80 -63.51 -54.03 42.76 Favored 'General case' 0 N--CA 1.477 0.901 0 CA-C-N 115.266 -0.879 . . . . 0.0 110.638 176.185 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 86.6 mt -68.65 -30.74 69.5 Favored 'General case' 0 N--CA 1.478 0.94 0 C-N-CA 123.642 0.777 . . . . 0.0 111.892 -173.108 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . 0.578 ' HA ' HD21 ' A' ' 57' ' ' LEU . 3.5 pt20 -81.62 -26.6 34.72 Favored 'General case' 0 N--CA 1.483 1.185 0 N-CA-C 111.62 0.23 . . . . 0.0 111.62 -179.085 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 12.1 tp10 -62.07 -38.7 89.8 Favored 'General case' 0 N--CA 1.479 1.014 0 C-N-CA 123.7 0.8 . . . . 0.0 111.815 -179.118 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 16.5 p80 -122.09 -25.67 4.88 Favored 'General case' 0 N--CA 1.493 1.71 0 N-CA-C 112.814 0.672 . . . . 0.0 112.814 -175.832 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . 0.493 ' HA2' ' HA ' ' A' ' 91' ' ' PHE . . . -61.54 139.58 47.12 Favored Glycine 0 C--N 1.347 1.145 0 CA-C-O 119.628 -0.54 . . . . 0.0 112.374 173.761 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 53' ' ' SER . . . . . 0.476 ' O ' ' HG ' ' A' ' 57' ' ' LEU . 28.7 t -63.57 151.88 40.26 Favored 'General case' 0 N--CA 1.481 1.084 0 C-N-CA 123.523 0.729 . . . . 0.0 111.476 -179.008 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 26.9 t70 -55.45 -37.04 67.2 Favored 'General case' 0 N--CA 1.483 1.189 0 O-C-N 124.309 1.006 . . . . 0.0 111.727 178.046 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 46.0 m -66.13 -42.19 89.45 Favored 'General case' 0 CA--C 1.543 0.71 0 O-C-N 123.84 0.712 . . . . 0.0 111.142 177.312 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 56' ' ' PHE . . . . . 0.43 ' HB2' ' HB3' ' A' ' 90' ' ' ARG . 27.6 t80 -60.57 -41.86 95.48 Favored 'General case' 0 N--CA 1.482 1.174 0 C-N-CA 123.714 0.805 . . . . 0.0 110.365 174.497 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . 0.578 HD21 ' HA ' ' A' ' 49' ' ' GLN . 65.0 mt -69.95 -37.73 75.92 Favored 'General case' 0 N--CA 1.47 0.539 0 CA-C-N 115.514 -0.767 . . . . 0.0 111.079 -176.815 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -67.38 -49.2 64.91 Favored 'General case' 0 N--CA 1.482 1.142 0 C-N-CA 123.332 0.653 . . . . 0.0 110.865 -179.74 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 47.1 mt-10 -59.87 -32.04 70.34 Favored 'General case' 0 N--CA 1.477 0.885 0 CA-C-N 115.318 -0.855 . . . . 0.0 111.96 178.183 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 41.1 m80 -116.13 14.39 15.95 Favored 'General case' 0 N--CA 1.485 1.278 0 N-CA-C 112.881 0.697 . . . . 0.0 112.881 -174.805 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 57.6 mttp 57.07 20.6 5.62 Favored 'General case' 0 N--CA 1.498 1.962 0 N-CA-C 114.167 1.173 . . . . 0.0 114.167 172.995 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 94.9 mt -83.64 -10.7 58.04 Favored 'General case' 0 N--CA 1.482 1.172 0 C-N-CA 122.822 0.449 . . . . 0.0 111.951 -174.847 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 2.5 pp -81.96 176.33 9.64 Favored 'General case' 0 N--CA 1.481 1.112 0 CA-C-O 121.31 0.576 . . . . 0.0 111.144 175.481 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 90.17 -148.9 19.97 Favored Glycine 0 C--N 1.336 0.583 0 CA-C-N 114.686 -1.143 . . . . 0.0 111.823 177.973 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 9.8 m120 -77.03 119.77 21.22 Favored 'General case' 0 N--CA 1.468 0.441 0 N-CA-C 108.68 -0.859 . . . . 0.0 108.68 176.283 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 64.1 mt -54.08 -48.06 65.49 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.051 0 C-N-CA 123.709 0.804 . . . . 0.0 110.157 178.698 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 61.3 pttt -54.12 -38.75 65.75 Favored 'General case' 0 N--CA 1.485 1.293 0 C-N-CA 124.022 0.929 . . . . 0.0 112.461 178.563 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 8.1 t30 -68.32 -45.64 72.41 Favored 'General case' 0 N--CA 1.478 0.941 0 C-N-CA 123.319 0.647 . . . . 0.0 110.692 179.524 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 69' ' ' VAL . . . . . 0.445 ' HA ' HG22 ' A' ' 72' ' ' THR . 44.9 t -71.94 -31.88 42.22 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.974 0 CA-C-N 115.58 -0.737 . . . . 0.0 110.714 -178.075 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -73.09 -14.94 61.49 Favored 'General case' 0 N--CA 1.479 1.007 0 C-N-CA 123.697 0.799 . . . . 0.0 112.212 -177.413 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 16.8 ptpt -99.3 -48.78 4.69 Favored 'General case' 0 CA--C 1.547 0.851 0 CA-C-N 118.11 0.414 . . . . 0.0 111.41 170.605 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 72' ' ' THR . . . . . 0.445 HG22 ' HA ' ' A' ' 69' ' ' VAL . 7.6 t -73.39 -35.34 65.89 Favored 'General case' 0 N--CA 1.487 1.419 0 C-N-CA 122.937 0.495 . . . . 0.0 112.027 -171.157 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -100.92 130.55 46.94 Favored 'General case' 0 N--CA 1.472 0.669 0 C-N-CA 123.699 0.799 . . . . 0.0 109.425 177.485 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 74' ' ' ASN . . . . . 0.401 ' O ' ' HG ' ' A' ' 78' ' ' LEU . 29.1 p-10 -82.98 173.81 11.46 Favored 'General case' 0 N--CA 1.484 1.27 0 C-N-CA 123.491 0.716 . . . . 0.0 111.216 -174.45 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . 0.633 ' HD3' ' HG2' ' A' ' 41' ' ' LYS . 15.7 tptm -64.25 -39.8 94.7 Favored 'General case' 0 N--CA 1.477 0.898 0 C-N-CA 123.676 0.79 . . . . 0.0 111.176 -174.403 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 22.3 t70 -64.41 -38.41 90.93 Favored 'General case' 0 N--CA 1.482 1.142 0 C-N-CA 124.009 0.924 . . . . 0.0 111.053 -177.212 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 77' ' ' HIS . . . . . 0.424 ' HD2' HD23 ' A' ' 78' ' ' LEU . 33.0 t60 -55.39 -43.58 75.31 Favored 'General case' 0 N--CA 1.481 1.076 0 C-N-CA 124.696 1.198 . . . . 0.0 110.56 173.902 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . 0.424 HD23 ' HD2' ' A' ' 77' ' ' HIS . 25.5 mt -67.74 -40.26 84.15 Favored 'General case' 0 N--CA 1.477 0.894 0 C-N-CA 123.882 0.873 . . . . 0.0 111.103 -175.663 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 79' ' ' VAL . . . . . 0.414 HG23 ' O ' ' A' ' 75' ' ' LYS . 45.2 t -66.55 -45.01 89.79 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.821 0 C-N-CA 123.801 0.841 . . . . 0.0 110.118 179.276 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 33.1 m -60.72 -42.91 98.23 Favored 'General case' 0 N--CA 1.482 1.171 0 C-N-CA 123.599 0.76 . . . . 0.0 111.117 179.08 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -66.87 -39.9 87.69 Favored 'General case' 0 N--CA 1.476 0.868 0 C-N-CA 123.705 0.802 . . . . 0.0 110.992 178.87 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 82' ' ' TYR . . . . . 0.444 ' O ' ' HB3' ' A' ' 85' ' ' LEU . 5.5 t80 -56.67 -55.64 31.47 Favored 'General case' 0 C--O 1.218 -0.557 0 C-N-CA 124.663 1.185 . . . . 0.0 110.908 177.035 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 83' ' ' ASN . . . . . . . . . . . . . 59.7 m-80 -67.33 -40.51 85.91 Favored 'General case' 0 N--CA 1.486 1.352 0 C-N-CA 122.52 0.328 . . . . 0.0 111.143 -174.58 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 55.4 m170 -66.51 -24.3 66.37 Favored 'General case' 0 N--CA 1.483 1.222 0 C-N-CA 123.771 0.829 . . . . 0.0 111.612 177.415 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 85' ' ' LEU . . . . . 0.444 ' HB3' ' O ' ' A' ' 82' ' ' TYR . 53.9 tp -59.3 -54.73 43.44 Favored 'General case' 0 N--CA 1.479 0.982 0 CA-C-O 121.327 0.584 . . . . 0.0 110.822 175.16 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 45.0 m-85 -73.77 -30.4 62.75 Favored 'General case' 0 N--CA 1.475 0.777 0 CA-C-N 114.515 -1.22 . . . . 0.0 110.798 -176.627 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 44.3 tt0 -65.29 -24.6 67.34 Favored 'General case' 0 N--CA 1.482 1.137 0 C-N-CA 124.076 0.95 . . . . 0.0 112.48 -175.95 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 10.1 p -125.16 -4.2 7.44 Favored 'General case' 0 N--CA 1.478 0.949 0 C-N-CA 123.731 0.812 . . . . 0.0 110.921 177.765 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 94.3 mttt 56.23 49.75 14.73 Favored 'General case' 0 N--CA 1.485 1.293 0 C-N-CA 124.364 1.066 . . . . 0.0 111.48 -175.806 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 90' ' ' ARG . . . . . 0.43 ' HB3' ' HB2' ' A' ' 56' ' ' PHE . 54.4 mtt85 -68.95 -13.27 62.34 Favored 'General case' 0 N--CA 1.488 1.44 0 C-N-CA 124.791 1.237 . . . . 0.0 112.891 178.018 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 91' ' ' PHE . . . . . 0.493 ' HA ' ' HA2' ' A' ' 52' ' ' GLY . 4.2 p90 -68.14 139.96 56.16 Favored 'General case' 0 N--CA 1.475 0.816 0 C-N-CA 122.442 0.297 . . . . 0.0 110.787 175.295 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 C--O 1.256 1.406 0 C-N-CA 124.441 1.097 . . . . 0.0 108.286 172.357 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 27.7 ptt180 . . . . . 0 CA--C 1.543 0.683 0 CA-C-O 121.518 0.675 . . . . 0.0 110.457 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -74.84 -22.38 58.72 Favored 'General case' 0 CA--C 1.54 0.575 0 CA-C-N 114.912 -1.04 . . . . 0.0 112.668 -167.047 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 29' ' ' TRP . . . . . 0.421 ' HB3' ' HB2' ' A' ' 33' ' ' GLN . 3.9 m-90 -138.89 150.71 46.27 Favored 'General case' 0 N--CA 1.478 0.945 0 C-N-CA 123.829 0.852 . . . . 0.0 110.902 -168.529 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 37.7 p -90.4 173.78 7.92 Favored 'General case' 0 N--CA 1.471 0.593 0 CA-C-N 115.37 -0.832 . . . . 0.0 109.05 170.404 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . 0.524 ' HA ' HD12 ' A' ' 34' ' ' LEU . 10.5 p -59.29 -34.3 53.57 Favored 'Isoleucine or valine' 0 CA--C 1.557 1.248 0 C-N-CA 123.741 0.816 . . . . 0.0 112.362 -174.689 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 12.5 pt-20 -70.48 -35.67 73.41 Favored 'General case' 0 N--CA 1.481 1.098 0 C-N-CA 123.589 0.756 . . . . 0.0 111.028 176.816 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 33' ' ' GLN . . . . . 0.421 ' HB2' ' HB3' ' A' ' 29' ' ' TRP . 22.5 mm-40 -72.64 -30.4 64.27 Favored 'General case' 0 CA--C 1.546 0.803 0 C-N-CA 123.103 0.561 . . . . 0.0 110.798 176.184 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.54 ' HB3' HG22 ' A' ' 79' ' ' VAL . 93.1 mt -72.27 -37.78 68.98 Favored 'General case' 0 N--CA 1.476 0.839 0 C-N-CA 123.674 0.79 . . . . 0.0 112.287 -179.0 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 12.0 ptt180 -76.43 -22.56 54.5 Favored 'General case' 0 N--CA 1.479 1.019 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.275 176.508 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 41.5 t -58.39 109.91 0.87 Allowed 'General case' 0 C--N 1.356 0.859 0 O-C-N 124.017 0.823 . . . . 0.0 111.829 -173.593 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 9.9 pt-20 -62.27 -21.08 64.93 Favored 'General case' 0 N--CA 1.484 1.261 0 C-N-CA 124.771 1.228 . . . . 0.0 112.541 179.453 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 12.0 mm100 -67.85 -32.82 73.61 Favored 'General case' 0 N--CA 1.473 0.715 0 C-N-CA 123.941 0.896 . . . . 0.0 110.356 176.437 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 3.5 tt -73.38 127.59 88.71 Favored Pre-proline 0 CA--C 1.547 0.861 0 N-CA-C 108.024 -1.102 . . . . 0.0 108.024 175.866 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 53.0 Cg_exo -55.41 126.35 22.21 Favored 'Trans proline' 0 C--N 1.378 2.088 0 C-N-CA 122.546 2.164 . . . . 0.0 112.365 174.015 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 41' ' ' LYS . . . . . 0.756 ' HG2' ' HD3' ' A' ' 75' ' ' LYS . 35.9 mtmm -58.08 -37.78 75.13 Favored 'General case' 0 N--CA 1.48 1.069 0 C-N-CA 124.348 1.059 . . . . 0.0 110.483 177.58 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 18.8 ptpt -62.19 -35.9 80.25 Favored 'General case' 0 N--CA 1.472 0.626 0 CA-C-N 114.777 -1.101 . . . . 0.0 111.9 175.498 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 30.2 t70 -69.82 -32.72 71.3 Favored 'General case' 0 CA--C 1.545 0.757 0 C-N-CA 122.444 0.298 . . . . 0.0 110.82 -174.338 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 56.2 mt -66.57 -52.4 46.45 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.148 0 N-CA-C 109.575 -0.528 . . . . 0.0 109.575 174.217 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 45' ' ' ILE . . . . . 0.48 HD13 HG12 ' A' ' 69' ' ' VAL . 76.4 mt -58.49 -33.38 48.0 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.333 0 C-N-CA 124.451 1.1 . . . . 0.0 111.654 178.95 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 33.0 ttmt -61.68 -41.94 98.24 Favored 'General case' 0 N--CA 1.48 1.028 0 C-N-CA 124.394 1.078 . . . . 0.0 110.796 179.233 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 2.0 t80 -70.89 -37.66 73.01 Favored 'General case' 0 CA--C 1.548 0.884 0 CA-C-N 114.488 -1.233 . . . . 0.0 109.858 177.698 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . 0.483 HD21 ' HA ' ' A' ' 82' ' ' TYR . 93.1 mt -68.89 -31.84 71.05 Favored 'General case' 0 N--CA 1.476 0.862 0 C-N-CA 123.481 0.712 . . . . 0.0 112.488 -178.73 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . 0.568 ' HA ' HD21 ' A' ' 57' ' ' LEU . 3.8 pt20 -85.07 -28.03 25.91 Favored 'General case' 0 N--CA 1.479 1.012 0 C-N-CA 122.103 0.161 . . . . 0.0 111.393 176.081 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 42.7 tt0 -61.22 -35.17 76.48 Favored 'General case' 0 N--CA 1.479 1.007 0 O-C-N 123.767 0.667 . . . . 0.0 111.26 -178.176 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 59.7 m-70 -112.86 -44.68 3.27 Favored 'General case' 0 N--CA 1.469 0.524 0 CA-C-N 115.798 -0.637 . . . . 0.0 110.022 -179.066 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . 0.422 ' HA2' ' HA ' ' A' ' 91' ' ' PHE . . . -57.07 131.28 51.97 Favored Glycine 0 C--N 1.354 1.564 0 O-C-N 123.912 0.757 . . . . 0.0 114.318 -175.328 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 44.1 m -72.58 166.12 23.34 Favored 'General case' 0 CA--C 1.54 0.57 0 C-N-CA 124.07 0.948 . . . . 0.0 111.736 -177.159 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 23.3 t70 -54.17 -38.77 65.93 Favored 'General case' 0 N--CA 1.481 1.083 0 CA-C-N 115.001 -0.999 . . . . 0.0 112.574 -175.233 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 20.2 t -67.05 -37.98 85.04 Favored 'General case' 0 CA--C 1.55 0.966 0 O-C-N 123.55 0.531 . . . . 0.0 111.098 -179.532 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 56' ' ' PHE . . . . . 0.501 ' HD1' HH11 ' A' ' 90' ' ' ARG . 53.4 t80 -67.02 -41.04 87.3 Favored 'General case' 0 N--CA 1.486 1.332 0 C-N-CA 123.632 0.773 . . . . 0.0 110.109 176.049 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . 0.568 HD21 ' HA ' ' A' ' 49' ' ' GLN . 39.0 mt -69.56 -55.25 10.68 Favored 'General case' 0 N--CA 1.471 0.595 0 CA-C-N 115.829 -0.623 . . . . 0.0 110.666 -175.802 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -61.55 -29.1 69.79 Favored 'General case' 0 N--CA 1.487 1.386 0 C-N-CA 124.394 1.078 . . . . 0.0 112.742 -174.109 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 50.6 mt-10 -54.39 -45.64 72.94 Favored 'General case' 0 N--CA 1.484 1.246 0 C-N-CA 122.798 0.439 . . . . 0.0 111.497 174.508 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 37.5 t-80 -114.07 4.14 15.54 Favored 'General case' 0 N--CA 1.48 1.042 0 C-N-CA 122.845 0.458 . . . . 0.0 111.345 -176.104 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 32.5 mmtp 49.29 60.5 3.72 Favored 'General case' 0 N--CA 1.476 0.831 0 C-N-CA 124.672 1.189 . . . . 0.0 111.301 -171.867 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . 0.52 ' HA ' HG11 ' A' ' 69' ' ' VAL . 95.2 mt -85.17 -14.77 45.89 Favored 'General case' 0 N--CA 1.481 1.11 0 CA-C-N 115.013 -0.994 . . . . 0.0 110.214 174.417 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 1.1 pp -76.66 171.11 15.22 Favored 'General case' 0 CA--C 1.545 0.769 0 C-N-CA 124.098 0.959 . . . . 0.0 110.739 173.556 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 88.4 -146.62 19.62 Favored Glycine 0 C--N 1.341 0.821 0 CA-C-N 115.61 -0.723 . . . . 0.0 111.921 -179.922 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 65' ' ' ASN . . . . . 0.414 ' O ' HG23 ' A' ' 69' ' ' VAL . 38.8 m-80 -72.73 113.12 9.41 Favored 'General case' 0 N--CA 1.478 0.947 0 N-CA-C 108.578 -0.897 . . . . 0.0 108.578 175.228 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 17.9 mt -55.9 -39.63 57.98 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.208 0 O-C-N 124.266 0.979 . . . . 0.0 110.335 -177.5 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 60.9 pttt -60.9 -39.76 90.54 Favored 'General case' 0 N--CA 1.478 0.961 0 C-N-CA 124.928 1.291 . . . . 0.0 112.246 178.302 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 28.3 t-20 -73.86 -36.47 64.86 Favored 'General case' 0 N--CA 1.477 0.899 0 C-N-CA 123.704 0.802 . . . . 0.0 109.984 -177.061 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 69' ' ' VAL . . . . . 0.52 HG11 ' HA ' ' A' ' 62' ' ' LEU . 58.7 t -63.53 -45.55 97.46 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.622 0 CA-C-N 114.984 -1.007 . . . . 0.0 109.522 172.17 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -67.59 -17.95 64.81 Favored 'General case' 0 N--CA 1.477 0.925 0 C-N-CA 124.582 1.153 . . . . 0.0 112.363 -177.068 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 25.3 ttpp -76.43 -43.66 39.19 Favored 'General case' 0 CA--C 1.539 0.55 0 C-N-CA 123.122 0.569 . . . . 0.0 110.469 175.524 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 15.1 t -99.94 -9.6 22.61 Favored 'General case' 0 CA--C 1.558 1.286 0 C-N-CA 123.848 0.859 . . . . 0.0 113.092 -171.304 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -87.79 160.02 18.2 Favored 'General case' 0 N--CA 1.484 1.25 0 C-N-CA 123.257 0.623 . . . . 0.0 110.553 179.544 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 50.4 t30 -110.16 129.99 55.62 Favored 'General case' 0 N--CA 1.48 1.066 0 C-N-CA 124.3 1.04 . . . . 0.0 109.321 -175.822 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . 0.756 ' HD3' ' HG2' ' A' ' 41' ' ' LYS . 22.7 tptp -59.48 -40.23 86.29 Favored 'General case' 0 N--CA 1.492 1.652 0 C-N-CA 123.977 0.911 . . . . 0.0 112.165 -169.932 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 3.5 p30 -74.74 -29.02 61.02 Favored 'General case' 0 N--CA 1.484 1.257 0 O-C-N 123.227 0.329 . . . . 0.0 111.05 -177.347 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 27.7 t60 -73.47 -28.74 62.11 Favored 'General case' 0 CA--C 1.549 0.935 0 C-N-CA 123.005 0.522 . . . . 0.0 110.062 173.341 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 83.1 mt -65.47 -32.84 74.67 Favored 'General case' 0 N--CA 1.49 1.547 0 C-N-CA 122.918 0.487 . . . . 0.0 110.596 175.147 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 79' ' ' VAL . . . . . 0.54 HG22 ' HB3' ' A' ' 34' ' ' LEU . 40.8 t -62.18 -47.94 90.75 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.139 0 C-N-CA 124.193 0.997 . . . . 0.0 109.658 172.718 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 16.0 m -64.53 -48.13 76.22 Favored 'General case' 0 N--CA 1.47 0.548 0 CA-C-N 114.176 -1.374 . . . . 0.0 111.841 -175.785 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -67.55 -34.02 76.22 Favored 'General case' 0 N--CA 1.477 0.923 0 C-N-CA 123.766 0.826 . . . . 0.0 111.176 -177.601 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 82' ' ' TYR . . . . . 0.483 ' HA ' HD21 ' A' ' 48' ' ' LEU . 81.4 t80 -60.19 -54.95 39.72 Favored 'General case' 0 N--CA 1.469 0.519 0 C-N-CA 124.487 1.115 . . . . 0.0 110.669 177.788 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 83' ' ' ASN . . . . . . . . . . . . . 90.6 m-20 -69.77 -31.11 68.88 Favored 'General case' 0 CA--C 1.54 0.565 0 CA-C-N 114.847 -1.069 . . . . 0.0 110.574 -178.021 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 2.8 m-70 -70.32 -28.44 65.16 Favored 'General case' 0 N--CA 1.485 1.282 0 C-N-CA 123.576 0.75 . . . . 0.0 111.607 174.734 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 44.9 tp -60.29 -53.26 59.72 Favored 'General case' 0 N--CA 1.478 0.968 0 CA-C-O 121.739 0.781 . . . . 0.0 109.911 -178.724 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 86' ' ' PHE . . . . . 0.46 ' HA ' ' HE2' ' A' ' 91' ' ' PHE . 6.3 m-85 -75.48 -31.4 60.22 Favored 'General case' 0 CA--C 1.549 0.935 0 CA-C-N 113.771 -1.559 . . . . 0.0 111.079 -175.42 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 10.4 tp10 -69.16 -40.49 78.15 Favored 'General case' 0 N--CA 1.482 1.158 0 C-N-CA 124.103 0.961 . . . . 0.0 111.719 -173.436 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 37.0 p -109.56 2.8 20.61 Favored 'General case' 0 N--CA 1.484 1.256 0 C-N-CA 123.28 0.632 . . . . 0.0 111.689 -178.622 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 89' ' ' LYS . . . . . 0.453 ' HA ' ' CE2' ' A' ' 91' ' ' PHE . 48.7 mtpt 59.34 44.7 14.94 Favored 'General case' 0 N--CA 1.478 0.949 0 C-N-CA 124.391 1.076 . . . . 0.0 112.225 179.843 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 90' ' ' ARG . . . . . 0.501 HH11 ' HD1' ' A' ' 56' ' ' PHE . 20.5 mtt180 -67.94 -7.39 28.16 Favored 'General case' 0 N--CA 1.486 1.355 0 C-N-CA 124.426 1.09 . . . . 0.0 113.266 178.547 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 91' ' ' PHE . . . . . 0.46 ' HE2' ' HA ' ' A' ' 86' ' ' PHE . 36.7 p90 -77.67 161.91 27.41 Favored 'General case' 0 CA--C 1.541 0.603 0 C-N-CA 124.118 0.967 . . . . 0.0 111.651 171.622 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 61.7 tttm . . . . . 0 C--O 1.25 1.112 0 C-N-CA 124.177 0.991 . . . . 0.0 109.581 178.178 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 9.8 ptp85 . . . . . 0 CA--C 1.544 0.75 0 CA-C-O 120.944 0.402 . . . . 0.0 111.132 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -95.78 -15.85 22.29 Favored 'General case' 0 N--CA 1.476 0.871 0 C-N-CA 123.185 0.594 . . . . 0.0 110.936 -176.237 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 29' ' ' TRP . . . . . . . . . . . . . 8.5 m-90 -142.94 157.78 44.24 Favored 'General case' 0 N--CA 1.482 1.155 0 C-N-CA 123.983 0.913 . . . . 0.0 109.879 -174.623 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 11.9 m -82.49 161.71 22.29 Favored 'General case' 0 CA--C 1.549 0.928 0 N-CA-C 108.065 -1.087 . . . . 0.0 108.065 168.495 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . 0.553 ' HA ' HD12 ' A' ' 34' ' ' LEU . 4.6 p -52.92 -39.64 32.91 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.399 0 C-N-CA 123.924 0.89 . . . . 0.0 111.796 -179.757 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 11.4 pt-20 -66.39 -43.21 86.49 Favored 'General case' 0 N--CA 1.479 1.022 0 C-N-CA 124.716 1.206 . . . . 0.0 111.263 177.483 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 48.1 mt-30 -64.7 -32.68 74.46 Favored 'General case' 0 N--CA 1.477 0.923 0 C-N-CA 123.525 0.73 . . . . 0.0 110.935 -179.038 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.553 HD12 ' HA ' ' A' ' 31' ' ' VAL . 51.6 mt -66.36 -50.35 63.83 Favored 'General case' 0 N--CA 1.47 0.548 0 O-C-N 124.112 0.883 . . . . 0.0 110.965 176.012 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 29.8 mtp180 -68.72 -18.99 64.34 Favored 'General case' 0 N--CA 1.475 0.795 0 C-N-CA 124.38 1.072 . . . . 0.0 111.665 -178.139 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 46.6 t -60.34 123.85 18.52 Favored 'General case' 0 CA--C 1.544 0.742 0 O-C-N 123.657 0.598 . . . . 0.0 110.251 176.162 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -55.53 -28.94 57.76 Favored 'General case' 0 CA--C 1.549 0.935 0 C-N-CA 125.057 1.343 . . . . 0.0 112.981 -177.056 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 91.3 mt-30 -65.17 -34.97 79.66 Favored 'General case' 0 N--CA 1.48 1.041 0 C-N-CA 123.927 0.891 . . . . 0.0 112.362 -177.774 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . 0.432 HD23 ' HD2' ' A' ' 40' ' ' PRO . 1.2 tt -69.2 123.09 87.53 Favored Pre-proline 0 N--CA 1.488 1.433 0 N-CA-C 109.154 -0.684 . . . . 0.0 109.154 -178.904 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 40' ' ' PRO . . . . . 0.468 ' HB2' ' HG2' ' A' ' 42' ' ' LYS . 35.1 Cg_endo -62.82 128.95 24.57 Favored 'Trans proline' 0 C--N 1.37 1.709 0 C-N-CA 122.149 1.899 . . . . 0.0 112.02 173.278 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 35.9 mtmm -56.71 -36.7 69.98 Favored 'General case' 0 N--CA 1.483 1.186 0 C-N-CA 123.922 0.889 . . . . 0.0 111.671 178.603 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . 0.468 ' HG2' ' HB2' ' A' ' 40' ' ' PRO . 19.2 ptpt -58.9 -34.39 71.62 Favored 'General case' 0 N--CA 1.474 0.772 0 C-N-CA 124.015 0.926 . . . . 0.0 111.6 -177.856 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 3.4 t70 -73.47 -36.22 65.81 Favored 'General case' 0 CA--C 1.54 0.594 0 CA-C-N 115.457 -0.792 . . . . 0.0 109.707 -176.415 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 44' ' ' ILE . . . . . 0.437 ' HB ' HD13 ' A' ' 78' ' ' LEU . 38.1 mt -68.61 -46.79 79.4 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.927 0 CA-C-N 115.742 -0.663 . . . . 0.0 110.023 177.702 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 74.7 mt -55.52 -42.82 69.92 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.593 0 C-N-CA 123.754 0.821 . . . . 0.0 110.495 174.88 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 38.2 ttpt -59.24 -36.43 75.44 Favored 'General case' 0 CA--C 1.55 0.945 0 C-N-CA 124.516 1.126 . . . . 0.0 111.178 179.154 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 18.7 t80 -69.69 -47.72 62.2 Favored 'General case' 0 N--CA 1.48 1.057 0 CA-C-N 115.634 -0.712 . . . . 0.0 111.027 176.272 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 90.5 mt -71.82 -32.79 67.92 Favored 'General case' 0 N--CA 1.476 0.851 0 C-N-CA 123.935 0.894 . . . . 0.0 112.885 -171.588 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . 0.446 ' HA ' HD21 ' A' ' 57' ' ' LEU . 3.5 pt20 -82.44 -27.95 31.61 Favored 'General case' 0 N--CA 1.484 1.264 0 CA-C-N 117.747 0.249 . . . . 0.0 111.231 -179.989 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 9.9 tp10 -69.69 -33.66 72.86 Favored 'General case' 0 N--CA 1.475 0.79 0 C-N-CA 123.353 0.661 . . . . 0.0 110.797 -179.402 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 66.2 m80 -112.06 -43.15 3.61 Favored 'General case' 0 N--CA 1.474 0.756 0 CA-C-N 115.309 -0.86 . . . . 0.0 112.381 -171.182 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . 0.418 ' HA2' ' HA ' ' A' ' 91' ' ' PHE . . . -65.41 132.74 35.64 Favored Glycine 0 N--CA 1.47 0.923 0 CA-C-O 119.346 -0.696 . . . . 0.0 111.899 171.976 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 20.1 t -80.28 168.52 18.95 Favored 'General case' 0 N--CA 1.48 1.073 0 CA-C-N 117.342 0.571 . . . . 0.0 110.165 -178.074 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 6.2 p-10 -58.87 -34.61 71.8 Favored 'General case' 0 N--CA 1.488 1.463 0 C-N-CA 124.345 1.058 . . . . 0.0 113.661 -169.313 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 23.1 m -72.93 -24.99 60.88 Favored 'General case' 0 N--CA 1.484 1.249 0 C-N-CA 122.748 0.419 . . . . 0.0 111.733 -179.421 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 56' ' ' PHE . . . . . 0.479 ' HB2' ' HB3' ' A' ' 90' ' ' ARG . 63.9 t80 -75.68 -49.93 16.89 Favored 'General case' 0 C--O 1.241 0.641 0 C-N-CA 123.445 0.698 . . . . 0.0 109.264 169.002 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . 0.446 HD21 ' HA ' ' A' ' 49' ' ' GLN . 62.0 mt -59.72 -50.64 73.04 Favored 'General case' 0 C--O 1.211 -0.938 0 CA-C-N 114.879 -1.055 . . . . 0.0 112.068 -168.892 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -60.42 -38.64 84.7 Favored 'General case' 0 N--CA 1.482 1.169 0 C-N-CA 123.497 0.719 . . . . 0.0 112.215 -175.403 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 12.3 mm-40 -67.27 -23.25 65.66 Favored 'General case' 0 N--CA 1.478 0.939 0 C-N-CA 123.176 0.59 . . . . 0.0 112.114 179.297 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 88.1 m-70 -115.99 7.28 14.31 Favored 'General case' 0 N--CA 1.484 1.274 0 C-N-CA 123.554 0.742 . . . . 0.0 111.332 176.275 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 48.3 mtpt 47.33 44.81 16.49 Favored 'General case' 0 N--CA 1.488 1.472 0 C-N-CA 125.119 1.368 . . . . 0.0 112.948 -178.934 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 66.8 mt -94.04 -11.42 30.76 Favored 'General case' 0 N--CA 1.478 0.951 0 C-N-CA 124.04 0.936 . . . . 0.0 111.931 -179.07 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 1.4 pp -79.44 -178.06 6.09 Favored 'General case' 0 N--CA 1.484 1.254 0 CA-C-O 121.357 0.598 . . . . 0.0 111.793 178.762 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 77.35 -142.44 27.14 Favored Glycine 0 C--N 1.341 0.828 0 CA-C-N 114.827 -1.078 . . . . 0.0 112.17 177.557 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 79.3 m-20 -82.04 131.06 35.24 Favored 'General case' 0 N--CA 1.469 0.481 0 N-CA-C 109.173 -0.677 . . . . 0.0 109.173 177.866 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 69.8 mt -57.49 -40.47 74.85 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.055 0 C-N-CA 123.478 0.711 . . . . 0.0 110.568 179.519 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 38.8 mtmm -55.19 -48.22 74.14 Favored 'General case' 0 N--CA 1.485 1.285 0 C-N-CA 123.332 0.653 . . . . 0.0 111.69 177.01 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 68' ' ' ASN . . . . . 0.415 ' O ' HG22 ' A' ' 72' ' ' THR . 3.3 m-20 -54.46 -41.71 69.79 Favored 'General case' 0 N--CA 1.49 1.558 0 C-N-CA 123.742 0.817 . . . . 0.0 111.606 177.905 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 22.3 t -73.07 -38.77 56.16 Favored 'Isoleucine or valine' 0 CA--C 1.551 0.996 0 CA-C-N 115.648 -0.705 . . . . 0.0 110.454 179.396 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -73.78 -26.46 60.65 Favored 'General case' 0 N--CA 1.488 1.432 0 C-N-CA 123.485 0.714 . . . . 0.0 112.592 -173.254 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 22.4 ptmt -81.88 -18.66 43.0 Favored 'General case' 0 N--CA 1.485 1.293 0 C-N-CA 122.704 0.402 . . . . 0.0 111.817 -176.232 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 72' ' ' THR . . . . . 0.415 HG22 ' O ' ' A' ' 68' ' ' ASN . 9.5 t -118.42 -34.8 3.94 Favored 'General case' 0 N--CA 1.484 1.234 0 C-N-CA 123.146 0.578 . . . . 0.0 111.754 -174.56 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . 0.444 ' HB1' ' ND1' ' A' ' 77' ' ' HIS . . . -98.35 141.25 31.47 Favored 'General case' 0 N--CA 1.471 0.586 0 C-N-CA 123.455 0.702 . . . . 0.0 110.219 -174.332 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 74' ' ' ASN . . . . . 0.441 ' ND2' ' HB3' ' A' ' 76' ' ' ASP . 26.9 p-10 -97.25 175.5 6.25 Favored 'General case' 0 N--CA 1.474 0.761 0 C-N-CA 123.603 0.761 . . . . 0.0 111.014 -176.043 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . 0.461 ' O ' HG23 ' A' ' 79' ' ' VAL . 32.0 ttmt -70.06 -38.82 75.88 Favored 'General case' 0 CA--C 1.541 0.602 0 C-N-CA 123.958 0.903 . . . . 0.0 111.269 -177.357 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 76' ' ' ASP . . . . . 0.441 ' HB3' ' ND2' ' A' ' 74' ' ' ASN . 24.0 t70 -58.77 -37.14 75.63 Favored 'General case' 0 N--CA 1.488 1.467 0 C-N-CA 123.577 0.751 . . . . 0.0 110.929 179.022 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 77' ' ' HIS . . . . . 0.444 ' ND1' ' HB1' ' A' ' 73' ' ' ALA . 4.1 t-80 -59.09 -47.56 84.81 Favored 'General case' 0 N--CA 1.476 0.86 0 C-N-CA 124.543 1.137 . . . . 0.0 110.818 173.262 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . 0.437 HD13 ' HB ' ' A' ' 44' ' ' ILE . 70.7 mt -65.68 -41.33 92.56 Favored 'General case' 0 N--CA 1.477 0.898 0 C-N-CA 123.372 0.669 . . . . 0.0 111.58 -172.268 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 79' ' ' VAL . . . . . 0.539 HG22 ' HB3' ' A' ' 34' ' ' LEU . 45.7 t -67.14 -44.71 87.75 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.697 0 C-N-CA 123.985 0.914 . . . . 0.0 110.552 -179.243 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 99.6 m -59.33 -50.01 75.62 Favored 'General case' 0 N--CA 1.477 0.876 0 C-N-CA 123.535 0.734 . . . . 0.0 110.924 176.185 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -62.35 -38.02 87.91 Favored 'General case' 0 N--CA 1.477 0.895 0 C-N-CA 123.545 0.738 . . . . 0.0 111.028 179.618 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 82' ' ' TYR . . . . . 0.422 ' O ' ' HB3' ' A' ' 85' ' ' LEU . 7.6 t80 -56.31 -54.16 48.75 Favored 'General case' 0 N--CA 1.476 0.854 0 C-N-CA 124.867 1.267 . . . . 0.0 111.614 177.67 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 83' ' ' ASN . . . . . . . . . . . . . 64.7 m-80 -66.14 -45.71 80.07 Favored 'General case' 0 N--CA 1.483 1.182 0 C-N-CA 122.849 0.46 . . . . 0.0 110.524 -176.953 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 15.2 m-70 -64.58 -26.16 68.29 Favored 'General case' 0 N--CA 1.481 1.097 0 C-N-CA 124.096 0.958 . . . . 0.0 111.295 -179.35 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 85' ' ' LEU . . . . . 0.429 HD11 ' HB3' ' A' ' 91' ' ' PHE . 25.2 tp -58.18 -54.28 48.72 Favored 'General case' 0 N--CA 1.481 1.109 0 C-N-CA 123.679 0.792 . . . . 0.0 110.724 176.59 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 86' ' ' PHE . . . . . 0.402 ' HA ' ' HE2' ' A' ' 91' ' ' PHE . 8.8 m-85 -74.87 -30.59 61.37 Favored 'General case' 0 CA--C 1.544 0.713 0 CA-C-N 113.539 -1.664 . . . . 0.0 111.0 -176.873 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 10.9 tp10 -67.69 -32.5 73.2 Favored 'General case' 0 N--CA 1.475 0.811 0 C-N-CA 124.144 0.978 . . . . 0.0 111.476 -174.436 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 43.3 p -113.94 -9.07 13.07 Favored 'General case' 0 N--CA 1.477 0.923 0 C-N-CA 123.972 0.909 . . . . 0.0 110.982 179.806 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 52.6 mtpt 62.93 41.1 8.82 Favored 'General case' 0 N--CA 1.481 1.081 0 C-N-CA 124.492 1.117 . . . . 0.0 112.415 174.338 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 90' ' ' ARG . . . . . 0.479 ' HB3' ' HB2' ' A' ' 56' ' ' PHE . 54.2 mtt180 -76.82 -5.81 49.79 Favored 'General case' 0 N--CA 1.487 1.423 0 C-N-CA 124.189 0.996 . . . . 0.0 112.735 -178.893 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 91' ' ' PHE . . . . . 0.429 ' HB3' HD11 ' A' ' 85' ' ' LEU . 5.5 p90 -61.9 150.8 36.52 Favored 'General case' 0 N--CA 1.472 0.664 0 C-N-CA 123.041 0.536 . . . . 0.0 112.309 175.475 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 86.2 tttt . . . . . 0 CA--C 1.549 0.914 0 CA-C-N 114.819 -1.082 . . . . 0.0 109.631 -179.155 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.475 0.785 0 N-CA-C 112.566 0.58 . . . . 0.0 112.566 . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -89.68 -29.51 18.73 Favored 'General case' 0 CA--C 1.544 0.748 0 CA-C-N 115.888 -0.597 . . . . 0.0 109.423 174.125 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 29' ' ' TRP . . . . . . . . . . . . . 6.8 m-90 -141.12 160.59 39.76 Favored 'General case' 0 N--CA 1.487 1.418 0 C-N-CA 124.301 1.041 . . . . 0.0 110.018 -177.925 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 74.5 p -88.44 170.23 11.09 Favored 'General case' 0 N--CA 1.472 0.643 0 C-N-CA 123.172 0.589 . . . . 0.0 109.463 175.261 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . 0.5 ' HA ' HD12 ' A' ' 34' ' ' LEU . 14.5 p -62.22 -37.15 77.84 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.416 0 C-N-CA 123.154 0.582 . . . . 0.0 111.817 -173.143 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 9.9 pt-20 -70.32 -34.04 72.22 Favored 'General case' 0 N--CA 1.479 0.98 0 C-N-CA 124.167 0.987 . . . . 0.0 111.304 177.682 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 16.0 mm100 -70.82 -36.17 72.82 Favored 'General case' 0 N--CA 1.475 0.785 0 C-N-CA 122.809 0.444 . . . . 0.0 110.701 173.385 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.56 ' HA ' HD23 ' A' ' 39' ' ' LEU . 92.1 mt -66.07 -53.58 36.53 Favored 'General case' 0 N--CA 1.475 0.792 0 C-N-CA 123.195 0.598 . . . . 0.0 110.614 -177.383 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 9.7 ptp180 -66.35 -21.19 66.24 Favored 'General case' 0 N--CA 1.477 0.879 0 CA-C-N 115.071 -0.968 . . . . 0.0 111.742 -174.323 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 42.0 t -57.11 126.78 28.76 Favored 'General case' 0 C--N 1.354 0.766 0 C-N-CA 123.941 0.897 . . . . 0.0 110.84 176.372 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 16.4 mp0 -63.91 -32.92 74.61 Favored 'General case' 0 CA--C 1.544 0.741 0 C-N-CA 123.339 0.655 . . . . 0.0 110.864 -179.616 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 1.8 mp0 -78.2 0.65 24.26 Favored 'General case' 0 N--CA 1.478 0.959 0 C-N-CA 123.597 0.759 . . . . 0.0 112.318 179.237 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . 0.56 HD23 ' HA ' ' A' ' 34' ' ' LEU . 62.4 tp -97.96 111.22 58.64 Favored Pre-proline 0 C--O 1.248 0.996 0 N-CA-C 106.5 -1.667 . . . . 0.0 106.5 158.58 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 32.5 Cg_exo -58.02 135.48 68.92 Favored 'Trans proline' 0 C--N 1.382 2.303 0 C-N-CA 122.662 2.241 . . . . 0.0 112.459 -178.981 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 41' ' ' LYS . . . . . 0.577 ' HG2' ' HE3' ' A' ' 75' ' ' LYS . 53.7 mtpt -56.71 -37.57 71.12 Favored 'General case' 0 N--CA 1.476 0.861 0 C-N-CA 124.885 1.274 . . . . 0.0 111.372 179.675 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 18.1 ptpt -63.31 -32.16 73.5 Favored 'General case' 0 C--O 1.217 -0.622 0 O-C-N 124.117 0.886 . . . . 0.0 112.08 -178.2 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 2.5 m-20 -65.32 -41.17 94.26 Favored 'General case' 0 N--CA 1.487 1.376 0 CA-C-O 120.782 0.325 . . . . 0.0 110.868 176.187 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 57.7 mt -69.16 -50.48 52.5 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.887 0 C-N-CA 123.468 0.707 . . . . 0.0 110.34 -178.835 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 75.8 mt -62.02 -38.5 80.93 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.062 0 C-N-CA 123.513 0.725 . . . . 0.0 110.867 179.495 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -58.09 -50.34 73.8 Favored 'General case' 0 N--CA 1.482 1.141 0 N-CA-C 108.86 -0.793 . . . . 0.0 108.86 175.63 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 27.7 t80 -58.65 -51.92 67.86 Favored 'General case' 0 CA--C 1.548 0.866 0 O-C-N 124.515 1.135 . . . . 0.0 111.069 -178.813 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 92.6 mt -69.62 -30.55 68.3 Favored 'General case' 0 N--CA 1.475 0.803 0 C-N-CA 123.822 0.849 . . . . 0.0 112.203 -173.826 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 2.9 pt20 -82.07 -26.11 33.96 Favored 'General case' 0 N--CA 1.484 1.258 0 C-N-CA 122.384 0.273 . . . . 0.0 110.629 177.174 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 43.1 tt0 -68.71 -22.47 64.34 Favored 'General case' 0 N--CA 1.484 1.243 0 C-N-CA 124.07 0.948 . . . . 0.0 111.811 -177.69 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 56.5 p-80 -127.79 -26.53 2.93 Favored 'General case' 0 N--CA 1.487 1.406 0 N-CA-C 112.635 0.606 . . . . 0.0 112.635 178.013 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -66.57 138.82 36.26 Favored Glycine 0 C--N 1.344 1.007 0 CA-C-O 119.506 -0.608 . . . . 0.0 112.715 178.924 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 53' ' ' SER . . . . . 0.448 ' O ' ' HG ' ' A' ' 57' ' ' LEU . 47.4 t -65.77 147.25 53.68 Favored 'General case' 0 N--CA 1.478 0.933 0 N-CA-C 109.677 -0.49 . . . . 0.0 109.677 178.515 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 8.8 p-10 -61.58 -28.18 69.16 Favored 'General case' 0 N--CA 1.485 1.303 0 C-N-CA 123.529 0.732 . . . . 0.0 111.937 -174.872 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 42.0 p -62.85 -44.13 96.96 Favored 'General case' 0 CA--C 1.552 1.05 0 C-N-CA 124.371 1.068 . . . . 0.0 111.141 174.836 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 67.2 t80 -64.27 -45.78 86.58 Favored 'General case' 0 N--CA 1.482 1.146 0 C-N-CA 124.277 1.031 . . . . 0.0 109.733 174.185 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . 0.448 ' HG ' ' O ' ' A' ' 53' ' ' SER . 75.7 mt -63.6 -29.7 70.91 Favored 'General case' 0 C--O 1.214 -0.775 0 CA-C-N 114.415 -1.266 . . . . 0.0 111.161 -176.073 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -71.34 -47.96 53.27 Favored 'General case' 0 N--CA 1.475 0.788 0 C-N-CA 123.237 0.615 . . . . 0.0 110.884 176.189 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 41.0 mt-10 -58.35 -36.12 72.97 Favored 'General case' 0 N--CA 1.491 1.583 0 C-N-CA 123.907 0.883 . . . . 0.0 111.661 178.082 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 41.2 m-70 -107.42 -2.05 20.9 Favored 'General case' 0 N--CA 1.486 1.339 0 C-N-CA 123.465 0.706 . . . . 0.0 112.062 -174.454 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 95.8 mttt 54.33 38.61 29.77 Favored 'General case' 0 N--CA 1.492 1.648 0 C-N-CA 124.678 1.191 . . . . 0.0 112.775 -179.935 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 85.9 mt -88.26 -8.89 54.53 Favored 'General case' 0 N--CA 1.479 0.986 0 C-N-CA 123.15 0.58 . . . . 0.0 111.164 176.653 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -80.17 166.78 21.12 Favored 'General case' 0 N--CA 1.485 1.318 0 CA-C-O 120.917 0.389 . . . . 0.0 111.168 174.632 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 92.63 -168.76 30.8 Favored Glycine 0 C--N 1.34 0.799 0 CA-C-N 115.22 -0.9 . . . . 0.0 112.155 -179.477 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 16.0 m120 -60.79 120.43 10.11 Favored 'General case' 0 N--CA 1.472 0.626 0 C-N-CA 123.232 0.613 . . . . 0.0 109.668 179.306 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 26.9 mt -61.33 -47.9 91.36 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.766 0 C-N-CA 124.039 0.936 . . . . 0.0 111.65 -167.069 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.66 -31.85 72.8 Favored 'General case' 0 N--CA 1.487 1.4 0 C-N-CA 123.748 0.819 . . . . 0.0 111.369 177.615 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 6.0 t30 -69.89 -36.43 75.43 Favored 'General case' 0 N--CA 1.483 1.22 0 C-N-CA 124.429 1.092 . . . . 0.0 110.609 178.396 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 47.7 t -73.06 -34.98 46.97 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.925 0 CA-C-N 115.83 -0.623 . . . . 0.0 109.502 172.274 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -73.44 -6.7 47.99 Favored 'General case' 0 N--CA 1.477 0.922 0 C-N-CA 124.207 1.003 . . . . 0.0 113.062 -174.538 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 22.3 ptmt -97.5 -26.66 14.75 Favored 'General case' 0 N--CA 1.48 1.052 0 CA-C-N 118.507 0.594 . . . . 0.0 112.271 173.454 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 8.8 t -112.08 -36.72 5.27 Favored 'General case' 0 N--CA 1.484 1.236 0 N-CA-C 112.787 0.662 . . . . 0.0 112.787 -166.734 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -91.2 102.46 15.18 Favored 'General case' 0 N--CA 1.472 0.661 0 N-CA-C 107.927 -1.138 . . . . 0.0 107.927 177.558 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 74' ' ' ASN . . . . . 0.449 ' O ' ' HG ' ' A' ' 78' ' ' LEU . 9.4 p30 -65.96 167.67 9.35 Favored 'General case' 0 N--CA 1.486 1.35 0 C-N-CA 123.863 0.865 . . . . 0.0 112.093 -169.687 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . 0.577 ' HE3' ' HG2' ' A' ' 41' ' ' LYS . 4.7 tppp? -63.08 -41.32 99.39 Favored 'General case' 0 CA--C 1.55 0.965 0 C-N-CA 122.9 0.48 . . . . 0.0 112.257 -174.014 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 19.1 t70 -60.38 -36.92 79.18 Favored 'General case' 0 N--CA 1.492 1.674 0 C-N-CA 123.52 0.728 . . . . 0.0 110.817 178.561 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 77' ' ' HIS . . . . . 0.415 ' HB3' ' O ' ' A' ' 74' ' ' ASN . 29.9 t60 -63.78 -39.73 94.95 Favored 'General case' 0 N--CA 1.479 0.983 0 C-N-CA 125.257 1.423 . . . . 0.0 110.466 175.206 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . 0.449 ' HG ' ' O ' ' A' ' 74' ' ' ASN . 40.9 mt -70.42 -38.89 74.66 Favored 'General case' 0 N--CA 1.487 1.417 0 C-N-CA 123.427 0.691 . . . . 0.0 111.91 -177.742 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 69.1 t -64.52 -46.09 93.7 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.904 0 C-N-CA 123.994 0.918 . . . . 0.0 110.27 179.526 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 51.1 m -62.14 -42.63 99.43 Favored 'General case' 0 N--CA 1.479 0.986 0 C-N-CA 123.418 0.687 . . . . 0.0 111.259 177.497 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -62.74 -43.4 98.9 Favored 'General case' 0 N--CA 1.477 0.882 0 C-N-CA 123.585 0.754 . . . . 0.0 110.837 177.676 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 82' ' ' TYR . . . . . . . . . . . . . 17.4 t80 -52.92 -57.9 8.74 Favored 'General case' 0 N--CA 1.473 0.691 0 C-N-CA 124.754 1.221 . . . . 0.0 110.519 178.751 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 83' ' ' ASN . . . . . . . . . . . . . 52.9 m-80 -64.9 -43.9 91.33 Favored 'General case' 0 N--CA 1.481 1.092 0 N-CA-C 112.429 0.529 . . . . 0.0 112.429 -171.067 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 88.6 m-70 -70.88 -24.42 62.49 Favored 'General case' 0 N--CA 1.48 1.062 0 C-N-CA 123.687 0.795 . . . . 0.0 112.083 -178.397 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 17.3 tp -58.76 -53.45 58.19 Favored 'General case' 0 N--CA 1.485 1.279 0 CA-C-O 121.903 0.858 . . . . 0.0 110.888 175.859 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 86' ' ' PHE . . . . . 0.417 ' HA ' ' HE2' ' A' ' 91' ' ' PHE . 56.7 m-85 -72.81 -36.35 67.52 Favored 'General case' 0 C--O 1.234 0.261 0 CA-C-N 113.937 -1.483 . . . . 0.0 110.87 -178.419 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 40.2 tt0 -59.33 -48.85 80.09 Favored 'General case' 0 N--CA 1.473 0.692 0 O-C-N 124.008 0.817 . . . . 0.0 112.202 -171.835 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 19.0 p -109.99 16.32 21.98 Favored 'General case' 0 N--CA 1.475 0.808 0 C-N-CA 123.241 0.616 . . . . 0.0 111.542 -178.897 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 47.3 mmtm 57.61 37.66 27.55 Favored 'General case' 0 N--CA 1.488 1.447 0 C-N-CA 123.95 0.9 . . . . 0.0 111.98 170.743 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 52.6 mtt-85 -70.79 -8.32 51.54 Favored 'General case' 0 N--CA 1.482 1.136 0 C-N-CA 124.126 0.97 . . . . 0.0 112.78 -176.621 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 91' ' ' PHE . . . . . 0.417 ' HE2' ' HA ' ' A' ' 86' ' ' PHE . 13.9 p90 -76.98 157.19 31.39 Favored 'General case' 0 N--CA 1.469 0.491 0 C-N-CA 123.139 0.576 . . . . 0.0 111.499 173.747 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 11.7 tmtt? . . . . . 0 CA--C 1.544 0.733 0 N-CA-C 107.062 -1.458 . . . . 0.0 107.062 -179.502 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.475 0.804 0 CA-C-O 120.607 0.241 . . . . 0.0 111.572 . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -108.98 -39.47 5.29 Favored 'General case' 0 N--CA 1.476 0.839 0 C-N-CA 123.23 0.612 . . . . 0.0 110.551 179.941 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 29' ' ' TRP . . . . . . . . . . . . . 3.6 m-90 -128.92 144.98 51.34 Favored 'General case' 0 N--CA 1.481 1.079 0 C-N-CA 123.972 0.909 . . . . 0.0 109.023 -176.495 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 20.2 p -83.53 169.6 15.27 Favored 'General case' 0 N--CA 1.474 0.77 0 C-N-CA 122.947 0.499 . . . . 0.0 109.789 -178.519 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . 0.584 ' HA ' HD12 ' A' ' 34' ' ' LEU . 7.4 p -56.98 -34.9 45.76 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.378 0 C-N-CA 122.887 0.475 . . . . 0.0 111.737 -173.844 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 12.9 pt-20 -67.19 -41.18 86.3 Favored 'General case' 0 N--CA 1.474 0.742 0 C-N-CA 123.814 0.846 . . . . 0.0 111.457 177.251 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 12.9 mm-40 -68.9 -35.24 76.62 Favored 'General case' 0 N--CA 1.477 0.902 0 C-N-CA 123.328 0.651 . . . . 0.0 111.266 178.792 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.584 HD12 ' HA ' ' A' ' 31' ' ' VAL . 66.3 mt -65.73 -45.64 81.88 Favored 'General case' 0 N--CA 1.472 0.643 0 O-C-N 123.618 0.573 . . . . 0.0 111.0 -179.693 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 35' ' ' ARG . . . . . 0.404 ' HG2' HG21 ' A' ' 79' ' ' VAL . 93.0 mtt-85 -79.01 -15.86 57.67 Favored 'General case' 0 CA--C 1.546 0.815 0 CA-C-N 115.419 -0.81 . . . . 0.0 111.352 179.637 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 40.0 t -63.83 138.65 58.57 Favored 'General case' 0 N--CA 1.48 1.057 0 C-N-CA 123.235 0.614 . . . . 0.0 111.414 -179.597 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 12.4 pt-20 -65.65 -18.86 65.63 Favored 'General case' 0 CA--C 1.551 1.014 0 C-N-CA 124.563 1.145 . . . . 0.0 111.97 179.989 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 76.3 mt-30 -73.42 -51.36 17.53 Favored 'General case' 0 CA--C 1.54 0.568 0 C-N-CA 124.116 0.966 . . . . 0.0 111.072 -177.984 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 46.7 tp -70.62 120.43 78.8 Favored Pre-proline 0 N--CA 1.478 0.941 0 CA-C-O 118.702 -0.666 . . . . 0.0 110.399 -176.189 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 24.6 Cg_exo -63.61 138.83 66.65 Favored 'Trans proline' 0 C--N 1.385 2.451 0 C-N-CA 122.747 2.298 . . . . 0.0 112.059 -179.19 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 21.5 ptmt -69.84 -32.36 70.72 Favored 'General case' 0 CA--C 1.537 0.444 0 C-N-CA 123.585 0.754 . . . . 0.0 110.825 -177.335 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 21.6 pttp -70.61 -28.83 65.15 Favored 'General case' 0 N--CA 1.474 0.753 0 C-N-CA 123.527 0.731 . . . . 0.0 110.915 175.994 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 28.0 t70 -69.24 -36.5 77.25 Favored 'General case' 0 N--CA 1.477 0.896 0 C-N-CA 122.543 0.337 . . . . 0.0 110.298 176.194 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 47.8 mt -66.34 -53.57 35.02 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.988 0 C-N-CA 122.878 0.471 . . . . 0.0 109.979 176.551 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 86.7 mt -55.91 -39.98 59.97 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.388 0 C-N-CA 123.959 0.903 . . . . 0.0 111.162 179.746 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 40.1 ttmt -57.49 -45.53 84.78 Favored 'General case' 0 N--CA 1.473 0.694 0 C-N-CA 123.703 0.801 . . . . 0.0 110.891 178.591 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 11.8 t80 -63.73 -48.29 77.63 Favored 'General case' 0 N--CA 1.471 0.606 0 O-C-N 123.897 0.748 . . . . 0.0 110.357 177.843 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 85.3 mt -68.86 -31.19 69.96 Favored 'General case' 0 CA--C 1.544 0.746 0 C-N-CA 123.201 0.6 . . . . 0.0 112.314 -172.742 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . 0.413 ' HA ' HD21 ' A' ' 57' ' ' LEU . 3.2 pt20 -84.61 -36.36 22.07 Favored 'General case' 0 N--CA 1.484 1.25 0 N-CA-C 111.674 0.25 . . . . 0.0 111.674 179.79 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 12.6 tp10 -69.14 -39.17 78.99 Favored 'General case' 0 N--CA 1.481 1.125 0 CA-C-O 121.587 0.708 . . . . 0.0 110.252 179.781 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 3.0 t60 -93.43 -49.85 5.72 Favored 'General case' 0 N--CA 1.47 0.548 0 CA-C-N 114.63 -1.168 . . . . 0.0 110.467 -173.349 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . 0.473 ' HA2' ' HA ' ' A' ' 91' ' ' PHE . . . -65.0 144.9 48.76 Favored Glycine 0 C--N 1.349 1.262 0 O-C-N 123.527 0.517 . . . . 0.0 113.185 173.253 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 34.5 t -89.67 166.45 13.59 Favored 'General case' 0 CA--C 1.55 0.971 0 C-N-CA 123.744 0.817 . . . . 0.0 110.669 -178.494 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 48.7 m-20 -58.0 -36.16 72.26 Favored 'General case' 0 N--CA 1.494 1.757 0 C-N-CA 123.912 0.885 . . . . 0.0 112.978 -169.175 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 40.2 t -64.0 -31.59 72.83 Favored 'General case' 0 N--CA 1.476 0.847 0 C-N-CA 123.605 0.762 . . . . 0.0 111.493 -178.299 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 85.4 t80 -76.21 -45.7 31.85 Favored 'General case' 0 CA--C 1.546 0.825 0 C-N-CA 123.497 0.719 . . . . 0.0 110.282 171.285 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . 0.413 HD21 ' HA ' ' A' ' 49' ' ' GLN . 45.7 mt -65.03 -33.44 76.04 Favored 'General case' 0 N--CA 1.478 0.935 0 CA-C-N 115.175 -0.921 . . . . 0.0 112.845 -169.701 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -68.4 -48.53 64.46 Favored 'General case' 0 N--CA 1.475 0.784 0 C-N-CA 122.62 0.368 . . . . 0.0 110.475 178.739 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 10.0 mm-40 -62.31 -33.5 74.8 Favored 'General case' 0 N--CA 1.476 0.87 0 CA-C-N 115.771 -0.649 . . . . 0.0 111.045 -178.484 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 34.5 m-70 -105.99 4.33 29.29 Favored 'General case' 0 N--CA 1.479 0.99 0 C-N-CA 123.223 0.609 . . . . 0.0 112.297 -178.214 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 46.0 mmtm 56.14 28.2 12.67 Favored 'General case' 0 N--CA 1.498 1.933 0 C-N-CA 124.377 1.071 . . . . 0.0 113.164 174.855 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . 0.487 HD11 ' HB1' ' A' ' 81' ' ' ALA . 92.2 mt -88.43 -8.85 54.3 Favored 'General case' 0 N--CA 1.481 1.094 0 C-N-CA 123.609 0.763 . . . . 0.0 112.061 -178.214 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 1.4 pp -67.48 167.34 12.94 Favored 'General case' 0 N--CA 1.477 0.913 0 C-N-CA 122.92 0.488 . . . . 0.0 111.44 177.727 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 77.01 -154.81 43.62 Favored Glycine 0 C--N 1.338 0.674 0 CA-C-N 115.653 -0.703 . . . . 0.0 113.623 174.695 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 65' ' ' ASN . . . . . 0.414 ' O ' HG23 ' A' ' 69' ' ' VAL . 15.9 m120 -64.57 124.66 22.44 Favored 'General case' 0 N--CA 1.472 0.658 0 C-N-CA 123.698 0.799 . . . . 0.0 110.609 -176.952 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 49.7 mt -58.03 -45.83 88.1 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.974 0 C-N-CA 124.127 0.971 . . . . 0.0 110.546 -179.327 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 17.7 mtpp -51.46 -46.02 62.94 Favored 'General case' 0 N--CA 1.482 1.175 0 C-N-CA 124.642 1.177 . . . . 0.0 111.714 174.714 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 68' ' ' ASN . . . . . 0.447 ' O ' ' HG2' ' A' ' 71' ' ' LYS . 7.8 t30 -64.57 -40.77 96.16 Favored 'General case' 0 N--CA 1.478 0.943 0 C-N-CA 123.484 0.714 . . . . 0.0 111.02 -179.169 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 69' ' ' VAL . . . . . 0.414 HG23 ' O ' ' A' ' 65' ' ' ASN . 18.4 t -71.4 -32.14 45.59 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.094 0 CA-C-O 121.018 0.437 . . . . 0.0 110.038 178.074 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -76.55 -16.33 59.64 Favored 'General case' 0 N--CA 1.485 1.288 0 C-N-CA 123.635 0.774 . . . . 0.0 112.229 -177.122 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . 0.447 ' HG2' ' O ' ' A' ' 68' ' ' ASN . 20.0 ptmt -94.76 -17.35 22.25 Favored 'General case' 0 N--CA 1.479 1.003 0 C-N-CA 122.367 0.267 . . . . 0.0 111.521 178.925 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 13.1 t -114.29 -35.32 5.02 Favored 'General case' 0 N--CA 1.479 1.006 0 C-N-CA 122.89 0.476 . . . . 0.0 111.777 -172.087 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -99.59 119.66 38.42 Favored 'General case' 0 N--CA 1.47 0.544 0 C-N-CA 124.048 0.939 . . . . 0.0 109.702 -176.082 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 74' ' ' ASN . . . . . 0.401 ' O ' ' HG ' ' A' ' 78' ' ' LEU . 27.8 p-10 -74.67 169.7 17.29 Favored 'General case' 0 N--CA 1.481 1.096 0 C-N-CA 123.563 0.745 . . . . 0.0 111.226 -177.171 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 15.0 tptm -60.23 -39.05 85.29 Favored 'General case' 0 N--CA 1.481 1.081 0 C-N-CA 124.029 0.932 . . . . 0.0 110.929 -174.122 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 29.7 t70 -64.4 -38.46 91.11 Favored 'General case' 0 N--CA 1.475 0.793 0 C-N-CA 124.125 0.97 . . . . 0.0 111.338 -179.099 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 31.1 t60 -59.8 -37.43 79.11 Favored 'General case' 0 N--CA 1.481 1.084 0 C-N-CA 124.213 1.005 . . . . 0.0 110.446 176.492 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . 0.401 ' HG ' ' O ' ' A' ' 74' ' ' ASN . 27.2 mt -72.72 -35.36 67.56 Favored 'General case' 0 N--CA 1.478 0.931 0 CA-C-N 115.78 -0.645 . . . . 0.0 111.278 -174.954 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 79' ' ' VAL . . . . . 0.404 HG21 ' HG2' ' A' ' 35' ' ' ARG . 21.5 t -69.86 -40.72 79.23 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.69 0 C-N-CA 123.306 0.642 . . . . 0.0 109.712 175.11 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 43.3 m -57.73 -45.1 86.26 Favored 'General case' 0 N--CA 1.478 0.928 0 C-N-CA 123.783 0.833 . . . . 0.0 110.489 175.118 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 81' ' ' ALA . . . . . 0.487 ' HB1' HD11 ' A' ' 62' ' ' LEU . . . -66.48 -43.53 85.18 Favored 'General case' 0 CA--C 1.534 0.335 0 CA-C-N 115.719 -0.673 . . . . 0.0 110.927 -179.592 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 82' ' ' TYR . . . . . 0.551 ' HD1' HD22 ' A' ' 83' ' ' ASN . 18.4 t80 -53.67 -56.39 17.69 Favored 'General case' 0 CA--C 1.543 0.676 0 C-N-CA 124.079 0.952 . . . . 0.0 110.409 176.816 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 83' ' ' ASN . . . . . 0.551 HD22 ' HD1' ' A' ' 82' ' ' TYR . 0.9 OUTLIER -55.68 -51.24 67.94 Favored 'General case' 0 N--CA 1.489 1.493 0 C-N-CA 123.46 0.704 . . . . 0.0 111.081 -175.824 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 66.4 m-70 -70.43 -22.83 62.67 Favored 'General case' 0 CA--C 1.543 0.707 0 C-N-CA 124.553 1.141 . . . . 0.0 112.567 -175.771 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 42.4 tp -63.19 -55.32 26.08 Favored 'General case' 0 N--CA 1.483 1.212 0 CA-C-O 121.603 0.716 . . . . 0.0 110.986 177.96 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 86' ' ' PHE . . . . . 0.49 ' HA ' ' HE1' ' A' ' 91' ' ' PHE . 37.2 m-85 -75.86 -28.78 58.31 Favored 'General case' 0 N--CA 1.474 0.735 0 CA-C-N 114.101 -1.409 . . . . 0.0 111.83 -175.744 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 11.6 tp10 -68.61 -18.49 64.32 Favored 'General case' 0 N--CA 1.479 1.017 0 C-N-CA 123.12 0.568 . . . . 0.0 112.063 -176.343 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 18.1 p -129.04 -1.42 5.21 Favored 'General case' 0 N--CA 1.479 0.985 0 C-N-CA 123.761 0.824 . . . . 0.0 111.811 -179.722 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 73.1 mmtt 59.57 38.78 22.1 Favored 'General case' 0 N--CA 1.487 1.397 0 C-N-CA 124.558 1.143 . . . . 0.0 111.71 177.301 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 62.2 mtt180 -73.23 -11.04 60.37 Favored 'General case' 0 N--CA 1.49 1.556 0 C-N-CA 123.625 0.77 . . . . 0.0 112.765 -178.232 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 91' ' ' PHE . . . . . 0.49 ' HE1' ' HA ' ' A' ' 86' ' ' PHE . 50.3 p90 -81.88 156.24 24.91 Favored 'General case' 0 C--O 1.242 0.666 0 C-N-CA 123.244 0.618 . . . . 0.0 110.946 171.872 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 33.2 ttpt . . . . . 0 C--O 1.253 1.272 0 N-CA-C 107.425 -1.324 . . . . 0.0 107.425 170.671 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 CA--C 1.539 0.529 0 CA-C-O 120.904 0.383 . . . . 0.0 110.734 . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -78.82 -31.96 46.02 Favored 'General case' 0 N--CA 1.467 0.412 0 CA-C-N 115.452 -0.795 . . . . 0.0 109.643 176.243 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 29' ' ' TRP . . . . . . . . . . . . . 3.4 m-90 -129.25 142.67 50.78 Favored 'General case' 0 N--CA 1.463 0.192 0 C-N-CA 124.439 1.096 . . . . 0.0 109.043 -175.456 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 42.7 p -82.03 174.75 10.95 Favored 'General case' 0 N--CA 1.473 0.691 0 C-N-CA 123.085 0.554 . . . . 0.0 109.597 173.648 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 7.5 p -58.62 -39.01 74.61 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.328 0 C-N-CA 122.732 0.413 . . . . 0.0 111.423 -176.799 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 11.4 pt-20 -69.32 -39.43 78.21 Favored 'General case' 0 N--CA 1.48 1.074 0 C-N-CA 123.58 0.752 . . . . 0.0 111.53 178.311 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 52.9 mt-30 -63.56 -36.76 84.85 Favored 'General case' 0 N--CA 1.481 1.083 0 C-N-CA 122.888 0.475 . . . . 0.0 110.807 177.963 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 89.7 mt -60.94 -51.48 69.09 Favored 'General case' 0 N--CA 1.48 1.045 0 O-C-N 123.473 0.483 . . . . 0.0 109.866 176.878 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 43.7 mtm105 -65.36 -18.87 65.66 Favored 'General case' 0 C--N 1.353 0.74 0 CA-C-N 114.43 -1.259 . . . . 0.0 111.865 -175.718 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 44.8 t -56.47 123.91 16.38 Favored 'General case' 0 C--N 1.354 0.789 0 N-CA-C 109.649 -0.5 . . . . 0.0 109.649 173.316 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 28.9 mt-10 -57.98 -37.1 73.58 Favored 'General case' 0 N--CA 1.474 0.749 0 C-N-CA 124.452 1.101 . . . . 0.0 111.278 -177.854 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 74.7 mt-30 -64.25 -30.21 71.27 Favored 'General case' 0 N--CA 1.475 0.794 0 C-N-CA 123.79 0.836 . . . . 0.0 111.484 -178.14 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 4.1 tt -81.05 113.0 37.39 Favored Pre-proline 0 CA--C 1.549 0.935 0 N-CA-C 107.553 -1.277 . . . . 0.0 107.553 172.692 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 40' ' ' PRO . . . . . 0.546 ' HB2' ' HG2' ' A' ' 42' ' ' LYS . 11.3 Cg_exo -70.55 147.34 57.59 Favored 'Trans proline' 0 C--N 1.371 1.717 0 C-N-CA 122.906 2.404 . . . . 0.0 112.81 -179.222 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 52.4 mtmt -56.83 -29.11 62.49 Favored 'General case' 0 N--CA 1.478 0.951 0 C-N-CA 124.602 1.161 . . . . 0.0 112.23 177.026 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . 0.546 ' HG2' ' HB2' ' A' ' 40' ' ' PRO . 17.4 ptpt -66.3 -36.91 84.16 Favored 'General case' 0 N--CA 1.47 0.533 0 C-N-CA 123.342 0.657 . . . . 0.0 111.71 -179.754 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 43' ' ' ASP . . . . . 0.474 ' HA ' ' HE2' ' A' ' 46' ' ' LYS . 2.3 m-20 -67.16 -35.36 79.52 Favored 'General case' 0 N--CA 1.479 1.009 0 O-C-N 123.293 0.37 . . . . 0.0 111.229 178.948 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 44' ' ' ILE . . . . . 0.4 ' O ' ' HG ' ' A' ' 48' ' ' LEU . 37.6 mt -65.65 -54.12 31.43 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.748 0 O-C-N 123.708 0.63 . . . . 0.0 109.635 177.949 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 68.0 mt -58.02 -39.52 72.62 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.253 0 C-N-CA 123.489 0.716 . . . . 0.0 111.096 177.945 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 46' ' ' LYS . . . . . 0.474 ' HE2' ' HA ' ' A' ' 43' ' ' ASP . 36.5 ttpt -59.92 -43.24 95.0 Favored 'General case' 0 N--CA 1.478 0.956 0 C-N-CA 124.086 0.955 . . . . 0.0 110.88 179.301 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 22.5 t80 -64.4 -47.13 80.36 Favored 'General case' 0 CA--C 1.548 0.889 0 CA-C-N 114.962 -1.017 . . . . 0.0 110.947 176.874 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . 0.4 ' HG ' ' O ' ' A' ' 44' ' ' ILE . 87.3 mt -70.82 -30.53 66.99 Favored 'General case' 0 N--CA 1.472 0.665 0 CA-C-N 115.326 -0.852 . . . . 0.0 111.741 -174.723 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . 0.507 ' HA ' HD21 ' A' ' 57' ' ' LEU . 3.4 pt20 -84.15 -27.5 28.08 Favored 'General case' 0 N--CA 1.482 1.13 0 C-N-CA 122.639 0.375 . . . . 0.0 110.909 177.748 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 14.4 tp10 -56.72 -37.26 70.71 Favored 'General case' 0 N--CA 1.475 0.816 0 C-N-CA 124.167 0.987 . . . . 0.0 111.505 179.699 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 31.9 m80 -129.99 -21.59 2.98 Favored 'General case' 0 N--CA 1.476 0.83 0 N-CA-C 113.032 0.753 . . . . 0.0 113.032 -177.46 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -60.18 136.34 49.73 Favored Glycine 0 N--CA 1.474 1.204 0 CA-C-N 118.694 0.679 . . . . 0.0 112.818 176.27 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 53' ' ' SER . . . . . 0.425 ' O ' ' HG ' ' A' ' 57' ' ' LEU . 39.7 t -64.08 158.71 22.03 Favored 'General case' 0 N--CA 1.481 1.089 0 C-N-CA 123.618 0.767 . . . . 0.0 110.752 179.133 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 7.2 p-10 -66.14 -29.58 69.9 Favored 'General case' 0 N--CA 1.483 1.181 0 C-N-CA 123.37 0.668 . . . . 0.0 111.396 -171.853 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 42.1 t -71.85 -38.43 70.09 Favored 'General case' 0 N--CA 1.473 0.694 0 C-N-CA 123.555 0.742 . . . . 0.0 110.722 175.397 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 57.4 t80 -63.44 -44.35 94.79 Favored 'General case' 0 N--CA 1.479 0.995 0 N-CA-C 109.14 -0.689 . . . . 0.0 109.14 174.771 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . 0.507 HD21 ' HA ' ' A' ' 49' ' ' GLN . 62.0 mt -68.05 -31.65 71.45 Favored 'General case' 0 C--O 1.222 -0.345 0 CA-C-N 115.243 -0.889 . . . . 0.0 111.081 -178.599 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -71.19 -50.06 37.16 Favored 'General case' 0 N--CA 1.472 0.65 0 C-N-CA 123.001 0.52 . . . . 0.0 111.212 177.632 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 27.1 mm-40 -73.79 -16.41 61.16 Favored 'General case' 0 N--CA 1.477 0.912 0 N-CA-C 112.335 0.495 . . . . 0.0 112.335 -176.851 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 44.6 m-70 -114.19 1.18 14.46 Favored 'General case' 0 N--CA 1.489 1.48 0 C-N-CA 123.176 0.59 . . . . 0.0 111.74 176.8 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 74.6 mmtt 58.09 30.51 19.4 Favored 'General case' 0 N--CA 1.493 1.708 0 C-N-CA 124.613 1.165 . . . . 0.0 113.103 174.499 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . 0.444 HD11 ' HB1' ' A' ' 81' ' ' ALA . 65.6 mt -90.41 -6.96 54.32 Favored 'General case' 0 N--CA 1.487 1.394 0 C-N-CA 123.755 0.822 . . . . 0.0 111.988 -176.415 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -74.57 173.73 10.0 Favored 'General case' 0 N--CA 1.477 0.923 0 C-N-CA 123.06 0.544 . . . . 0.0 111.699 177.196 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 82.6 -165.84 44.75 Favored Glycine 0 C--O 1.246 0.868 0 CA-C-N 115.353 -0.839 . . . . 0.0 112.919 178.278 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 45.5 t-20 -68.2 125.09 25.28 Favored 'General case' 0 C--O 1.241 0.646 0 N-CA-C 109.014 -0.735 . . . . 0.0 109.014 176.884 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 66' ' ' ILE . . . . . 0.437 HD13 ' HB2' ' A' ' 46' ' ' LYS . 32.5 mt -58.5 -53.22 49.71 Favored 'Isoleucine or valine' 0 C--O 1.214 -0.811 0 O-C-N 124.317 1.01 . . . . 0.0 111.707 -169.885 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 22.9 pttp -59.41 -34.92 73.06 Favored 'General case' 0 N--CA 1.489 1.489 0 C-N-CA 123.886 0.875 . . . . 0.0 112.99 -172.051 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 47.9 t30 -65.4 -45.29 84.55 Favored 'General case' 0 N--CA 1.473 0.692 0 C-N-CA 123.452 0.701 . . . . 0.0 110.115 178.86 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 97.3 t -70.61 -43.44 77.63 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.787 0 CA-C-N 115.162 -0.926 . . . . 0.0 110.91 178.167 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -59.22 -50.56 73.54 Favored 'General case' 0 N--CA 1.479 1.009 0 C-N-CA 124.875 1.27 . . . . 0.0 112.603 -167.121 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 19.4 ptpt -55.53 -45.41 77.19 Favored 'General case' 0 CA--C 1.558 1.26 0 O-C-N 123.863 0.727 . . . . 0.0 112.063 -179.545 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 13.3 t -93.0 -9.72 38.83 Favored 'General case' 0 N--CA 1.479 1.01 0 C-N-CA 123.662 0.785 . . . . 0.0 111.874 -173.981 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -93.41 118.03 30.81 Favored 'General case' 0 N--CA 1.472 0.662 0 N-CA-C 108.62 -0.881 . . . . 0.0 108.62 173.306 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 29.2 p-10 -73.98 148.54 42.0 Favored 'General case' 0 C--O 1.239 0.535 0 N-CA-C 109.78 -0.452 . . . . 0.0 109.78 176.9 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 39.2 ttmt -63.94 -26.71 68.71 Favored 'General case' 0 CA--C 1.541 0.602 0 C-N-CA 123.559 0.744 . . . . 0.0 111.124 -174.435 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 28.3 t70 -59.74 -40.66 88.83 Favored 'General case' 0 CA--C 1.544 0.739 0 C-N-CA 124.272 1.029 . . . . 0.0 111.28 177.758 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 75.0 t60 -66.37 -39.34 89.05 Favored 'General case' 0 N--CA 1.474 0.77 0 C-N-CA 123.955 0.902 . . . . 0.0 110.086 175.66 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 29.7 mt -69.87 -36.46 75.5 Favored 'General case' 0 N--CA 1.481 1.1 0 C-N-CA 123.348 0.659 . . . . 0.0 112.009 -174.693 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 77.2 t -67.83 -42.83 86.3 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.668 0 C-N-CA 123.849 0.859 . . . . 0.0 109.659 177.295 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 51.5 m -61.09 -40.38 93.5 Favored 'General case' 0 CA--C 1.549 0.91 0 C-N-CA 122.882 0.473 . . . . 0.0 110.725 175.046 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 81' ' ' ALA . . . . . 0.444 ' HB1' HD11 ' A' ' 62' ' ' LEU . . . -65.82 -40.64 92.01 Favored 'General case' 0 N--CA 1.474 0.745 0 C-N-CA 123.497 0.719 . . . . 0.0 111.011 177.414 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 82' ' ' TYR . . . . . . . . . . . . . 13.9 t80 -58.59 -55.34 36.32 Favored 'General case' 0 CA--C 1.541 0.629 0 CA-C-N 114.532 -1.213 . . . . 0.0 110.989 179.206 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 83' ' ' ASN . . . . . . . . . . . . . 67.3 m-80 -64.7 -44.08 91.41 Favored 'General case' 0 N--CA 1.483 1.176 0 C-N-CA 122.454 0.302 . . . . 0.0 111.161 -174.129 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 25.2 m-70 -64.3 -26.63 68.57 Favored 'General case' 0 N--CA 1.485 1.315 0 C-N-CA 123.708 0.803 . . . . 0.0 111.845 179.155 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 85' ' ' LEU . . . . . 0.491 HD12 ' HB2' ' A' ' 90' ' ' ARG . 53.6 tp -58.34 -52.95 63.43 Favored 'General case' 0 N--CA 1.482 1.13 0 CA-C-O 121.219 0.533 . . . . 0.0 111.163 177.327 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 45.3 m-85 -75.61 -35.68 60.47 Favored 'General case' 0 N--CA 1.475 0.807 0 CA-C-N 115.041 -0.981 . . . . 0.0 111.65 -178.65 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 17.4 tp10 -60.29 -47.05 87.65 Favored 'General case' 0 N--CA 1.473 0.68 0 C-N-CA 124.162 0.985 . . . . 0.0 111.613 -172.516 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 7.6 p -117.04 11.84 14.38 Favored 'General case' 0 CA--C 1.548 0.87 0 C-N-CA 123.999 0.919 . . . . 0.0 111.236 -179.583 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 27.2 mtpp 55.14 56.8 6.11 Favored 'General case' 0 N--CA 1.486 1.336 0 C-N-CA 125.241 1.416 . . . . 0.0 112.251 168.604 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 90' ' ' ARG . . . . . 0.491 ' HB2' HD12 ' A' ' 85' ' ' LEU . 11.7 mmm180 -73.26 -16.81 61.38 Favored 'General case' 0 N--CA 1.484 1.266 0 CA-C-N 115.163 -0.926 . . . . 0.0 111.864 -176.971 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 91' ' ' PHE . . . . . . . . . . . . . 3.4 p90 -69.08 144.26 53.99 Favored 'General case' 0 CA--C 1.544 0.747 0 CA-C-O 121.631 0.729 . . . . 0.0 111.865 -179.533 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 6.7 mtpm? . . . . . 0 C--O 1.247 0.941 0 C-N-CA 125.379 1.472 . . . . 0.0 108.78 170.675 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.544 0.737 0 CA-C-O 120.867 0.365 . . . . 0.0 110.515 . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -85.72 -38.86 17.82 Favored 'General case' 0 N--CA 1.472 0.638 0 CA-C-N 115.841 -0.618 . . . . 0.0 109.372 179.127 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 29' ' ' TRP . . . . . . . . . . . . . 5.1 m-90 -137.34 154.54 50.02 Favored 'General case' 0 N--CA 1.476 0.828 0 C-N-CA 124.669 1.188 . . . . 0.0 108.636 178.649 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 77.2 p -85.82 173.16 10.22 Favored 'General case' 0 N--CA 1.477 0.901 0 N-CA-C 109.683 -0.488 . . . . 0.0 109.683 174.266 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 8.0 p -56.96 -40.8 74.8 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.139 0 C-N-CA 123.762 0.825 . . . . 0.0 111.766 -177.396 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 10.2 pt-20 -71.43 -37.51 71.43 Favored 'General case' 0 N--CA 1.476 0.835 0 C-N-CA 123.782 0.833 . . . . 0.0 111.563 179.377 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 49.9 mt-30 -66.33 -36.06 81.95 Favored 'General case' 0 N--CA 1.474 0.736 0 C-N-CA 123.023 0.529 . . . . 0.0 110.99 175.915 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.459 ' HB3' HG22 ' A' ' 79' ' ' VAL . 84.2 mt -65.05 -50.06 67.69 Favored 'General case' 0 N--CA 1.475 0.812 0 C-N-CA 123.21 0.604 . . . . 0.0 110.941 -179.788 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 35' ' ' ARG . . . . . 0.585 ' HA ' ' HD3' ' A' ' 75' ' ' LYS . 17.8 ptm180 -73.87 -14.89 61.15 Favored 'General case' 0 N--CA 1.477 0.923 0 CA-C-N 115.699 -0.682 . . . . 0.0 111.707 -178.325 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 47.7 t -56.56 129.46 40.96 Favored 'General case' 0 N--CA 1.478 0.944 0 C-N-CA 123.389 0.676 . . . . 0.0 111.043 179.242 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 33.5 mt-10 -67.67 -18.83 65.07 Favored 'General case' 0 N--CA 1.479 1.012 0 C-N-CA 124.353 1.061 . . . . 0.0 111.883 -177.659 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 13.7 mm100 -70.8 -28.29 64.54 Favored 'General case' 0 CA--C 1.542 0.645 0 C-N-CA 123.52 0.728 . . . . 0.0 111.309 175.406 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 4.6 tt -91.99 127.24 50.35 Favored Pre-proline 0 CA--C 1.561 1.38 0 N-CA-C 108.229 -1.026 . . . . 0.0 108.229 178.5 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 24.5 Cg_exo -68.8 -149.06 0.02 OUTLIER 'Trans proline' 0 C--N 1.378 2.117 0 C-N-CA 123.571 2.847 . . . . 0.0 113.524 171.512 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -122.83 -30.65 3.8 Favored 'General case' 0 N--CA 1.482 1.134 0 C-N-CA 123.526 0.731 . . . . 0.0 111.169 177.559 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . 0.526 ' HA ' HD12 ' A' ' 45' ' ' ILE . 19.3 pttp -61.03 -39.27 89.15 Favored 'General case' 0 N--CA 1.486 1.335 0 C-N-CA 123.899 0.88 . . . . 0.0 112.776 -171.799 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 15.4 p-10 -69.7 -32.75 71.52 Favored 'General case' 0 CA--C 1.544 0.735 0 C-N-CA 122.697 0.399 . . . . 0.0 111.372 176.678 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 42.3 mt -67.18 -44.1 88.02 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.357 0 C-N-CA 122.315 0.246 . . . . 0.0 110.343 176.378 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 45' ' ' ILE . . . . . 0.526 HD12 ' HA ' ' A' ' 42' ' ' LYS . 67.3 mt -55.33 -44.27 74.74 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.325 0 C-N-CA 123.506 0.722 . . . . 0.0 110.011 175.21 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 46' ' ' LYS . . . . . 0.429 ' O ' ' HB2' ' A' ' 50' ' ' GLU . 55.0 tttp -58.37 -44.63 88.94 Favored 'General case' 0 CA--C 1.542 0.67 0 O-C-N 124.213 0.946 . . . . 0.0 110.845 178.414 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 23.7 t80 -59.63 -49.47 77.63 Favored 'General case' 0 N--CA 1.483 1.218 0 O-C-N 123.773 0.671 . . . . 0.0 111.219 177.318 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 97.7 mt -70.0 -31.8 69.67 Favored 'General case' 0 CA--C 1.544 0.731 0 C-N-CA 123.579 0.752 . . . . 0.0 112.115 -174.472 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . 0.418 ' HA ' HD21 ' A' ' 57' ' ' LEU . 3.4 pt20 -84.23 -31.1 25.2 Favored 'General case' 0 N--CA 1.488 1.458 0 CA-C-N 117.711 0.232 . . . . 0.0 111.556 179.004 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . 0.429 ' HB2' ' O ' ' A' ' 46' ' ' LYS . 7.1 tp10 -63.9 -27.41 69.13 Favored 'General case' 0 N--CA 1.486 1.363 0 C-N-CA 124.168 0.987 . . . . 0.0 111.539 -175.576 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 52.0 m80 -120.95 -33.02 3.83 Favored 'General case' 0 N--CA 1.469 0.519 0 CA-C-N 115.072 -0.967 . . . . 0.0 111.422 -173.624 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -75.97 156.5 47.55 Favored Glycine 0 C--N 1.352 1.418 0 O-C-N 123.314 0.384 . . . . 0.0 113.597 -174.746 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 20.7 t -87.79 172.06 9.93 Favored 'General case' 0 N--CA 1.476 0.841 0 C-N-CA 123.583 0.753 . . . . 0.0 110.898 177.715 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 14.9 m-20 -60.27 -42.19 94.86 Favored 'General case' 0 N--CA 1.479 0.993 0 C-N-CA 124.436 1.094 . . . . 0.0 112.811 -171.206 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 32.9 t -70.42 -27.92 64.65 Favored 'General case' 0 N--CA 1.477 0.911 0 C-N-CA 123.299 0.64 . . . . 0.0 111.25 -176.545 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 56' ' ' PHE . . . . . 0.475 ' HD1' HH11 ' A' ' 90' ' ' ARG . 32.3 t80 -67.73 -46.22 72.79 Favored 'General case' 0 N--CA 1.482 1.155 0 CA-C-O 121.443 0.64 . . . . 0.0 110.085 174.149 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . 0.418 HD21 ' HA ' ' A' ' 49' ' ' GLN . 66.0 mt -69.97 -44.87 68.57 Favored 'General case' 0 CA--C 1.538 0.492 0 CA-C-N 114.81 -1.086 . . . . 0.0 110.577 -175.854 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -54.65 -24.44 21.62 Favored 'General case' 0 N--CA 1.484 1.26 0 C-N-CA 125.674 1.59 . . . . 0.0 113.399 -176.815 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 53.8 mt-10 -54.37 -51.35 65.08 Favored 'General case' 0 N--CA 1.482 1.144 0 C-N-CA 123.512 0.725 . . . . 0.0 111.354 -179.459 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 15.9 t60 -119.03 13.79 13.05 Favored 'General case' 0 N--CA 1.487 1.384 0 C-N-CA 122.697 0.399 . . . . 0.0 111.241 175.778 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 61.7 mttp 56.82 65.29 1.43 Allowed 'General case' 0 N--CA 1.478 0.931 0 C-N-CA 124.417 1.087 . . . . 0.0 111.175 -176.184 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . 0.55 ' HA ' HG11 ' A' ' 69' ' ' VAL . 77.9 mt -86.24 -9.5 56.38 Favored 'General case' 0 N--CA 1.477 0.921 0 C-N-CA 123.972 0.909 . . . . 0.0 110.042 176.767 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 1.5 pp -80.43 156.06 26.8 Favored 'General case' 0 CA--C 1.545 0.783 0 C-N-CA 124.303 1.041 . . . . 0.0 110.781 177.201 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 90.03 -149.69 20.51 Favored Glycine 0 C--N 1.34 0.79 0 CA-C-N 115.696 -0.684 . . . . 0.0 112.732 178.327 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 65' ' ' ASN . . . . . 0.451 ' O ' HG23 ' A' ' 69' ' ' VAL . 82.3 m-20 -65.05 113.45 3.92 Favored 'General case' 0 N--CA 1.48 1.025 0 C-N-CA 123.927 0.891 . . . . 0.0 110.427 -177.001 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 70.4 mt -59.44 -42.92 89.24 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.125 0 C-N-CA 123.928 0.891 . . . . 0.0 110.605 -176.591 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 17.9 mtpp -55.61 -47.62 76.24 Favored 'General case' 0 CA--C 1.545 0.757 0 C-N-CA 124.063 0.945 . . . . 0.0 111.208 177.643 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 68' ' ' ASN . . . . . 0.52 ' O ' ' HG2' ' A' ' 71' ' ' LYS . 7.0 t30 -61.8 -42.83 99.5 Favored 'General case' 0 N--CA 1.479 0.984 0 C-N-CA 123.599 0.759 . . . . 0.0 111.336 176.068 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 69' ' ' VAL . . . . . 0.55 HG11 ' HA ' ' A' ' 62' ' ' LEU . 87.9 t -68.93 -30.13 45.76 Favored 'Isoleucine or valine' 0 CA--C 1.554 1.109 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.856 -178.988 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -65.82 -8.12 19.91 Favored 'General case' 0 N--CA 1.492 1.652 0 N-CA-C 114.363 1.246 . . . . 0.0 114.363 -173.929 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . 0.52 ' HG2' ' O ' ' A' ' 68' ' ' ASN . 64.7 pttt -91.54 -24.47 19.61 Favored 'General case' 0 N--CA 1.483 1.198 0 C-N-CA 122.88 0.472 . . . . 0.0 111.328 178.593 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 6.9 t -111.9 -27.94 8.25 Favored 'General case' 0 N--CA 1.474 0.772 0 C-N-CA 123.584 0.754 . . . . 0.0 110.996 -176.465 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . 0.467 ' HB1' HD21 ' A' ' 78' ' ' LEU . . . -73.39 85.28 1.48 Allowed 'General case' 0 C--O 1.243 0.756 0 N-CA-C 108.586 -0.894 . . . . 0.0 108.586 178.435 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 7.6 p30 -73.92 142.93 45.93 Favored 'General case' 0 C--O 1.239 0.529 0 CA-C-N 113.559 -1.655 . . . . 0.0 109.023 179.347 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . 0.585 ' HD3' ' HA ' ' A' ' 35' ' ' ARG . 40.4 ttmt -60.49 -34.16 73.65 Favored 'General case' 0 CA--C 1.538 0.492 0 C-N-CA 124.383 1.073 . . . . 0.0 111.419 -174.294 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 27.8 t70 -58.04 -39.91 79.58 Favored 'General case' 0 N--CA 1.472 0.671 0 C-N-CA 123.626 0.77 . . . . 0.0 111.175 177.922 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 73.6 t60 -71.21 -42.42 68.97 Favored 'General case' 0 C--O 1.213 -0.856 0 C-N-CA 123.633 0.773 . . . . 0.0 110.253 176.186 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . 0.467 HD21 ' HB1' ' A' ' 73' ' ' ALA . 98.2 mt -67.36 -31.21 71.3 Favored 'General case' 0 N--CA 1.483 1.187 0 N-CA-C 113.051 0.76 . . . . 0.0 113.051 -170.893 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 79' ' ' VAL . . . . . 0.459 HG22 ' HB3' ' A' ' 34' ' ' LEU . 60.0 t -71.58 -46.55 62.41 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.782 0 C-N-CA 123.407 0.683 . . . . 0.0 109.66 174.335 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 34.9 m -63.73 -32.38 73.86 Favored 'General case' 0 N--CA 1.477 0.877 0 CA-C-N 115.431 -0.804 . . . . 0.0 110.921 176.775 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -74.96 -37.52 61.93 Favored 'General case' 0 N--CA 1.473 0.713 0 C-N-CA 124.183 0.993 . . . . 0.0 110.358 179.639 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 82' ' ' TYR . . . . . . . . . . . . . 35.7 t80 -55.25 -55.22 33.87 Favored 'General case' 0 N--CA 1.472 0.673 0 C-N-CA 124.428 1.091 . . . . 0.0 109.954 173.676 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 83' ' ' ASN . . . . . . . . . . . . . 68.5 m-80 -64.59 -41.68 96.09 Favored 'General case' 0 N--CA 1.482 1.133 0 C-N-CA 122.639 0.376 . . . . 0.0 110.842 -178.396 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 16.6 t-160 -67.47 -27.45 67.03 Favored 'General case' 0 N--CA 1.485 1.28 0 C-N-CA 124.037 0.935 . . . . 0.0 110.787 -178.684 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -59.72 -53.05 62.53 Favored 'General case' 0 N--CA 1.48 1.075 0 C-N-CA 124.182 0.993 . . . . 0.0 109.822 -179.448 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 32.2 m-85 -74.08 -28.28 61.31 Favored 'General case' 0 CA--C 1.547 0.849 0 CA-C-N 114.22 -1.354 . . . . 0.0 111.462 -179.963 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 9.4 tm-20 -73.19 -26.76 61.29 Favored 'General case' 0 N--CA 1.48 1.058 0 C-N-CA 124.149 0.979 . . . . 0.0 111.498 -174.345 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 23.0 p -116.79 -7.16 11.51 Favored 'General case' 0 N--CA 1.479 0.98 0 C-N-CA 123.315 0.646 . . . . 0.0 111.403 178.05 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 41.5 mtmt 59.79 35.29 22.03 Favored 'General case' 0 N--CA 1.487 1.387 0 C-N-CA 124.197 0.999 . . . . 0.0 111.901 175.212 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 90' ' ' ARG . . . . . 0.475 HH11 ' HD1' ' A' ' 56' ' ' PHE . 99.4 mtt180 -62.91 -15.74 56.39 Favored 'General case' 0 N--CA 1.49 1.569 0 N-CA-C 113.562 0.949 . . . . 0.0 113.562 -173.26 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 91' ' ' PHE . . . . . . . . . . . . . 21.9 p90 -71.37 162.08 30.02 Favored 'General case' 0 C--N 1.321 -0.654 0 C-N-CA 123.722 0.809 . . . . 0.0 111.904 172.645 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 1.4 tmtp? . . . . . 0 C--O 1.243 0.734 0 N-CA-C 105.668 -1.975 . . . . 0.0 105.668 167.294 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 36.0 ttp180 . . . . . 0 CA--C 1.534 0.334 0 N-CA-C 108.542 -0.91 . . . . 0.0 108.542 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -89.64 -18.02 27.29 Favored 'General case' 0 CA--C 1.543 0.703 0 CA-C-N 114.324 -1.307 . . . . 0.0 111.751 -172.498 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 29' ' ' TRP . . . . . . . . . . . . . 5.7 m-90 -130.51 139.25 50.51 Favored 'General case' 0 N--CA 1.473 0.718 0 C-N-CA 123.856 0.863 . . . . 0.0 109.792 -174.221 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 73.8 p -80.27 167.31 20.44 Favored 'General case' 0 C--O 1.242 0.702 0 N-CA-C 108.329 -0.989 . . . . 0.0 108.329 171.796 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . 0.579 ' HA ' HD12 ' A' ' 34' ' ' LEU . 9.5 p -62.81 -30.04 48.51 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.89 0 CA-C-N 117.572 0.169 . . . . 0.0 111.376 -174.946 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 9.9 pt-20 -68.76 -40.49 79.72 Favored 'General case' 0 C--N 1.359 0.981 0 C-N-CA 123.067 0.547 . . . . 0.0 110.706 175.185 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 52.6 mt-30 -64.14 -41.71 97.09 Favored 'General case' 0 N--CA 1.482 1.148 0 C-N-CA 123.002 0.521 . . . . 0.0 110.599 178.151 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.579 HD12 ' HA ' ' A' ' 31' ' ' VAL . 84.3 mt -60.29 -52.99 62.91 Favored 'General case' 0 N--CA 1.47 0.555 0 O-C-N 124.361 1.038 . . . . 0.0 111.219 -178.539 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 16.6 ptm180 -72.74 -23.19 60.81 Favored 'General case' 0 N--CA 1.475 0.818 0 O-C-N 124.418 1.074 . . . . 0.0 110.768 -175.876 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 24.7 t -63.19 123.3 18.28 Favored 'General case' 0 C--N 1.356 0.853 0 C-N-CA 123.032 0.533 . . . . 0.0 110.291 -177.788 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 12.0 pt-20 -65.01 -21.01 66.78 Favored 'General case' 0 N--CA 1.474 0.754 0 C-N-CA 123.858 0.863 . . . . 0.0 112.521 -177.653 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 94.8 mt-30 -68.56 -26.91 65.65 Favored 'General case' 0 CA--C 1.542 0.655 0 C-N-CA 123.749 0.82 . . . . 0.0 110.905 177.265 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 60.5 tp -83.14 117.97 70.23 Favored Pre-proline 0 N--CA 1.478 0.942 0 N-CA-C 108.363 -0.976 . . . . 0.0 108.363 169.511 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 40' ' ' PRO . . . . . 0.603 ' HB2' ' HG2' ' A' ' 42' ' ' LYS . 30.1 Cg_endo -64.01 141.23 76.21 Favored 'Trans proline' 0 C--N 1.376 2.004 0 C-N-CA 122.175 1.916 . . . . 0.0 112.254 176.414 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 50.5 mtmt -61.24 -32.68 72.47 Favored 'General case' 0 N--CA 1.474 0.748 0 C-N-CA 124.203 1.001 . . . . 0.0 111.026 178.832 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . 0.603 ' HG2' ' HB2' ' A' ' 40' ' ' PRO . 17.8 ptpt -65.99 -31.52 72.46 Favored 'General case' 0 N--CA 1.469 0.517 0 C-N-CA 123.858 0.863 . . . . 0.0 111.021 -179.568 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 43' ' ' ASP . . . . . 0.603 ' HB2' ' HG2' ' A' ' 40' ' ' PRO . 2.4 t70 -67.05 -38.05 85.13 Favored 'General case' 0 N--CA 1.481 1.089 0 N-CA-C 109.391 -0.596 . . . . 0.0 109.391 -178.246 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 44' ' ' ILE . . . . . 0.518 ' O ' ' HG ' ' A' ' 48' ' ' LEU . 23.6 mt -67.34 -53.93 28.3 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.765 0 CA-C-N 115.17 -0.923 . . . . 0.0 109.705 177.411 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 73.8 mt -60.09 -36.18 66.03 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.733 0 C-N-CA 123.655 0.782 . . . . 0.0 111.955 -178.453 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 33.8 ttpt -53.86 -45.19 70.91 Favored 'General case' 0 N--CA 1.48 1.052 0 C-N-CA 124.364 1.066 . . . . 0.0 110.479 174.314 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 31.9 t80 -67.51 -45.62 75.26 Favored 'General case' 0 CA--C 1.551 1.0 0 CA-C-N 114.353 -1.294 . . . . 0.0 111.442 177.384 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . 0.518 ' HG ' ' O ' ' A' ' 44' ' ' ILE . 73.9 mt -65.55 -34.25 77.81 Favored 'General case' 0 N--CA 1.477 0.923 0 C-N-CA 123.857 0.863 . . . . 0.0 111.673 -172.903 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . 0.464 ' HA ' HD21 ' A' ' 57' ' ' LEU . 3.4 pt20 -83.92 -28.03 28.16 Favored 'General case' 0 N--CA 1.481 1.081 0 C-N-CA 122.637 0.375 . . . . 0.0 110.766 176.004 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 11.5 tp10 -61.83 -48.91 78.47 Favored 'General case' 0 N--CA 1.482 1.134 0 C-N-CA 123.699 0.8 . . . . 0.0 110.73 179.1 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 1.1 m80 -140.59 22.86 2.32 Favored 'General case' 0 N--CA 1.482 1.135 0 N-CA-C 113.203 0.816 . . . . 0.0 113.203 -171.23 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -84.99 -144.18 6.76 Favored Glycine 0 CA--C 1.534 1.243 0 N-CA-C 109.375 -1.49 . . . . 0.0 109.375 157.467 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 53' ' ' SER . . . . . 0.461 ' O ' ' HG ' ' A' ' 57' ' ' LEU . 28.1 t -149.67 162.68 39.75 Favored 'General case' 0 N--CA 1.478 0.932 0 CA-C-N 117.59 0.695 . . . . 0.0 109.847 174.77 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 4.0 p30 -52.48 -36.04 54.07 Favored 'General case' 0 N--CA 1.487 1.377 0 C-N-CA 124.485 1.114 . . . . 0.0 112.988 -174.424 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 20.4 m -70.69 -43.43 69.04 Favored 'General case' 0 CA--C 1.546 0.791 0 C-N-CA 123.706 0.802 . . . . 0.0 110.762 179.623 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 56' ' ' PHE . . . . . 0.42 ' HE2' ' HB3' ' A' ' 48' ' ' LEU . 66.2 t80 -60.41 -38.92 85.56 Favored 'General case' 0 N--CA 1.483 1.196 0 C-N-CA 124.16 0.984 . . . . 0.0 110.348 174.474 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . 0.464 HD21 ' HA ' ' A' ' 49' ' ' GLN . 51.6 mt -73.9 -32.49 63.6 Favored 'General case' 0 C--O 1.211 -0.936 0 CA-C-N 115.012 -0.994 . . . . 0.0 110.485 -178.983 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -69.92 -47.15 63.55 Favored 'General case' 0 N--CA 1.483 1.18 0 C-N-CA 123.334 0.654 . . . . 0.0 111.391 179.024 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 42.2 mt-10 -55.15 -47.11 75.58 Favored 'General case' 0 N--CA 1.486 1.364 0 C-N-CA 123.631 0.773 . . . . 0.0 111.003 179.196 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 28.6 m80 -107.76 4.68 25.88 Favored 'General case' 0 CA--C 1.543 0.705 0 CA-C-N 115.583 -0.735 . . . . 0.0 111.871 -170.088 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 48.9 mtmt 55.73 39.24 30.81 Favored 'General case' 0 N--CA 1.492 1.639 0 C-N-CA 123.91 0.884 . . . . 0.0 111.824 176.754 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . 0.558 ' HA ' HG11 ' A' ' 69' ' ' VAL . 73.2 mt -88.12 -6.48 57.87 Favored 'General case' 0 N--CA 1.479 0.998 0 C-N-CA 123.93 0.892 . . . . 0.0 111.099 -179.723 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . 0.417 ' H ' ' HG ' ' A' ' 63' ' ' LEU . 1.8 pp -73.04 159.99 32.75 Favored 'General case' 0 N--CA 1.474 0.771 0 C-N-CA 124.011 0.924 . . . . 0.0 111.513 174.34 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 92.22 -168.46 31.1 Favored Glycine 0 CA--C 1.524 0.621 0 CA-C-N 115.518 -0.764 . . . . 0.0 112.682 179.729 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 16.1 m120 -62.37 126.15 26.35 Favored 'General case' 0 N--CA 1.478 0.948 0 C-N-CA 123.635 0.774 . . . . 0.0 109.831 -179.58 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 54.8 mt -57.09 -48.12 82.53 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.86 0 O-C-N 124.268 0.98 . . . . 0.0 112.434 -168.543 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 22.4 pttp -65.38 -31.55 72.72 Favored 'General case' 0 N--CA 1.482 1.159 0 C-N-CA 123.688 0.795 . . . . 0.0 111.575 -178.137 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 48.9 t30 -66.75 -41.77 87.26 Favored 'General case' 0 N--CA 1.481 1.121 0 C-N-CA 123.372 0.669 . . . . 0.0 109.862 176.458 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 69' ' ' VAL . . . . . 0.558 HG11 ' HA ' ' A' ' 62' ' ' LEU . 38.4 t -69.04 -34.57 64.56 Favored 'Isoleucine or valine' 0 C--O 1.212 -0.889 0 CA-C-N 115.03 -0.986 . . . . 0.0 109.644 175.31 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -75.37 -2.14 27.11 Favored 'General case' 0 N--CA 1.484 1.23 0 C-N-CA 123.683 0.793 . . . . 0.0 111.341 179.372 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 40.2 ttmt -95.06 -49.63 5.44 Favored 'General case' 0 CA--C 1.547 0.83 0 C-N-CA 123.554 0.742 . . . . 0.0 110.347 172.313 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 15.1 t -83.03 -33.63 26.44 Favored 'General case' 0 CA--C 1.555 1.167 0 C-N-CA 123.435 0.694 . . . . 0.0 111.955 -172.679 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -92.41 118.16 30.66 Favored 'General case' 0 N--CA 1.47 0.563 0 C-N-CA 123.972 0.909 . . . . 0.0 109.735 -179.452 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 74' ' ' ASN . . . . . 0.437 ' O ' ' HB3' ' A' ' 77' ' ' HIS . 24.0 p-10 -76.73 168.41 20.13 Favored 'General case' 0 N--CA 1.476 0.835 0 C-N-CA 123.173 0.589 . . . . 0.0 110.042 173.328 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . 0.416 ' HD3' ' O ' ' A' ' 34' ' ' LEU . 32.3 ttmt -71.99 -32.3 67.08 Favored 'General case' 0 CA--C 1.543 0.703 0 C-N-CA 122.78 0.432 . . . . 0.0 111.709 -175.184 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 33.9 t70 -60.74 -28.58 68.8 Favored 'General case' 0 N--CA 1.487 1.409 0 C-N-CA 123.283 0.633 . . . . 0.0 111.527 177.354 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 77' ' ' HIS . . . . . 0.474 ' HD2' HD23 ' A' ' 78' ' ' LEU . 42.1 t60 -71.2 -48.91 48.68 Favored 'General case' 0 CA--C 1.552 1.045 0 C-N-CA 125.055 1.342 . . . . 0.0 109.978 172.211 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . 0.474 HD23 ' HD2' ' A' ' 77' ' ' HIS . 77.6 mt -67.22 -45.79 75.76 Favored 'General case' 0 N--CA 1.487 1.408 0 N-CA-C 113.454 0.909 . . . . 0.0 113.454 -169.132 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 79' ' ' VAL . . . . . 0.524 HG22 ' HB3' ' A' ' 34' ' ' LEU . 61.9 t -59.53 -42.06 86.83 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.218 0 O-C-N 123.941 0.775 . . . . 0.0 110.207 -177.812 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 24.8 m -62.54 -44.41 96.4 Favored 'General case' 0 N--CA 1.476 0.847 0 CA-C-N 115.203 -0.908 . . . . 0.0 111.496 177.815 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -66.42 -39.35 88.89 Favored 'General case' 0 N--CA 1.48 1.041 0 C-N-CA 123.55 0.74 . . . . 0.0 110.7 -179.803 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 82' ' ' TYR . . . . . 0.455 ' CD2' HD11 ' A' ' 34' ' ' LEU . 86.6 t80 -63.13 -54.56 35.87 Favored 'General case' 0 N--CA 1.471 0.621 0 C-N-CA 124.387 1.075 . . . . 0.0 111.105 -177.328 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 83' ' ' ASN . . . . . . . . . . . . . 67.8 m-80 -68.71 -35.76 77.57 Favored 'General case' 0 N--CA 1.481 1.115 0 C-N-CA 123.055 0.542 . . . . 0.0 110.96 -177.492 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 37.9 t60 -63.97 -30.54 71.61 Favored 'General case' 0 N--CA 1.483 1.218 0 C-N-CA 123.859 0.863 . . . . 0.0 110.647 174.292 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 85' ' ' LEU . . . . . 0.408 ' HA ' ' HG2' ' A' ' 90' ' ' ARG . 1.5 tt -60.1 -51.93 67.53 Favored 'General case' 0 N--CA 1.479 1.018 0 C-N-CA 123.467 0.707 . . . . 0.0 109.522 -176.842 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 35.0 m-85 -73.11 -31.89 64.61 Favored 'General case' 0 N--CA 1.48 1.055 0 CA-C-N 115.499 -0.773 . . . . 0.0 110.991 -179.108 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 9.7 tp10 -60.68 -41.61 95.42 Favored 'General case' 0 N--CA 1.477 0.911 0 C-N-CA 124.345 1.058 . . . . 0.0 111.699 -177.114 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 12.2 p -120.32 3.73 10.81 Favored 'General case' 0 N--CA 1.477 0.916 0 C-N-CA 124.152 0.981 . . . . 0.0 111.779 -175.602 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 56.2 mtpt 53.85 70.17 0.63 Allowed 'General case' 0 N--CA 1.48 1.038 0 C-N-CA 124.673 1.189 . . . . 0.0 111.787 178.634 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 90' ' ' ARG . . . . . 0.408 ' HG2' ' HA ' ' A' ' 85' ' ' LEU . 26.3 mmm180 -80.12 14.33 1.93 Allowed 'General case' 0 N--CA 1.493 1.693 0 C-N-CA 124.241 1.016 . . . . 0.0 112.369 -179.722 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 91' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -65.15 163.25 15.4 Favored 'General case' 0 N--CA 1.479 1.012 0 C-N-CA 123.671 0.788 . . . . 0.0 110.839 -177.854 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 23.1 ttmm . . . . . 0 C--O 1.254 1.338 0 CA-C-N 115.256 -0.884 . . . . 0.0 109.287 174.952 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.545 0.786 0 CA-C-O 121.128 0.49 . . . . 0.0 111.3 . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -78.97 -34.56 44.13 Favored 'General case' 0 CA--C 1.535 0.39 0 N-CA-C 108.697 -0.853 . . . . 0.0 108.697 173.348 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 29' ' ' TRP . . . . . . . . . . . . . 4.7 m-90 -134.13 149.83 51.1 Favored 'General case' 0 N--CA 1.476 0.835 0 C-N-CA 124.679 1.192 . . . . 0.0 108.344 178.782 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 21.6 p -91.72 178.1 6.01 Favored 'General case' 0 N--CA 1.478 0.929 0 C-N-CA 122.814 0.446 . . . . 0.0 110.916 -178.482 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 7.2 p -54.34 -45.78 68.96 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.608 0 N-CA-C 113.441 0.904 . . . . 0.0 113.441 -169.873 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 1.3 pm0 -71.42 -31.3 67.07 Favored 'General case' 0 N--CA 1.476 0.843 0 C-N-CA 123.133 0.573 . . . . 0.0 111.447 179.305 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 23.4 mm-40 -71.28 -32.98 69.33 Favored 'General case' 0 N--CA 1.476 0.844 0 C-N-CA 123.139 0.576 . . . . 0.0 110.613 175.69 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 70.3 mt -81.34 -27.3 35.0 Favored 'General case' 0 N--CA 1.475 0.797 0 C-N-CA 123.79 0.836 . . . . 0.0 111.827 -176.25 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 3.6 ptm180 -82.68 -25.26 33.2 Favored 'General case' 0 N--CA 1.479 0.983 0 CA-C-O 119.669 -0.205 . . . . 0.0 110.829 169.715 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 37.1 t -59.94 125.33 23.23 Favored 'General case' 0 N--CA 1.486 1.36 0 C-N-CA 124.093 0.957 . . . . 0.0 112.111 -172.974 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 10.9 tp10 -65.46 -17.16 64.34 Favored 'General case' 0 CA--C 1.555 1.161 0 C-N-CA 124.487 1.115 . . . . 0.0 111.558 178.534 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 71.3 mt-30 -62.89 -38.59 91.51 Favored 'General case' 0 N--CA 1.476 0.869 0 C-N-CA 123.852 0.861 . . . . 0.0 110.418 173.377 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . 0.512 HD12 ' HD2' ' A' ' 40' ' ' PRO . 51.4 tp -86.52 128.09 58.22 Favored Pre-proline 0 N--CA 1.482 1.134 0 C-N-CA 123.777 0.831 . . . . 0.0 110.016 177.573 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 40' ' ' PRO . . . . . 0.512 ' HD2' HD12 ' A' ' 39' ' ' LEU . 39.0 Cg_endo -70.14 134.26 26.78 Favored 'Trans proline' 0 C--N 1.379 2.144 0 C-N-CA 122.363 2.042 . . . . 0.0 112.318 173.168 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 41' ' ' LYS . . . . . 0.517 ' HB3' ' HD3' ' A' ' 75' ' ' LYS . 21.5 pttp -76.95 -20.01 56.65 Favored 'General case' 0 N--CA 1.48 1.051 0 N-CA-C 113.235 0.828 . . . . 0.0 113.235 -173.213 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . 0.567 ' HA ' HD12 ' A' ' 45' ' ' ILE . 60.1 pttt -63.77 -30.76 71.82 Favored 'General case' 0 N--CA 1.478 0.941 0 C-N-CA 122.966 0.507 . . . . 0.0 110.706 171.256 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -73.94 -26.25 60.4 Favored 'General case' 0 N--CA 1.479 0.996 0 C-N-CA 122.967 0.507 . . . . 0.0 111.596 177.692 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 39.3 mt -74.55 -43.99 47.75 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.971 0 N-CA-C 109.438 -0.578 . . . . 0.0 109.438 174.846 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 45' ' ' ILE . . . . . 0.567 HD12 ' HA ' ' A' ' 42' ' ' LYS . 77.9 mt -53.89 -46.85 64.57 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.165 0 C-N-CA 123.358 0.663 . . . . 0.0 109.314 172.119 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 29.0 ttpp -63.79 -39.37 94.1 Favored 'General case' 0 CA--C 1.538 0.519 0 CA-C-N 114.467 -1.242 . . . . 0.0 110.893 -177.948 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 26.5 t80 -64.64 -54.31 33.77 Favored 'General case' 0 N--CA 1.473 0.693 0 O-C-N 123.969 0.793 . . . . 0.0 110.623 177.13 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 95.8 mt -69.03 -29.69 67.91 Favored 'General case' 0 N--CA 1.474 0.726 0 C-N-CA 123.656 0.782 . . . . 0.0 111.846 -173.03 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 3.0 pt20 -79.45 -26.21 41.81 Favored 'General case' 0 N--CA 1.48 1.039 0 C-N-CA 122.222 0.209 . . . . 0.0 110.621 176.646 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 10.7 tp10 -61.23 -37.71 84.03 Favored 'General case' 0 N--CA 1.482 1.159 0 C-N-CA 123.679 0.791 . . . . 0.0 111.269 -179.477 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 31.2 p-80 -124.34 -32.21 3.2 Favored 'General case' 0 N--CA 1.485 1.32 0 N-CA-C 113.253 0.834 . . . . 0.0 113.253 -174.24 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -61.83 139.84 46.78 Favored Glycine 0 C--N 1.348 1.198 0 CA-C-N 118.221 0.464 . . . . 0.0 113.6 178.115 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 53' ' ' SER . . . . . 0.472 ' O ' ' HG ' ' A' ' 57' ' ' LEU . 44.1 t -60.14 148.36 36.33 Favored 'General case' 0 N--CA 1.48 1.057 0 C-N-CA 123.582 0.753 . . . . 0.0 111.597 179.556 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 14.2 m-20 -61.52 -32.9 72.96 Favored 'General case' 0 N--CA 1.487 1.419 0 C-N-CA 123.65 0.78 . . . . 0.0 112.489 -174.181 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 21.5 m -67.42 -41.93 84.05 Favored 'General case' 0 CA--C 1.544 0.716 0 O-C-N 123.607 0.567 . . . . 0.0 110.402 177.827 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 56' ' ' PHE . . . . . 0.52 ' HB2' ' HD3' ' A' ' 90' ' ' ARG . 62.4 t80 -60.98 -43.9 98.14 Favored 'General case' 0 N--CA 1.477 0.882 0 C-N-CA 123.849 0.86 . . . . 0.0 109.934 174.027 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . 0.472 ' HG ' ' O ' ' A' ' 53' ' ' SER . 73.1 mt -64.53 -44.49 90.67 Favored 'General case' 0 C--O 1.209 -1.068 0 CA-C-N 115.097 -0.956 . . . . 0.0 110.491 -177.506 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -61.72 -45.28 94.64 Favored 'General case' 0 N--CA 1.482 1.138 0 C-N-CA 123.655 0.782 . . . . 0.0 111.393 -177.39 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 46.7 mt-10 -60.38 -36.58 78.39 Favored 'General case' 0 N--CA 1.482 1.168 0 C-N-CA 123.666 0.787 . . . . 0.0 112.006 177.668 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 53.2 m80 -105.11 6.82 33.51 Favored 'General case' 0 N--CA 1.487 1.393 0 C-N-CA 122.967 0.507 . . . . 0.0 112.132 -177.59 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 68.8 mmtt 59.96 27.22 16.57 Favored 'General case' 0 N--CA 1.488 1.436 0 C-N-CA 125.094 1.358 . . . . 0.0 112.981 175.65 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 70.1 mt -81.92 -21.51 37.3 Favored 'General case' 0 N--CA 1.483 1.198 0 C-N-CA 124.157 0.983 . . . . 0.0 112.669 -174.703 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -78.09 170.04 17.27 Favored 'General case' 0 N--CA 1.485 1.283 0 CA-C-O 120.809 0.337 . . . . 0.0 111.683 179.818 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 90.96 -157.55 25.23 Favored Glycine 0 C--N 1.341 0.848 0 CA-C-N 115.391 -0.822 . . . . 0.0 112.367 177.303 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 65' ' ' ASN . . . . . 0.402 ' O ' HG23 ' A' ' 69' ' ' VAL . 17.8 m120 -69.41 115.93 9.25 Favored 'General case' 0 N--CA 1.47 0.567 0 C-N-CA 123.62 0.768 . . . . 0.0 110.205 -179.437 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 65.7 mt -54.29 -50.35 57.11 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.967 0 C-N-CA 124.515 1.126 . . . . 0.0 112.187 -173.758 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 67' ' ' LYS . . . . . 0.501 ' H ' ' HD2' ' A' ' 67' ' ' LYS . 0.0 OUTLIER -60.92 -41.64 96.59 Favored 'General case' 0 N--CA 1.48 1.049 0 O-C-N 123.774 0.671 . . . . 0.0 109.661 -175.898 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 49.5 t30 -61.35 -47.82 84.11 Favored 'General case' 0 N--CA 1.479 1.008 0 CA-C-N 115.075 -0.966 . . . . 0.0 110.975 176.959 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 69' ' ' VAL . . . . . 0.402 HG23 ' O ' ' A' ' 65' ' ' ASN . 85.8 t -62.28 -32.35 54.57 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.099 0 C-N-CA 123.585 0.754 . . . . 0.0 110.732 178.676 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -70.69 8.02 0.97 Allowed 'General case' 0 CA--C 1.554 1.134 0 C-N-CA 123.738 0.815 . . . . 0.0 112.976 -178.453 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 16.5 ptpt -94.81 -27.4 15.78 Favored 'General case' 0 N--CA 1.484 1.255 0 CA-C-N 119.179 0.9 . . . . 0.0 110.824 169.69 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 10.2 t -109.23 -28.94 8.74 Favored 'General case' 0 N--CA 1.482 1.155 0 C-N-CA 123.732 0.813 . . . . 0.0 111.045 -175.207 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -80.62 86.36 5.89 Favored 'General case' 0 C--O 1.237 0.447 0 C-N-CA 123.511 0.724 . . . . 0.0 109.656 -178.66 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 3.9 p-10 -70.27 160.95 31.26 Favored 'General case' 0 C--O 1.239 0.538 0 CA-C-N 114.489 -1.232 . . . . 0.0 110.389 174.877 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . 0.517 ' HD3' ' HB3' ' A' ' 41' ' ' LYS . 13.3 tptm -61.19 -47.73 84.79 Favored 'General case' 0 N--CA 1.471 0.59 0 CA-C-N 115.712 -0.676 . . . . 0.0 111.3 -166.923 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 4.4 p30 -69.43 -29.94 67.76 Favored 'General case' 0 N--CA 1.485 1.3 0 CA-C-N 115.975 -0.557 . . . . 0.0 111.649 -176.304 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 74.5 t60 -59.83 -41.53 91.53 Favored 'General case' 0 N--CA 1.481 1.099 0 C-N-CA 123.883 0.873 . . . . 0.0 110.128 173.094 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . 0.452 ' CD1' ' HB2' ' A' ' 41' ' ' LYS . 83.5 mt -74.1 -28.95 61.6 Favored 'General case' 0 N--CA 1.47 0.533 0 CA-C-N 115.242 -0.89 . . . . 0.0 112.24 -176.92 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 79' ' ' VAL . . . . . 0.414 HG23 ' O ' ' A' ' 75' ' ' LYS . 21.3 t -73.73 -39.1 52.49 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.914 0 N-CA-C 109.732 -0.47 . . . . 0.0 109.732 173.553 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 29.2 m -67.5 -36.62 81.44 Favored 'General case' 0 N--CA 1.48 1.061 0 C-N-CA 122.895 0.478 . . . . 0.0 111.098 176.094 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -68.34 -39.65 81.84 Favored 'General case' 0 N--CA 1.473 0.688 0 C-N-CA 123.378 0.671 . . . . 0.0 109.955 175.663 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 82' ' ' TYR . . . . . . . . . . . . . 15.2 t80 -53.57 -58.86 5.67 Favored 'General case' 0 CA--C 1.542 0.65 0 CA-C-N 115.084 -0.962 . . . . 0.0 110.217 174.859 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 83' ' ' ASN . . . . . . . . . . . . . 49.4 m-80 -64.72 -31.19 72.3 Favored 'General case' 0 N--CA 1.481 1.112 0 C-N-CA 122.749 0.42 . . . . 0.0 111.501 -175.513 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 6.4 t60 -65.7 -45.66 81.91 Favored 'General case' 0 CA--C 1.549 0.938 0 C-N-CA 123.471 0.708 . . . . 0.0 110.267 178.218 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 85' ' ' LEU . . . . . 0.418 HD12 ' HB2' ' A' ' 90' ' ' ARG . 20.2 tp -57.13 -54.72 43.57 Favored 'General case' 0 N--CA 1.49 1.531 0 C-N-CA 123.701 0.8 . . . . 0.0 112.34 -172.691 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 83.0 m-85 -74.6 -21.73 59.32 Favored 'General case' 0 CA--C 1.543 0.697 0 CA-C-N 113.625 -1.625 . . . . 0.0 111.409 -174.519 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 7.9 tp10 -82.91 -10.84 58.62 Favored 'General case' 0 N--CA 1.478 0.96 0 C-N-CA 123.165 0.586 . . . . 0.0 111.601 178.524 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 31.4 p -125.5 -3.17 7.34 Favored 'General case' 0 N--CA 1.483 1.211 0 C-N-CA 123.617 0.767 . . . . 0.0 110.94 178.691 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 74.4 mmtt 61.04 23.84 13.99 Favored 'General case' 0 N--CA 1.486 1.359 0 C-N-CA 125.033 1.333 . . . . 0.0 113.125 174.052 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 90' ' ' ARG . . . . . 0.52 ' HD3' ' HB2' ' A' ' 56' ' ' PHE . 51.1 mtt180 -65.15 -18.87 65.67 Favored 'General case' 0 N--CA 1.491 1.605 0 N-CA-C 113.812 1.041 . . . . 0.0 113.812 -170.296 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 91' ' ' PHE . . . . . . . . . . . . . 24.6 p90 -59.68 145.65 44.08 Favored 'General case' 0 N--CA 1.476 0.841 0 C-N-CA 122.688 0.395 . . . . 0.0 111.571 177.56 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 14.1 mmmm . . . . . 0 CA--C 1.554 1.107 0 C-N-CA 124.736 1.214 . . . . 0.0 111.561 -167.27 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 CA--C 1.547 0.858 0 N-CA-C 108.341 -0.985 . . . . 0.0 108.341 . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -128.9 -17.57 3.94 Favored 'General case' 0 N--CA 1.482 1.169 0 N-CA-C 112.543 0.572 . . . . 0.0 112.543 -167.537 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 29' ' ' TRP . . . . . . . . . . . . . 2.1 m-90 -126.27 138.1 53.57 Favored 'General case' 0 N--CA 1.481 1.101 0 C-N-CA 122.606 0.362 . . . . 0.0 110.143 -167.765 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 8.4 m -81.83 161.95 23.02 Favored 'General case' 0 CA--C 1.549 0.935 0 N-CA-C 108.191 -1.04 . . . . 0.0 108.191 171.353 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . 0.556 ' HA ' HD12 ' A' ' 34' ' ' LEU . 60.1 t -57.48 -33.3 43.95 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.485 0 C-N-CA 123.003 0.521 . . . . 0.0 110.74 -177.483 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 12.0 pt-20 -68.07 -38.56 82.53 Favored 'General case' 0 N--CA 1.478 0.97 0 C-N-CA 124.558 1.143 . . . . 0.0 111.83 176.026 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 43.2 mt-30 -65.49 -37.76 87.76 Favored 'General case' 0 N--CA 1.48 1.044 0 C-N-CA 122.54 0.336 . . . . 0.0 110.467 176.552 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.556 HD12 ' HA ' ' A' ' 31' ' ' VAL . 72.9 mt -65.15 -56.45 12.83 Favored 'General case' 0 C--N 1.347 0.492 0 O-C-N 123.969 0.793 . . . . 0.0 110.233 -178.516 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 40.2 ptt180 -65.01 -24.47 67.51 Favored 'General case' 0 N--CA 1.481 1.1 0 CA-C-N 115.331 -0.85 . . . . 0.0 111.194 -173.517 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 33.6 t -65.39 116.09 6.33 Favored 'General case' 0 C--O 1.24 0.582 0 N-CA-C 108.599 -0.889 . . . . 0.0 108.599 173.408 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 5.2 tp10 -73.76 -7.01 50.48 Favored 'General case' 0 CA--C 1.553 1.065 0 C-N-CA 123.189 0.596 . . . . 0.0 110.844 -174.668 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 70.8 mt-30 -55.28 -39.29 69.66 Favored 'General case' 0 N--CA 1.479 0.986 0 C-N-CA 124.417 1.087 . . . . 0.0 110.049 167.801 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 3.6 tt -78.88 124.8 84.82 Favored Pre-proline 0 CA--C 1.557 1.221 0 N-CA-C 107.926 -1.139 . . . . 0.0 107.926 173.961 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 40.9 Cg_exo -59.49 -178.54 0.16 Allowed 'Trans proline' 0 C--N 1.379 2.167 0 C-N-CA 123.475 2.783 . . . . 0.0 113.98 171.36 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 52.0 mtmt -106.16 -20.15 13.49 Favored 'General case' 0 N--CA 1.473 0.697 0 CA-C-N 115.901 -0.591 . . . . 0.0 110.808 178.686 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 18.9 ptpt -62.08 -47.21 85.66 Favored 'General case' 0 N--CA 1.474 0.769 0 C-N-CA 123.726 0.811 . . . . 0.0 112.089 -174.764 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 43' ' ' ASP . . . . . 0.525 ' HA ' ' HE2' ' A' ' 46' ' ' LYS . 9.4 p-10 -73.86 -27.95 61.34 Favored 'General case' 0 N--CA 1.472 0.625 0 CA-C-N 116.07 -0.514 . . . . 0.0 111.907 -174.256 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 32.6 mt -68.66 -56.08 13.58 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.944 0 N-CA-C 109.735 -0.469 . . . . 0.0 109.735 175.88 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 79.9 mt -54.77 -38.47 43.96 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.544 0 C-N-CA 123.558 0.743 . . . . 0.0 110.654 175.812 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 46' ' ' LYS . . . . . 0.525 ' HE2' ' HA ' ' A' ' 43' ' ' ASP . 38.6 ttpt -62.63 -45.56 92.28 Favored 'General case' 0 N--CA 1.48 1.054 0 C-N-CA 124.092 0.957 . . . . 0.0 111.721 179.602 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 47' ' ' PHE . . . . . 0.465 ' HE2' ' HZ ' ' A' ' 86' ' ' PHE . 24.3 t80 -66.72 -44.51 81.39 Favored 'General case' 0 N--CA 1.476 0.852 0 CA-C-N 115.719 -0.673 . . . . 0.0 111.295 179.808 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 83.6 mt -71.04 -30.3 66.45 Favored 'General case' 0 CA--C 1.539 0.526 0 CA-C-N 115.516 -0.765 . . . . 0.0 111.2 -175.435 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . 0.498 ' HA ' HD21 ' A' ' 57' ' ' LEU . 2.9 pt20 -81.44 -26.76 35.05 Favored 'General case' 0 N--CA 1.479 1.014 0 O-C-N 123.245 0.34 . . . . 0.0 110.764 175.638 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 10.8 tp10 -62.29 -43.4 98.92 Favored 'General case' 0 N--CA 1.477 0.878 0 C-N-CA 123.611 0.764 . . . . 0.0 110.95 179.196 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 0.7 OUTLIER -107.66 -36.17 6.51 Favored 'General case' 0 N--CA 1.476 0.836 0 CA-C-N 115.94 -0.573 . . . . 0.0 111.682 -171.167 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . 0.557 ' HA2' ' HA ' ' A' ' 91' ' ' PHE . . . -61.85 143.62 48.71 Favored Glycine 0 C--N 1.353 1.508 0 N-CA-C 114.431 0.532 . . . . 0.0 114.431 -177.757 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 53' ' ' SER . . . . . 0.403 ' O ' ' HG ' ' A' ' 57' ' ' LEU . 92.4 p -78.74 174.7 11.17 Favored 'General case' 0 N--CA 1.485 1.321 0 C-N-CA 123.908 0.883 . . . . 0.0 111.217 -179.081 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 6.8 m-20 -57.24 -44.44 83.85 Favored 'General case' 0 N--CA 1.491 1.585 0 C-N-CA 123.494 0.718 . . . . 0.0 110.95 179.815 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 39.5 t -63.48 -32.68 74.19 Favored 'General case' 0 CA--C 1.548 0.896 0 CA-C-N 115.13 -0.941 . . . . 0.0 111.579 -179.119 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 56' ' ' PHE . . . . . 0.401 ' HB2' ' HB3' ' A' ' 90' ' ' ARG . 54.7 t80 -74.27 -48.88 25.78 Favored 'General case' 0 N--CA 1.477 0.887 0 CA-C-O 120.864 0.364 . . . . 0.0 110.53 175.741 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . 0.498 HD21 ' HA ' ' A' ' 49' ' ' GLN . 37.2 mt -70.11 -36.64 74.99 Favored 'General case' 0 N--CA 1.478 0.941 0 CA-C-N 115.427 -0.806 . . . . 0.0 112.398 -169.296 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -71.03 -49.83 40.71 Favored 'General case' 0 N--CA 1.474 0.729 0 C-N-CA 122.919 0.488 . . . . 0.0 111.106 -179.717 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 39.2 mm-40 -69.25 -20.69 63.94 Favored 'General case' 0 N--CA 1.478 0.97 0 N-CA-C 112.745 0.646 . . . . 0.0 112.745 -179.164 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 62.8 m80 -108.77 -3.2 17.95 Favored 'General case' 0 N--CA 1.483 1.213 0 C-N-CA 123.1 0.56 . . . . 0.0 111.459 176.791 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 50.5 mtmt 59.46 28.36 17.72 Favored 'General case' 0 N--CA 1.495 1.79 0 C-N-CA 124.369 1.068 . . . . 0.0 112.732 174.5 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . 0.508 HD11 ' HB1' ' A' ' 81' ' ' ALA . 87.3 mt -88.98 -7.46 55.96 Favored 'General case' 0 N--CA 1.486 1.364 0 C-N-CA 123.776 0.831 . . . . 0.0 112.373 -174.232 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 2.2 pp -78.3 176.72 9.04 Favored 'General case' 0 N--CA 1.479 0.985 0 C-N-CA 123.029 0.532 . . . . 0.0 110.952 177.135 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 78.32 -162.13 49.29 Favored Glycine 0 CA--C 1.526 0.724 0 CA-C-N 115.685 -0.689 . . . . 0.0 113.505 176.816 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 65' ' ' ASN . . . . . 0.414 HD22 ' N ' ' A' ' 65' ' ' ASN . 0.8 OUTLIER -64.6 113.38 3.68 Favored 'General case' 0 N--CA 1.477 0.921 0 C-N-CA 123.524 0.73 . . . . 0.0 109.185 -179.621 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 82.4 mt -54.6 -47.45 72.28 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.947 0 O-C-N 124.123 0.89 . . . . 0.0 111.775 -173.77 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -65.68 -30.29 70.96 Favored 'General case' 0 N--CA 1.483 1.186 0 N-CA-C 111.999 0.37 . . . . 0.0 111.999 -177.494 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 68' ' ' ASN . . . . . 0.493 ' O ' ' HG2' ' A' ' 71' ' ' LYS . 60.0 t30 -73.57 -34.58 65.19 Favored 'General case' 0 N--CA 1.483 1.188 0 C-N-CA 123.356 0.662 . . . . 0.0 110.268 178.141 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 67.1 t -72.94 -34.13 45.3 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.875 0 CA-C-N 115.536 -0.756 . . . . 0.0 110.082 172.247 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -75.75 1.86 13.67 Favored 'General case' 0 N--CA 1.484 1.242 0 C-N-CA 124.112 0.965 . . . . 0.0 112.953 -175.481 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . 0.493 ' HG2' ' O ' ' A' ' 68' ' ' ASN . 18.0 ptpt -94.7 -17.92 21.78 Favored 'General case' 0 N--CA 1.482 1.166 0 CA-C-N 118.186 0.448 . . . . 0.0 110.666 172.891 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 14.1 t -129.09 -12.98 4.58 Favored 'General case' 0 CA--C 1.547 0.84 0 C-N-CA 123.356 0.662 . . . . 0.0 111.861 -169.707 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -99.87 98.29 9.09 Favored 'General case' 0 N--CA 1.472 0.645 0 N-CA-C 107.999 -1.111 . . . . 0.0 107.999 174.863 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 26.6 p-10 -71.33 169.69 14.72 Favored 'General case' 0 N--CA 1.48 1.039 0 O-C-N 123.331 0.395 . . . . 0.0 110.388 -178.546 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . 0.48 ' O ' HG23 ' A' ' 79' ' ' VAL . 3.4 tppp? -61.46 -40.47 94.62 Favored 'General case' 0 CA--C 1.545 0.755 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.911 -175.81 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 23.2 m-20 -58.13 -41.11 82.97 Favored 'General case' 0 N--CA 1.486 1.374 0 C-N-CA 123.485 0.714 . . . . 0.0 111.473 -179.977 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 75.3 t60 -61.44 -40.45 94.52 Favored 'General case' 0 N--CA 1.479 0.993 0 C-N-CA 124.047 0.939 . . . . 0.0 110.827 175.72 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 58.3 mt -75.77 -28.44 58.44 Favored 'General case' 0 N--CA 1.48 1.034 0 C-N-CA 123.234 0.614 . . . . 0.0 112.54 -176.037 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 79' ' ' VAL . . . . . 0.48 HG23 ' O ' ' A' ' 75' ' ' LYS . 61.5 t -67.54 -48.27 77.47 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.704 0 N-CA-C 108.703 -0.851 . . . . 0.0 108.703 172.76 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 53.7 m -60.56 -39.96 89.9 Favored 'General case' 0 CA--C 1.542 0.659 0 CA-C-N 114.828 -1.078 . . . . 0.0 111.124 177.453 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 81' ' ' ALA . . . . . 0.508 ' HB1' HD11 ' A' ' 62' ' ' LEU . . . -70.12 -42.72 72.26 Favored 'General case' 0 CA--C 1.542 0.637 0 C-N-CA 123.049 0.54 . . . . 0.0 111.588 -178.9 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 82' ' ' TYR . . . . . 0.554 ' CD2' HD11 ' A' ' 34' ' ' LEU . 90.2 t80 -62.89 -55.89 22.1 Favored 'General case' 0 N--CA 1.479 0.995 0 C-N-CA 123.982 0.913 . . . . 0.0 110.797 -179.067 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 83' ' ' ASN . . . . . . . . . . . . . 60.8 m-80 -65.1 -46.98 78.83 Favored 'General case' 0 N--CA 1.48 1.041 0 C-N-CA 122.714 0.406 . . . . 0.0 111.589 -175.846 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 26.3 m-70 -67.04 -23.99 65.95 Favored 'General case' 0 N--CA 1.482 1.16 0 C-N-CA 123.511 0.724 . . . . 0.0 112.086 -179.121 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 21.1 tp -59.11 -54.44 47.02 Favored 'General case' 0 N--CA 1.483 1.182 0 CA-C-O 121.205 0.526 . . . . 0.0 110.553 177.5 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 86' ' ' PHE . . . . . 0.465 ' HZ ' ' HE2' ' A' ' 47' ' ' PHE . 6.3 m-85 -75.36 -29.75 60.01 Favored 'General case' 0 N--CA 1.471 0.586 0 CA-C-N 114.242 -1.344 . . . . 0.0 110.874 -176.1 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 22.8 tt0 -54.78 -40.31 69.3 Favored 'General case' 0 N--CA 1.481 1.12 0 C-N-CA 124.732 1.213 . . . . 0.0 111.105 176.378 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 40.7 p -111.62 -7.3 14.28 Favored 'General case' 0 CA--C 1.544 0.719 0 C-N-CA 124.279 1.031 . . . . 0.0 111.381 -176.634 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 8.5 mtpm? 52.84 43.26 31.74 Favored 'General case' 0 N--CA 1.481 1.11 0 C-N-CA 124.778 1.231 . . . . 0.0 111.91 -177.812 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 90' ' ' ARG . . . . . 0.401 ' HB3' ' HB2' ' A' ' 56' ' ' PHE . 94.1 mtt180 -69.59 -9.01 52.29 Favored 'General case' 0 N--CA 1.49 1.528 0 C-N-CA 123.746 0.818 . . . . 0.0 113.004 179.845 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 91' ' ' PHE . . . . . 0.557 ' HA ' ' HA2' ' A' ' 52' ' ' GLY . 21.1 p90 -65.95 133.94 51.91 Favored 'General case' 0 CA--C 1.546 0.79 0 CA-C-O 120.973 0.416 . . . . 0.0 111.492 174.084 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 61.3 tttp . . . . . 0 C--O 1.252 1.216 0 CA-C-N 115.322 -0.853 . . . . 0.0 108.854 173.599 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 27' ' ' ARG . . . . . 0.508 ' HB2' ' OH ' ' A' ' 82' ' ' TYR . 0.0 OUTLIER . . . . . 0 CA--C 1.542 0.657 0 CA-C-O 121.103 0.478 . . . . 0.0 110.918 . . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -91.39 -34.96 14.66 Favored 'General case' 0 N--CA 1.469 0.525 0 CA-C-N 115.099 -0.955 . . . . 0.0 111.436 -169.222 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 29' ' ' TRP . . . . . . . . . . . . . 4.4 m-90 -115.17 149.86 36.98 Favored 'General case' 0 N--CA 1.469 0.48 0 CA-C-N 115.51 -0.768 . . . . 0.0 111.433 -169.443 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 80.8 p -90.74 168.98 11.35 Favored 'General case' 0 CA--C 1.54 0.574 0 CA-C-N 115.275 -0.875 . . . . 0.0 109.223 172.512 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . 0.585 ' HA ' HD12 ' A' ' 34' ' ' LEU . 2.6 p -52.17 -41.66 33.8 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.416 0 C-N-CA 123.737 0.815 . . . . 0.0 112.633 -177.214 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 12.7 pt-20 -73.77 -36.44 65.09 Favored 'General case' 0 N--CA 1.478 0.961 0 C-N-CA 124.135 0.974 . . . . 0.0 112.111 -178.398 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 52.7 mt-30 -61.1 -38.58 86.82 Favored 'General case' 0 N--CA 1.49 1.538 0 C-N-CA 122.705 0.402 . . . . 0.0 110.101 175.267 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.585 HD12 ' HA ' ' A' ' 31' ' ' VAL . 36.1 mt -63.03 -41.32 99.5 Favored 'General case' 0 N--CA 1.473 0.699 0 CA-C-N 115.466 -0.788 . . . . 0.0 110.626 178.266 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 32.5 mtp180 -70.44 -30.31 67.13 Favored 'General case' 0 N--CA 1.478 0.939 0 C-N-CA 123.352 0.661 . . . . 0.0 111.518 -179.636 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 34.0 t -66.13 114.07 4.98 Favored 'General case' 0 N--CA 1.473 0.715 0 C-N-CA 123.308 0.643 . . . . 0.0 110.41 -179.949 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 41.0 mt-10 -73.32 -10.98 60.32 Favored 'General case' 0 CA--C 1.55 0.951 0 C-N-CA 123.454 0.702 . . . . 0.0 112.297 -176.642 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 79.1 mm-40 -55.57 -37.81 68.51 Favored 'General case' 0 N--CA 1.488 1.428 0 C-N-CA 123.695 0.798 . . . . 0.0 109.703 166.257 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 4.8 tt -78.44 128.87 76.42 Favored Pre-proline 0 CA--C 1.553 1.065 0 N-CA-C 107.329 -1.36 . . . . 0.0 107.329 170.746 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 47.5 Cg_exo -60.2 172.55 2.41 Favored 'Trans proline' 0 C--N 1.373 1.844 0 C-N-CA 123.259 2.639 . . . . 0.0 114.63 176.464 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 55.9 mtmt -93.36 -32.17 14.37 Favored 'General case' 0 N--CA 1.475 0.786 0 C-N-CA 123.662 0.785 . . . . 0.0 110.706 173.213 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 21.3 ptmt -63.83 -41.39 97.85 Favored 'General case' 0 CA--C 1.545 0.761 0 C-N-CA 123.911 0.884 . . . . 0.0 112.475 -172.801 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 30.4 p-10 -71.2 -32.37 68.76 Favored 'General case' 0 N--CA 1.481 1.103 0 C-N-CA 123.142 0.577 . . . . 0.0 111.912 -175.753 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 33.5 mt -68.85 -48.87 68.39 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.198 0 N-CA-C 109.982 -0.377 . . . . 0.0 109.982 176.079 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 79.6 mt -60.71 -39.97 83.34 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.364 0 C-N-CA 123.102 0.561 . . . . 0.0 110.938 178.005 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 84.7 tttt -62.76 -44.21 96.79 Favored 'General case' 0 CA--C 1.544 0.735 0 CA-C-N 115.436 -0.802 . . . . 0.0 110.784 177.788 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 1.0 OUTLIER -57.94 -52.08 66.99 Favored 'General case' 0 N--CA 1.484 1.256 0 O-C-N 124.248 0.967 . . . . 0.0 109.324 177.518 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . 0.492 HD21 ' HA ' ' A' ' 82' ' ' TYR . 96.3 mt -67.4 -31.6 71.92 Favored 'General case' 0 N--CA 1.471 0.612 0 CA-C-N 114.906 -1.043 . . . . 0.0 113.052 -174.732 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . 0.551 ' HA ' HD21 ' A' ' 57' ' ' LEU . 3.4 pt20 -84.18 -27.4 28.08 Favored 'General case' 0 N--CA 1.482 1.162 0 CA-C-N 117.886 0.312 . . . . 0.0 111.359 178.483 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 40.3 tt0 -75.19 -36.83 61.4 Favored 'General case' 0 N--CA 1.474 0.754 0 C-N-CA 123.387 0.675 . . . . 0.0 111.346 179.611 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 69.1 m80 -107.87 -35.46 6.64 Favored 'General case' 0 N--CA 1.476 0.855 0 CA-C-N 115.562 -0.745 . . . . 0.0 112.06 -173.163 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -66.67 172.89 27.4 Favored Glycine 0 CA--C 1.528 0.883 0 CA-C-N 117.691 0.223 . . . . 0.0 113.346 176.314 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 53' ' ' SER . . . . . 0.458 ' O ' ' HG ' ' A' ' 57' ' ' LEU . 64.0 p -94.32 161.42 14.25 Favored 'General case' 0 N--CA 1.48 1.033 0 C-N-CA 123.154 0.582 . . . . 0.0 109.825 176.514 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 5.1 p-10 -63.26 -34.27 77.31 Favored 'General case' 0 N--CA 1.485 1.283 0 C-N-CA 122.897 0.479 . . . . 0.0 111.757 -176.384 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 23.1 t -67.86 -39.6 83.75 Favored 'General case' 0 N--CA 1.481 1.076 0 C-N-CA 123.619 0.768 . . . . 0.0 110.44 177.821 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 47.7 t80 -59.78 -37.66 79.68 Favored 'General case' 0 N--CA 1.483 1.208 0 C-N-CA 124.191 0.996 . . . . 0.0 110.161 172.972 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . 0.551 HD21 ' HA ' ' A' ' 49' ' ' GLN . 49.0 mt -74.9 -39.01 61.71 Favored 'General case' 0 C--O 1.216 -0.684 0 CA-C-N 115.836 -0.62 . . . . 0.0 112.012 -177.911 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -66.89 -46.74 73.97 Favored 'General case' 0 N--CA 1.481 1.086 0 CA-C-O 121.344 0.592 . . . . 0.0 110.435 -178.444 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 43.4 mt-10 -66.2 -26.11 67.24 Favored 'General case' 0 CA--C 1.55 0.954 0 CA-C-N 114.939 -1.028 . . . . 0.0 112.264 178.942 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 33.1 m80 -116.7 9.18 13.96 Favored 'General case' 0 N--CA 1.493 1.691 0 N-CA-C 112.888 0.699 . . . . 0.0 112.888 -178.862 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 34.1 mmtp 57.81 26.57 13.34 Favored 'General case' 0 N--CA 1.498 1.934 0 C-N-CA 124.224 1.01 . . . . 0.0 113.34 173.11 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . 0.425 HD11 ' HB1' ' A' ' 81' ' ' ALA . 73.1 mt -87.36 -9.67 54.19 Favored 'General case' 0 N--CA 1.485 1.303 0 C-N-CA 123.72 0.808 . . . . 0.0 112.187 -176.379 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 1.8 pp -80.13 165.85 22.06 Favored 'General case' 0 N--CA 1.479 0.99 0 C-N-CA 122.725 0.41 . . . . 0.0 111.002 175.923 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 92.9 -162.32 26.25 Favored Glycine 0 C--N 1.339 0.729 0 CA-C-N 115.307 -0.861 . . . . 0.0 111.891 -178.877 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 65' ' ' ASN . . . . . 0.446 ' O ' HG23 ' A' ' 69' ' ' VAL . 28.6 t-20 -69.77 122.25 18.83 Favored 'General case' 0 N--CA 1.467 0.401 0 N-CA-C 109.564 -0.532 . . . . 0.0 109.564 -178.921 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 62.6 mt -60.57 -44.6 97.07 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.376 0 C-N-CA 124.19 0.996 . . . . 0.0 111.305 -169.904 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 41.1 mtpt -57.31 -43.07 82.95 Favored 'General case' 0 CA--C 1.548 0.899 0 C-N-CA 124.495 1.118 . . . . 0.0 111.118 177.201 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 68' ' ' ASN . . . . . 0.452 ' O ' ' HG2' ' A' ' 71' ' ' LYS . 5.9 t30 -72.87 -29.86 63.52 Favored 'General case' 0 CA--C 1.55 0.964 0 CA-C-N 115.31 -0.859 . . . . 0.0 111.09 -178.857 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 69' ' ' VAL . . . . . 0.446 HG23 ' O ' ' A' ' 65' ' ' ASN . 57.7 t -72.11 -39.1 64.98 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.058 0 N-CA-C 109.798 -0.445 . . . . 0.0 109.798 173.527 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -71.18 -8.38 53.14 Favored 'General case' 0 N--CA 1.479 1.011 0 C-N-CA 124.145 0.978 . . . . 0.0 112.903 -175.272 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . 0.452 ' HG2' ' O ' ' A' ' 68' ' ' ASN . 53.1 pttt -88.38 -19.93 25.97 Favored 'General case' 0 N--CA 1.481 1.089 0 CA-C-N 117.872 0.305 . . . . 0.0 110.51 177.781 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 10.3 t -128.85 -13.76 4.6 Favored 'General case' 0 N--CA 1.478 0.932 0 C-N-CA 123.587 0.755 . . . . 0.0 111.862 -167.716 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -103.81 100.99 10.8 Favored 'General case' 0 N--CA 1.469 0.508 0 N-CA-C 107.514 -1.291 . . . . 0.0 107.514 175.336 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 25.6 p-10 -71.04 174.2 6.56 Favored 'General case' 0 N--CA 1.478 0.965 0 C-N-CA 122.884 0.474 . . . . 0.0 111.113 -173.249 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . 0.477 ' O ' HG23 ' A' ' 79' ' ' VAL . 9.2 tptm -64.57 -38.09 89.8 Favored 'General case' 0 CA--C 1.545 0.778 0 C-N-CA 122.598 0.359 . . . . 0.0 110.846 -173.274 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 28.5 m-20 -64.32 -35.8 82.05 Favored 'General case' 0 N--CA 1.48 1.039 0 C-N-CA 123.508 0.723 . . . . 0.0 111.237 178.849 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 77' ' ' HIS . . . . . 0.4 ' HD2' HD23 ' A' ' 78' ' ' LEU . 18.8 t60 -60.62 -42.32 96.63 Favored 'General case' 0 N--CA 1.482 1.15 0 C-N-CA 124.159 0.984 . . . . 0.0 110.503 176.538 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . 0.4 HD23 ' HD2' ' A' ' 77' ' ' HIS . 42.2 mt -68.34 -37.31 80.39 Favored 'General case' 0 N--CA 1.473 0.716 0 CA-C-N 115.159 -0.928 . . . . 0.0 111.528 -175.528 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 79' ' ' VAL . . . . . 0.553 ' HA ' HD13 ' A' ' 34' ' ' LEU . 47.2 t -62.89 -49.12 84.9 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.751 0 C-N-CA 124.025 0.93 . . . . 0.0 110.008 175.495 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 70.7 m -60.81 -46.27 91.17 Favored 'General case' 0 CA--C 1.545 0.761 0 CA-C-N 114.293 -1.321 . . . . 0.0 111.681 -179.045 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 81' ' ' ALA . . . . . 0.425 ' HB1' HD11 ' A' ' 62' ' ' LEU . . . -68.84 -43.32 75.73 Favored 'General case' 0 N--CA 1.478 0.975 0 C-N-CA 123.516 0.727 . . . . 0.0 111.443 -177.639 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 82' ' ' TYR . . . . . 0.578 ' CD2' HD11 ' A' ' 34' ' ' LEU . 86.5 t80 -58.64 -55.31 36.77 Favored 'General case' 0 N--CA 1.476 0.853 0 C-N-CA 124.276 1.03 . . . . 0.0 110.408 -179.334 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 83' ' ' ASN . . . . . . . . . . . . . 93.0 m-20 -64.9 -34.7 79.02 Favored 'General case' 0 N--CA 1.477 0.879 0 C-N-CA 123.43 0.692 . . . . 0.0 111.545 -175.992 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 24.5 m170 -72.29 -26.81 62.12 Favored 'General case' 0 N--CA 1.487 1.419 0 C-N-CA 123.225 0.61 . . . . 0.0 112.354 176.965 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 85' ' ' LEU . . . . . 0.5 ' HG ' ' HD2' ' A' ' 91' ' ' PHE . 43.5 tp -57.1 -53.09 61.99 Favored 'General case' 0 N--CA 1.485 1.31 0 CA-C-O 121.935 0.874 . . . . 0.0 110.768 178.223 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 86' ' ' PHE . . . . . 0.425 ' HA ' ' HE2' ' A' ' 91' ' ' PHE . 31.7 m-85 -74.2 -32.23 62.95 Favored 'General case' 0 CA--C 1.54 0.587 0 CA-C-N 113.532 -1.667 . . . . 0.0 110.974 -177.916 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 34.2 tt0 -61.26 -44.86 96.55 Favored 'General case' 0 N--CA 1.48 1.055 0 C-N-CA 123.928 0.891 . . . . 0.0 111.847 -176.2 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 37.4 p -109.59 6.67 24.12 Favored 'General case' 0 CA--C 1.544 0.743 0 C-N-CA 123.644 0.778 . . . . 0.0 111.418 -176.004 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 13.4 mmmm 57.14 35.09 25.82 Favored 'General case' 0 N--CA 1.492 1.629 0 C-N-CA 124.471 1.108 . . . . 0.0 111.504 173.644 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 47.2 mtt-85 -65.74 -24.02 66.86 Favored 'General case' 0 N--CA 1.491 1.624 0 N-CA-C 113.518 0.933 . . . . 0.0 113.518 -172.146 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 91' ' ' PHE . . . . . 0.5 ' HD2' ' HG ' ' A' ' 85' ' ' LEU . 5.5 p90 -57.51 161.56 3.44 Favored 'General case' 0 CA--C 1.551 0.996 0 N-CA-C 114.351 1.241 . . . . 0.0 114.351 -172.946 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 16.3 ptmt . . . . . 0 CA--C 1.562 1.413 0 C-N-CA 126.101 1.76 . . . . 0.0 113.573 -171.198 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.547 0.847 0 CA-C-O 121.391 0.615 . . . . 0.0 111.135 . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -82.0 -29.72 31.94 Favored 'General case' 0 N--CA 1.473 0.695 0 CA-C-N 115.193 -0.912 . . . . 0.0 108.787 176.439 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 29' ' ' TRP . . . . . . . . . . . . . 4.8 m-90 -134.63 146.51 49.63 Favored 'General case' 0 N--CA 1.464 0.274 0 CA-C-N 114.065 -1.425 . . . . 0.0 108.95 -177.28 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 22.7 p -86.59 175.35 8.36 Favored 'General case' 0 N--CA 1.472 0.641 0 N-CA-C 108.967 -0.753 . . . . 0.0 108.967 170.375 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . 0.482 ' HA ' HD12 ' A' ' 34' ' ' LEU . 14.8 p -62.21 -31.92 53.07 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.214 0 C-N-CA 122.693 0.397 . . . . 0.0 111.319 -176.157 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 12.5 pt-20 -70.99 -38.78 72.71 Favored 'General case' 0 N--CA 1.48 1.063 0 C-N-CA 124.003 0.921 . . . . 0.0 111.79 176.681 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 53.1 mt-30 -69.11 -38.15 78.76 Favored 'General case' 0 N--CA 1.477 0.92 0 C-N-CA 122.921 0.488 . . . . 0.0 110.554 176.171 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.482 HD12 ' HA ' ' A' ' 31' ' ' VAL . 87.3 mt -63.48 -50.93 67.75 Favored 'General case' 0 N--CA 1.48 1.062 0 C-N-CA 123.482 0.713 . . . . 0.0 111.171 -178.719 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 35' ' ' ARG . . . . . 0.445 HH21 HG22 ' A' ' 31' ' ' VAL . 18.6 ptp180 -69.89 -12.93 61.99 Favored 'General case' 0 CA--C 1.553 1.067 0 O-C-N 124.18 0.925 . . . . 0.0 111.474 -175.97 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 35.7 t -63.23 118.27 7.73 Favored 'General case' 0 N--CA 1.472 0.635 0 C-N-CA 123.387 0.675 . . . . 0.0 109.219 173.721 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 14.1 pt-20 -64.4 -30.21 71.25 Favored 'General case' 0 CA--C 1.548 0.879 0 C-N-CA 123.376 0.67 . . . . 0.0 111.725 -176.893 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 77.6 mt-30 -66.91 -19.06 65.66 Favored 'General case' 0 N--CA 1.484 1.252 0 C-N-CA 123.652 0.781 . . . . 0.0 111.584 179.942 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 1.8 tt -79.12 116.4 59.91 Favored Pre-proline 0 CA--C 1.551 1.008 0 N-CA-C 106.429 -1.693 . . . . 0.0 106.429 170.795 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 19.2 Cg_endo -58.57 119.97 7.55 Favored 'Trans proline' 0 C--N 1.378 2.085 0 C-N-CA 122.722 2.281 . . . . 0.0 111.62 177.011 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 41' ' ' LYS . . . . . 0.412 ' HE3' ' HB1' ' A' ' 70' ' ' ALA . 58.2 pttt -56.65 -30.48 63.4 Favored 'General case' 0 N--CA 1.48 1.068 0 C-N-CA 125.039 1.335 . . . . 0.0 112.67 -177.987 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . 0.433 ' HA ' HD12 ' A' ' 45' ' ' ILE . 22.5 pttp -71.41 -31.96 67.84 Favored 'General case' 0 CA--C 1.545 0.755 0 C-N-CA 123.408 0.683 . . . . 0.0 110.796 -179.486 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -73.28 -25.94 60.88 Favored 'General case' 0 N--CA 1.478 0.926 0 C-N-CA 123.028 0.531 . . . . 0.0 110.814 177.624 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 59.9 mt -67.68 -51.18 53.66 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.93 0 N-CA-C 109.294 -0.632 . . . . 0.0 109.294 171.649 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 45' ' ' ILE . . . . . 0.433 HD12 ' HA ' ' A' ' 42' ' ' LYS . 62.8 mt -54.25 -41.84 53.97 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.694 0 C-N-CA 123.827 0.851 . . . . 0.0 110.41 175.911 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 37.1 ttpt -63.45 -41.65 98.65 Favored 'General case' 0 CA--C 1.543 0.68 0 C-N-CA 124.625 1.17 . . . . 0.0 111.419 -178.089 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 27.4 t80 -66.02 -47.63 73.8 Favored 'General case' 0 N--CA 1.479 0.999 0 CA-C-N 115.794 -0.639 . . . . 0.0 111.015 178.116 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 84.9 mt -70.41 -29.83 66.55 Favored 'General case' 0 N--CA 1.471 0.61 0 C-N-CA 123.883 0.873 . . . . 0.0 111.947 -174.287 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 2.9 pt20 -79.57 -26.61 41.31 Favored 'General case' 0 N--CA 1.484 1.248 0 O-C-N 123.13 0.269 . . . . 0.0 110.482 175.163 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 43.5 tt0 -66.14 -26.98 67.69 Favored 'General case' 0 N--CA 1.482 1.153 0 C-N-CA 123.697 0.799 . . . . 0.0 112.003 -177.332 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 51' ' ' HIS . . . . . 0.471 ' NE2' HD13 ' A' ' 85' ' ' LEU . 47.7 p-80 -126.62 -17.01 5.14 Favored 'General case' 0 N--CA 1.486 1.334 0 N-CA-C 112.952 0.723 . . . . 0.0 112.952 -179.645 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -73.19 142.99 32.45 Favored Glycine 0 N--CA 1.472 1.052 0 CA-C-N 118.132 0.424 . . . . 0.0 112.593 176.247 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 53' ' ' SER . . . . . 0.441 ' O ' ' HG ' ' A' ' 57' ' ' LEU . 32.7 t -76.1 155.18 34.96 Favored 'General case' 0 N--CA 1.48 1.039 0 C-N-CA 123.142 0.577 . . . . 0.0 110.26 177.052 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 22.1 m-20 -63.73 -31.83 73.12 Favored 'General case' 0 N--CA 1.492 1.634 0 C-N-CA 123.204 0.602 . . . . 0.0 112.493 -170.473 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 28.9 t -70.05 -28.26 65.31 Favored 'General case' 0 N--CA 1.474 0.76 0 C-N-CA 123.179 0.592 . . . . 0.0 110.869 179.575 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 82.1 t80 -74.92 -48.97 21.86 Favored 'General case' 0 CA--C 1.545 0.759 0 N-CA-C 109.589 -0.523 . . . . 0.0 109.589 170.102 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . 0.441 ' HG ' ' O ' ' A' ' 53' ' ' SER . 79.0 mt -60.07 -46.62 88.96 Favored 'General case' 0 C--O 1.213 -0.839 0 CA-C-N 115.144 -0.934 . . . . 0.0 111.867 -169.965 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -64.63 -44.8 89.35 Favored 'General case' 0 N--CA 1.481 1.105 0 C-N-CA 123.729 0.811 . . . . 0.0 111.704 -177.361 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 19.1 mm-40 -62.03 -21.66 65.08 Favored 'General case' 0 N--CA 1.483 1.204 0 C-N-CA 123.186 0.595 . . . . 0.0 112.192 177.39 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 21.3 m80 -113.95 1.15 14.62 Favored 'General case' 0 N--CA 1.488 1.448 0 C-N-CA 123.611 0.764 . . . . 0.0 111.098 179.083 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 38.4 mtmm 56.99 25.68 10.96 Favored 'General case' 0 N--CA 1.483 1.202 0 C-N-CA 125.47 1.508 . . . . 0.0 113.706 -179.91 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . 0.45 HD11 ' HB1' ' A' ' 81' ' ' ALA . 90.0 mt -76.09 -14.77 60.18 Favored 'General case' 0 N--CA 1.477 0.886 0 C-N-CA 123.006 0.523 . . . . 0.0 112.344 -178.597 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 2.0 pp -86.08 174.99 8.8 Favored 'General case' 0 N--CA 1.479 1.013 0 CA-C-O 121.018 0.437 . . . . 0.0 110.946 176.109 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 84.53 -163.35 38.76 Favored Glycine 0 C--N 1.344 0.994 0 CA-C-N 115.481 -0.781 . . . . 0.0 112.384 179.473 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 30.4 m-80 -61.92 110.2 1.48 Allowed 'General case' 0 C--N 1.354 0.767 0 N-CA-C 109.139 -0.689 . . . . 0.0 109.139 176.491 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 66' ' ' ILE . . . . . 0.417 HG22 ' HB2' ' A' ' 42' ' ' LYS . 75.0 mt -61.02 -38.91 80.56 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.702 0 O-C-N 124.119 0.887 . . . . 0.0 110.769 -176.42 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 61.9 pttt -59.31 -36.89 76.44 Favored 'General case' 0 CA--C 1.553 1.084 0 C-N-CA 123.503 0.721 . . . . 0.0 111.271 176.483 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 68' ' ' ASN . . . . . 0.411 ' O ' ' HG2' ' A' ' 71' ' ' LYS . 48.3 t-20 -72.22 -44.5 62.83 Favored 'General case' 0 N--CA 1.478 0.97 0 C-N-CA 123.459 0.704 . . . . 0.0 109.726 179.594 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 69' ' ' VAL . . . . . 0.423 HG12 ' HB2' ' A' ' 73' ' ' ALA . 98.0 t -60.58 -39.03 80.09 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.733 0 CA-C-N 115.707 -0.679 . . . . 0.0 110.49 178.457 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 70' ' ' ALA . . . . . 0.435 ' HA ' ' HB3' ' A' ' 73' ' ' ALA . . . -63.29 -17.25 62.32 Favored 'General case' 0 N--CA 1.478 0.967 0 C-N-CA 124.416 1.086 . . . . 0.0 113.282 -175.215 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . 0.411 ' HG2' ' O ' ' A' ' 68' ' ' ASN . 16.1 ptpt -75.61 -22.27 57.02 Favored 'General case' 0 N--CA 1.489 1.521 0 CA-C-N 118.49 0.586 . . . . 0.0 110.91 -178.754 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 13.5 t -122.12 -12.31 8.33 Favored 'General case' 0 CA--C 1.543 0.703 0 C-N-CA 124.169 0.987 . . . . 0.0 110.607 -179.135 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . 0.526 ' HB1' HD21 ' A' ' 78' ' ' LEU . . . -77.49 86.19 3.85 Favored 'General case' 0 C--N 1.349 0.552 0 CA-C-O 121.461 0.648 . . . . 0.0 109.67 179.673 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 74' ' ' ASN . . . . . 0.431 ' ND2' ' HB3' ' A' ' 76' ' ' ASP . 7.9 p-10 -73.12 150.36 42.29 Favored 'General case' 0 C--O 1.24 0.58 0 CA-C-N 114.507 -1.224 . . . . 0.0 108.548 174.838 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 2.1 ttmp? -68.96 -26.66 65.16 Favored 'General case' 0 CA--C 1.544 0.72 0 C-N-CA 123.4 0.68 . . . . 0.0 111.482 -167.125 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 76' ' ' ASP . . . . . 0.431 ' HB3' ' ND2' ' A' ' 74' ' ' ASN . 28.4 t70 -62.95 -43.24 99.33 Favored 'General case' 0 N--CA 1.478 0.959 0 C-N-CA 123.555 0.742 . . . . 0.0 110.604 173.868 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 61.0 t60 -61.95 -42.39 99.05 Favored 'General case' 0 N--CA 1.482 1.165 0 C-N-CA 124.404 1.082 . . . . 0.0 110.664 175.857 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . 0.526 HD21 ' HB1' ' A' ' 73' ' ' ALA . 96.3 mt -65.1 -38.64 91.37 Favored 'General case' 0 N--CA 1.481 1.083 0 C-N-CA 123.571 0.748 . . . . 0.0 112.196 -175.392 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 98.2 t -69.24 -40.33 80.21 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.942 0 CA-C-N 115.606 -0.724 . . . . 0.0 110.503 176.085 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 57.2 m -62.21 -41.47 98.41 Favored 'General case' 0 N--CA 1.48 1.048 0 C-N-CA 123.273 0.629 . . . . 0.0 111.118 177.31 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 81' ' ' ALA . . . . . 0.45 ' HB1' HD11 ' A' ' 62' ' ' LEU . . . -68.74 -42.19 77.92 Favored 'General case' 0 CA--C 1.543 0.699 0 C-N-CA 123.436 0.694 . . . . 0.0 110.659 178.492 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 82' ' ' TYR . . . . . . . . . . . . . 7.5 t80 -52.08 -55.55 20.02 Favored 'General case' 0 N--CA 1.475 0.802 0 C-N-CA 124.434 1.094 . . . . 0.0 110.542 175.61 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 83' ' ' ASN . . . . . . . . . . . . . 28.9 m-80 -64.37 -45.71 86.54 Favored 'General case' 0 N--CA 1.482 1.153 0 C-N-CA 123.31 0.644 . . . . 0.0 111.594 -175.855 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 23.9 m-70 -62.01 -25.37 67.6 Favored 'General case' 0 N--CA 1.481 1.084 0 C-N-CA 123.484 0.714 . . . . 0.0 111.827 -179.541 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 85' ' ' LEU . . . . . 0.471 HD13 ' NE2' ' A' ' 51' ' ' HIS . 2.9 mt -60.85 -52.36 65.38 Favored 'General case' 0 N--CA 1.476 0.857 0 CA-C-O 120.766 0.317 . . . . 0.0 111.126 173.139 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 60.8 m-85 -72.97 -30.68 64.02 Favored 'General case' 0 CA--C 1.553 1.083 0 CA-C-N 115.475 -0.784 . . . . 0.0 111.092 -176.837 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 37.4 tt0 -48.36 -48.55 36.43 Favored 'General case' 0 N--CA 1.491 1.597 0 C-N-CA 126.055 1.742 . . . . 0.0 113.83 -173.532 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 27.3 p -120.62 -4.04 9.79 Favored 'General case' 0 CA--C 1.538 0.492 0 C-N-CA 124.342 1.057 . . . . 0.0 109.99 -178.71 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 32.1 mtmm 62.23 69.88 0.6 Allowed 'General case' 0 C--N 1.357 0.922 0 C-N-CA 124.402 1.081 . . . . 0.0 109.783 -173.843 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 44.6 mtt85 -86.01 15.02 5.36 Favored 'General case' 0 N--CA 1.489 1.524 0 C-N-CA 125.244 1.417 . . . . 0.0 111.837 175.816 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 91' ' ' PHE . . . . . . . . . . . . . 1.8 m-30 -56.67 160.11 3.51 Favored 'General case' 0 N--CA 1.477 0.901 0 C-N-CA 124.646 1.178 . . . . 0.0 111.331 171.356 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 92' ' ' LYS . . . . . 0.437 ' HE3' ' HA ' ' A' ' 53' ' ' SER . 40.7 ttmt . . . . . 0 C--O 1.249 1.058 0 N-CA-C 108.106 -1.072 . . . . 0.0 108.106 -179.617 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' MET . . . . . . . . . . . . . 37.2 tpp . . . . . 0 N--CA 1.483 1.204 0 CA-C-O 120.441 0.162 . . . . 0.0 110.855 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -69.04 105.07 2.29 Favored 'General case' 0 C--N 1.353 0.76 0 C-N-CA 123.106 0.562 . . . . 0.0 109.597 175.474 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . 62.31 56.63 2.11 Favored 'General case' 0 CA--C 1.548 0.898 0 C-N-CA 124.841 1.256 . . . . 0.0 110.779 -175.84 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -92.11 116.32 28.84 Favored 'General case' 0 N--CA 1.475 0.792 0 CA-C-N 115.371 -0.831 . . . . 0.0 109.512 177.42 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 26.8 m -64.78 145.2 98.89 Favored Pre-proline 0 N--CA 1.481 1.113 0 C-N-CA 123.789 0.836 . . . . 0.0 111.332 -177.862 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 5.8 Cg_exo -74.78 98.42 1.14 Allowed 'Trans proline' 0 C--N 1.373 1.847 0 C-N-CA 123.057 2.505 . . . . 0.0 112.229 -176.541 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 26.3 mt-30 -78.31 117.08 19.21 Favored 'General case' 0 C--O 1.249 1.077 0 N-CA-C 106.614 -1.624 . . . . 0.0 106.614 165.647 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . 0.48 ' HD3' ' H ' ' A' ' 27' ' ' ARG . 0.0 OUTLIER -55.21 123.16 12.81 Favored 'General case' 0 CA--C 1.541 0.612 0 O-C-N 123.889 0.743 . . . . 0.0 111.056 -176.717 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -76.24 -37.39 57.74 Favored 'General case' 0 N--CA 1.472 0.627 0 CA-C-N 114.53 -1.214 . . . . 0.0 109.919 -176.859 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' TRP . . . . . . . . . . . . . 2.5 m-90 -120.94 148.13 44.5 Favored 'General case' 0 N--CA 1.471 0.6 0 CA-C-N 114.932 -1.031 . . . . 0.0 109.1 -177.279 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 76.3 p -87.18 175.33 8.11 Favored 'General case' 0 CA--C 1.54 0.596 0 C-N-CA 123.073 0.549 . . . . 0.0 110.006 176.167 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . 0.436 HG12 ' HE ' ' A' ' 35' ' ' ARG . 51.8 t -55.87 -46.26 80.07 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.052 0 C-N-CA 123.687 0.795 . . . . 0.0 111.484 -178.732 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 12.7 pt-20 -66.94 -41.51 86.87 Favored 'General case' 0 N--CA 1.475 0.782 0 C-N-CA 123.335 0.654 . . . . 0.0 111.403 -179.245 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 55.3 mt-30 -60.17 -36.52 77.76 Favored 'General case' 0 N--CA 1.479 0.995 0 C-N-CA 123.196 0.598 . . . . 0.0 110.974 178.329 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 85.0 mt -70.19 -51.43 31.1 Favored 'General case' 0 N--CA 1.469 0.497 0 C-N-CA 122.74 0.416 . . . . 0.0 110.427 178.864 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . 0.436 ' HE ' HG12 ' A' ' 31' ' ' VAL . 50.5 mtm180 -57.27 -28.45 62.99 Favored 'General case' 0 N--CA 1.484 1.251 0 C-N-CA 123.913 0.885 . . . . 0.0 111.755 -179.371 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 44.6 t -53.93 122.19 9.56 Favored 'General case' 0 CA--C 1.541 0.619 0 C-N-CA 124.262 1.025 . . . . 0.0 110.941 174.848 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 10.9 pt-20 -71.14 -8.82 56.07 Favored 'General case' 0 CA--C 1.549 0.939 0 C-N-CA 123.973 0.909 . . . . 0.0 111.482 179.038 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 95.7 mt-30 -65.89 -47.92 73.2 Favored 'General case' 0 N--CA 1.472 0.667 0 C-N-CA 123.914 0.886 . . . . 0.0 109.712 168.753 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 3.8 tt -76.89 116.92 61.25 Favored Pre-proline 0 CA--C 1.553 1.085 0 N-CA-C 108.126 -1.065 . . . . 0.0 108.126 179.509 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 32.4 Cg_exo -61.63 165.45 13.58 Favored 'Trans proline' 0 C--N 1.38 2.187 0 C-N-CA 123.479 2.786 . . . . 0.0 114.126 176.763 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 36.6 mtmm -81.54 -25.94 35.48 Favored 'General case' 0 N--CA 1.475 0.82 0 CA-C-N 115.722 -0.672 . . . . 0.0 111.004 179.536 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 18.5 ptpt -64.77 -48.11 75.68 Favored 'General case' 0 CA--C 1.547 0.865 0 C-N-CA 123.524 0.73 . . . . 0.0 112.797 -171.394 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 13.6 p-10 -73.28 -23.65 60.33 Favored 'General case' 0 N--CA 1.478 0.936 0 C-N-CA 122.666 0.386 . . . . 0.0 111.852 -176.794 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 54.2 mt -66.89 -52.69 41.76 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.084 0 C-N-CA 123.071 0.549 . . . . 0.0 110.1 171.496 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 80.3 mt -60.13 -34.73 57.92 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.17 0 C-N-CA 123.132 0.573 . . . . 0.0 110.416 177.545 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 2.7 tmtp? -59.77 -50.29 74.41 Favored 'General case' 0 N--CA 1.474 0.761 0 C-N-CA 123.714 0.806 . . . . 0.0 109.075 175.498 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 24.0 t80 -58.77 -45.16 90.39 Favored 'General case' 0 N--CA 1.485 1.319 0 C-N-CA 124.035 0.934 . . . . 0.0 111.627 179.978 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . 0.486 ' HB3' ' HE2' ' A' ' 56' ' ' PHE . 92.4 mt -72.01 -32.3 67.05 Favored 'General case' 0 CA--C 1.545 0.782 0 CA-C-N 115.277 -0.874 . . . . 0.0 111.816 -175.879 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . 0.559 ' HA ' HD21 ' A' ' 57' ' ' LEU . 3.0 pt20 -85.53 -23.86 27.52 Favored 'General case' 0 N--CA 1.491 1.594 0 C-N-CA 122.724 0.41 . . . . 0.0 112.013 175.051 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 8.5 tp10 -58.36 -39.04 78.47 Favored 'General case' 0 N--CA 1.482 1.165 0 C-N-CA 124.458 1.103 . . . . 0.0 111.24 -179.759 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 2.0 m80 -132.59 -30.23 1.47 Allowed 'General case' 0 N--CA 1.479 0.98 0 CA-C-O 119.034 -0.508 . . . . 0.0 112.169 -175.004 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -59.31 120.16 21.41 Favored Glycine 0 N--CA 1.478 1.434 0 CA-C-O 119.489 -0.617 . . . . 0.0 111.949 175.758 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 22.8 t -70.97 176.44 4.35 Favored 'General case' 0 N--CA 1.484 1.246 0 C-N-CA 123.607 0.763 . . . . 0.0 112.17 -171.251 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 5.6 p-10 -58.57 -36.49 74.02 Favored 'General case' 0 N--CA 1.48 1.056 0 C-N-CA 124.292 1.037 . . . . 0.0 113.429 -168.16 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 27.8 t -69.38 -40.7 77.26 Favored 'General case' 0 N--CA 1.476 0.827 0 C-N-CA 122.839 0.456 . . . . 0.0 110.096 -178.998 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 56' ' ' PHE . . . . . 0.64 ' HB2' ' HB3' ' A' ' 90' ' ' ARG . 65.7 t80 -59.69 -49.29 78.33 Favored 'General case' 0 N--CA 1.477 0.906 0 CA-C-O 121.378 0.609 . . . . 0.0 110.368 175.454 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . 0.559 HD21 ' HA ' ' A' ' 49' ' ' GLN . 68.7 mt -67.71 -31.78 71.96 Favored 'General case' 0 C--O 1.221 -0.424 0 CA-C-N 114.626 -1.17 . . . . 0.0 112.082 -176.128 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -73.68 -49.97 23.2 Favored 'General case' 0 N--CA 1.478 0.943 0 C-N-CA 122.798 0.439 . . . . 0.0 111.647 179.345 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 43.6 mt-10 -67.17 -36.59 82.12 Favored 'General case' 0 N--CA 1.485 1.301 0 C-N-CA 123.58 0.752 . . . . 0.0 111.612 -177.782 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 42.6 m-70 -98.77 -4.96 32.22 Favored 'General case' 0 N--CA 1.478 0.972 0 C-N-CA 123.122 0.569 . . . . 0.0 111.892 -177.85 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 62.9 mttp 58.56 41.35 22.54 Favored 'General case' 0 N--CA 1.496 1.849 0 C-N-CA 124.482 1.113 . . . . 0.0 112.641 175.736 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 85.1 mt -102.73 0.94 33.72 Favored 'General case' 0 N--CA 1.479 1.0 0 C-N-CA 123.592 0.757 . . . . 0.0 111.487 -178.749 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . 0.433 ' HB3' ' HB3' ' A' ' 57' ' ' LEU . 1.1 pp -77.07 160.73 28.85 Favored 'General case' 0 N--CA 1.483 1.206 0 C-N-CA 122.95 0.5 . . . . 0.0 111.369 174.651 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 89.28 -158.67 27.99 Favored Glycine 0 C--N 1.338 0.666 0 CA-C-N 115.167 -0.924 . . . . 0.0 112.942 173.79 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 36.8 m-80 -61.91 118.3 7.05 Favored 'General case' 0 CA--C 1.539 0.541 0 C-N-CA 123.573 0.749 . . . . 0.0 110.423 179.957 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 84.4 mt -50.05 -51.89 15.7 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.117 0 C-N-CA 124.136 0.975 . . . . 0.0 111.398 -177.617 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 67' ' ' LYS . . . . . 0.44 ' HD3' ' H ' ' A' ' 67' ' ' LYS . 0.0 OUTLIER -61.76 -38.55 88.44 Favored 'General case' 0 CA--C 1.552 1.047 0 C-N-CA 123.47 0.708 . . . . 0.0 112.148 -178.399 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 23.9 t-20 -61.54 -38.34 87.06 Favored 'General case' 0 N--CA 1.485 1.311 0 C-N-CA 123.411 0.684 . . . . 0.0 110.777 175.841 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 99.2 t -73.5 -39.72 54.75 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.786 0 CA-C-N 115.183 -0.917 . . . . 0.0 110.355 175.141 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -69.35 -26.71 64.82 Favored 'General case' 0 N--CA 1.484 1.232 0 C-N-CA 124.388 1.075 . . . . 0.0 112.589 -171.902 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 22.1 ptmt -76.82 -17.13 59.2 Favored 'General case' 0 N--CA 1.477 0.91 0 C-N-CA 122.425 0.29 . . . . 0.0 111.523 -179.94 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 9.1 t -120.98 2.29 10.46 Favored 'General case' 0 CA--C 1.55 0.966 0 C-N-CA 123.94 0.896 . . . . 0.0 110.452 177.801 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . 0.423 ' HB1' HD21 ' A' ' 78' ' ' LEU . . . -91.95 121.16 33.28 Favored 'General case' 0 N--CA 1.47 0.55 0 C-N-CA 123.148 0.579 . . . . 0.0 109.932 175.063 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 12.5 p-10 -93.42 145.92 24.13 Favored 'General case' 0 N--CA 1.473 0.678 0 N-CA-C 108.493 -0.929 . . . . 0.0 108.493 168.829 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 4.6 tppp? -59.64 -42.3 92.45 Favored 'General case' 0 N--CA 1.477 0.88 0 C-N-CA 123.842 0.857 . . . . 0.0 112.143 -169.839 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 6.2 p-10 -64.5 -32.45 74.08 Favored 'General case' 0 N--CA 1.477 0.893 0 C-N-CA 123.265 0.626 . . . . 0.0 111.833 -177.102 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 47.5 t60 -68.37 -34.91 76.91 Favored 'General case' 0 N--CA 1.487 1.376 0 C-N-CA 123.484 0.713 . . . . 0.0 110.465 174.046 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . 0.423 HD21 ' HB1' ' A' ' 73' ' ' ALA . 84.4 mt -70.23 -35.33 73.79 Favored 'General case' 0 N--CA 1.479 0.977 0 C-N-CA 122.892 0.477 . . . . 0.0 111.465 -179.174 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 53.4 t -71.71 -37.95 64.54 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.788 0 O-C-N 124.084 0.865 . . . . 0.0 110.045 176.748 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 63.6 m -61.49 -47.17 86.87 Favored 'General case' 0 CA--C 1.545 0.756 0 CA-C-N 115.625 -0.716 . . . . 0.0 110.265 173.216 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -63.48 -41.63 98.58 Favored 'General case' 0 N--CA 1.476 0.825 0 C-N-CA 123.606 0.762 . . . . 0.0 110.951 -179.608 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 82' ' ' TYR . . . . . . . . . . . . . 7.8 t80 -55.77 -55.49 31.72 Favored 'General case' 0 CA--C 1.543 0.711 0 C-N-CA 124.954 1.302 . . . . 0.0 111.11 175.964 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 83' ' ' ASN . . . . . . . . . . . . . 70.7 m-20 -65.17 -41.09 94.98 Favored 'General case' 0 N--CA 1.486 1.36 0 C-N-CA 123.302 0.641 . . . . 0.0 111.683 -175.924 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 22.2 m-70 -68.79 -25.58 64.77 Favored 'General case' 0 N--CA 1.479 0.979 0 C-N-CA 123.878 0.871 . . . . 0.0 111.567 178.171 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 85' ' ' LEU . . . . . 0.519 ' HG ' ' HD2' ' A' ' 91' ' ' PHE . 51.2 tp -57.57 -53.95 52.42 Favored 'General case' 0 N--CA 1.487 1.405 0 CA-C-O 121.831 0.824 . . . . 0.0 111.069 178.872 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 43.4 m-85 -73.11 -30.9 63.97 Favored 'General case' 0 CA--C 1.538 0.506 0 CA-C-N 113.787 -1.551 . . . . 0.0 110.889 -177.174 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 44.9 tt0 -66.51 -30.33 70.62 Favored 'General case' 0 CA--C 1.548 0.871 0 C-N-CA 124.141 0.976 . . . . 0.0 111.774 -176.221 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 11.6 p -116.98 2.58 12.74 Favored 'General case' 0 N--CA 1.48 1.071 0 C-N-CA 123.421 0.688 . . . . 0.0 111.618 179.153 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 27.2 mtpp 58.21 30.97 20.2 Favored 'General case' 0 N--CA 1.485 1.285 0 C-N-CA 123.92 0.888 . . . . 0.0 111.815 177.461 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 90' ' ' ARG . . . . . 0.64 ' HB3' ' HB2' ' A' ' 56' ' ' PHE . 53.2 mtt85 -62.8 -12.36 23.88 Favored 'General case' 0 N--CA 1.489 1.513 0 C-N-CA 124.14 0.976 . . . . 0.0 113.095 -175.748 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 91' ' ' PHE . . . . . 0.519 ' HD2' ' HG ' ' A' ' 85' ' ' LEU . 6.9 p90 -77.15 161.66 28.05 Favored 'General case' 0 CA--C 1.542 0.644 0 C-N-CA 123.462 0.705 . . . . 0.0 112.046 174.997 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 19.4 ptmt . . . . . 0 CA--C 1.557 1.218 0 N-CA-C 108.127 -1.064 . . . . 0.0 108.127 169.047 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 20' ' ' MET . . . . . . . . . . . . . 85.6 mtp . . . . . 0 N--CA 1.478 0.951 0 N-CA-C 109.703 -0.48 . . . . 0.0 109.703 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -70.67 93.57 0.94 Allowed 'General case' 0 N--CA 1.473 0.695 0 N-CA-C 108.453 -0.943 . . . . 0.0 108.453 173.877 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -83.75 106.21 15.27 Favored 'General case' 0 C--O 1.239 0.511 0 C-N-CA 123.75 0.82 . . . . 0.0 110.83 -175.544 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -73.3 101.48 3.42 Favored 'General case' 0 N--CA 1.471 0.596 0 C-N-CA 123.092 0.557 . . . . 0.0 109.557 174.85 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 9.2 m -93.25 109.07 37.74 Favored Pre-proline 0 CA--C 1.548 0.899 0 C-N-CA 122.855 0.462 . . . . 0.0 109.835 177.117 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 25' ' ' PRO . . . . . 0.43 ' HB2' ' HE1' ' A' ' 86' ' ' PHE . 11.2 Cg_exo -71.51 101.22 1.12 Allowed 'Trans proline' 0 C--N 1.373 1.852 0 C-N-CA 122.942 2.428 . . . . 0.0 110.606 175.787 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 12.0 pt20 -77.37 125.51 29.44 Favored 'General case' 0 C--O 1.24 0.568 0 N-CA-C 108.118 -1.067 . . . . 0.0 108.118 173.868 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 38.0 ttp180 -65.04 107.55 1.55 Allowed 'General case' 0 CA--C 1.537 0.473 0 N-CA-C 109.279 -0.638 . . . . 0.0 109.279 176.405 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -93.83 -15.95 24.58 Favored 'General case' 0 N--CA 1.47 0.53 0 CA-C-N 114.485 -1.234 . . . . 0.0 110.847 -174.898 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 29' ' ' TRP . . . . . . . . . . . . . 4.1 m0 -130.57 132.31 45.48 Favored 'General case' 0 N--CA 1.466 0.357 0 C-N-CA 123.791 0.836 . . . . 0.0 108.9 -174.062 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 64.7 p -80.4 174.1 11.94 Favored 'General case' 0 C--O 1.245 0.844 0 N-CA-C 108.912 -0.773 . . . . 0.0 108.912 167.927 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . 0.433 ' HA ' HD12 ' A' ' 34' ' ' LEU . 13.5 p -57.35 -35.38 48.97 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.262 0 C-N-CA 122.565 0.346 . . . . 0.0 111.38 -174.724 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 14.8 pt-20 -73.73 -37.75 65.0 Favored 'General case' 0 CA--C 1.551 0.99 0 C-N-CA 123.963 0.905 . . . . 0.0 111.635 178.879 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 33' ' ' GLN . . . . . 0.413 ' O ' HD13 ' A' ' 39' ' ' LEU . 15.4 mm100 -67.49 -33.49 75.22 Favored 'General case' 0 N--CA 1.479 1.014 0 C-N-CA 123.311 0.644 . . . . 0.0 110.666 179.998 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.509 HD11 ' CD2' ' A' ' 82' ' ' TYR . 83.2 mt -59.02 -48.83 80.16 Favored 'General case' 0 N--CA 1.473 0.721 0 N-CA-C 109.256 -0.646 . . . . 0.0 109.256 171.738 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 29.6 mtp180 -68.09 -12.93 61.74 Favored 'General case' 0 N--CA 1.487 1.422 0 CA-C-N 114.638 -1.164 . . . . 0.0 113.221 -176.949 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 46.1 t -56.85 117.64 4.14 Favored 'General case' 0 N--CA 1.48 1.032 0 C-N-CA 123.67 0.788 . . . . 0.0 109.929 176.784 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 12.4 pt-20 -65.58 -33.93 77.06 Favored 'General case' 0 N--CA 1.48 1.044 0 C-N-CA 123.427 0.691 . . . . 0.0 112.06 -172.248 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 18.0 mm-40 -74.07 -22.53 59.49 Favored 'General case' 0 N--CA 1.471 0.597 0 C-N-CA 123.309 0.643 . . . . 0.0 111.19 179.65 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.413 HD13 ' O ' ' A' ' 33' ' ' GLN . 5.3 tt -76.2 116.97 60.77 Favored Pre-proline 0 CA--C 1.545 0.781 0 N-CA-C 107.281 -1.377 . . . . 0.0 107.281 171.002 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 17.9 Cg_exo -66.62 136.14 41.4 Favored 'Trans proline' 0 C--N 1.375 1.963 0 C-N-CA 122.831 2.354 . . . . 0.0 111.831 -177.895 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . 0.404 ' HB2' ' CD1' ' A' ' 78' ' ' LEU . 16.7 ptpt -64.72 -33.4 75.87 Favored 'General case' 0 CA--C 1.548 0.899 0 C-N-CA 122.963 0.505 . . . . 0.0 110.036 177.365 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 55.0 pttt -71.19 -27.06 63.24 Favored 'General case' 0 N--CA 1.478 0.956 0 C-N-CA 123.946 0.898 . . . . 0.0 111.356 179.912 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 14.9 t70 -63.34 -36.72 84.65 Favored 'General case' 0 CA--C 1.552 1.022 0 C-N-CA 122.97 0.508 . . . . 0.0 109.702 172.561 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 42.8 mt -73.28 -47.17 47.66 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.923 0 C-N-CA 123.902 0.881 . . . . 0.0 110.183 177.818 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 82.7 mt -56.82 -39.53 65.12 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.707 0 C-N-CA 123.553 0.741 . . . . 0.0 110.953 178.973 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 37.8 ttmt -62.96 -44.52 95.84 Favored 'General case' 0 N--CA 1.476 0.865 0 C-N-CA 123.254 0.622 . . . . 0.0 110.679 178.702 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 22.8 t80 -59.34 -46.39 88.74 Favored 'General case' 0 N--CA 1.478 0.951 0 CA-C-N 115.269 -0.878 . . . . 0.0 110.42 177.274 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . 0.407 ' HB3' ' HE2' ' A' ' 56' ' ' PHE . 96.6 mt -72.47 -30.76 64.84 Favored 'General case' 0 CA--C 1.539 0.555 0 CA-C-N 114.625 -1.171 . . . . 0.0 112.212 -175.187 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . 0.542 ' HA ' HD21 ' A' ' 57' ' ' LEU . 3.0 pt20 -84.08 -34.24 24.21 Favored 'General case' 0 N--CA 1.483 1.176 0 CA-C-N 117.895 0.316 . . . . 0.0 111.42 179.796 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 43.0 tt0 -67.89 -39.67 83.63 Favored 'General case' 0 N--CA 1.48 1.056 0 CA-C-O 121.403 0.621 . . . . 0.0 110.569 -179.913 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 51' ' ' HIS . . . . . 0.408 ' HB3' ' HG3' ' A' ' 25' ' ' PRO . 76.7 m80 -96.37 -49.8 5.03 Favored 'General case' 0 N--CA 1.469 0.503 0 CA-C-N 114.865 -1.061 . . . . 0.0 111.297 -175.584 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . 0.542 ' HA2' ' HA ' ' A' ' 91' ' ' PHE . . . -60.77 141.31 48.1 Favored Glycine 0 C--N 1.345 1.063 0 O-C-N 123.396 0.435 . . . . 0.0 113.698 178.505 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 16.8 t -88.54 174.03 8.31 Favored 'General case' 0 N--CA 1.479 1.016 0 C-N-CA 122.737 0.415 . . . . 0.0 111.296 -176.842 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 3.2 m-20 -48.29 -45.43 34.78 Favored 'General case' 0 N--CA 1.489 1.477 0 C-N-CA 125.839 1.656 . . . . 0.0 113.831 -170.187 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 42.0 t -66.35 -43.09 87.03 Favored 'General case' 0 N--CA 1.478 0.975 0 C-N-CA 123.402 0.681 . . . . 0.0 110.855 -178.386 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 56' ' ' PHE . . . . . 0.543 ' HB2' ' HB3' ' A' ' 90' ' ' ARG . 85.1 t80 -62.08 -40.2 95.01 Favored 'General case' 0 N--CA 1.48 1.037 0 C-N-CA 123.324 0.65 . . . . 0.0 110.316 176.499 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . 0.542 HD21 ' HA ' ' A' ' 49' ' ' GLN . 32.0 mt -73.01 -35.68 66.86 Favored 'General case' 0 C--O 1.218 -0.591 0 CA-C-N 115.095 -0.957 . . . . 0.0 111.906 -175.532 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -73.54 -49.32 27.07 Favored 'General case' 0 N--CA 1.473 0.69 0 C-N-CA 122.64 0.376 . . . . 0.0 110.785 179.416 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 27.2 mm-40 -55.15 -36.89 66.29 Favored 'General case' 0 N--CA 1.481 1.114 0 C-N-CA 123.756 0.822 . . . . 0.0 112.253 178.586 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 57.9 m80 -108.11 1.5 22.33 Favored 'General case' 0 CA--C 1.55 0.978 0 C-N-CA 123.022 0.529 . . . . 0.0 112.338 -177.117 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 57.4 mtpt 54.93 35.31 24.19 Favored 'General case' 0 N--CA 1.496 1.857 0 C-N-CA 124.405 1.082 . . . . 0.0 112.796 177.375 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 0.441 ' HA ' HG11 ' A' ' 69' ' ' VAL . 92.3 mt -90.13 -6.62 55.19 Favored 'General case' 0 N--CA 1.482 1.133 0 C-N-CA 123.483 0.713 . . . . 0.0 111.931 -176.319 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . 0.418 ' H ' ' HG ' ' A' ' 63' ' ' LEU . 1.2 pp -73.51 162.65 29.03 Favored 'General case' 0 N--CA 1.481 1.079 0 C-N-CA 123.749 0.82 . . . . 0.0 111.75 179.146 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 81.23 -148.26 28.05 Favored Glycine 0 CA--C 1.528 0.864 0 CA-C-N 115.353 -0.84 . . . . 0.0 113.613 174.614 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -68.0 113.96 6.13 Favored 'General case' 0 N--CA 1.478 0.949 0 C-N-CA 123.269 0.628 . . . . 0.0 109.505 -178.465 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 41.4 mt -55.02 -45.33 76.75 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.874 0 O-C-N 124.822 1.326 . . . . 0.0 110.968 -177.063 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 62.6 pttt -60.71 -37.44 81.69 Favored 'General case' 0 CA--C 1.554 1.114 0 C-N-CA 123.994 0.917 . . . . 0.0 111.93 179.459 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 68' ' ' ASN . . . . . 0.404 ' O ' ' HG2' ' A' ' 71' ' ' LYS . 61.5 t30 -72.75 -36.68 67.75 Favored 'General case' 0 N--CA 1.48 1.056 0 C-N-CA 123.376 0.67 . . . . 0.0 110.456 179.485 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 69' ' ' VAL . . . . . 0.441 HG11 ' HA ' ' A' ' 62' ' ' LEU . 57.8 t -66.25 -36.4 77.31 Favored 'Isoleucine or valine' 0 C--O 1.214 -0.789 0 CA-C-N 115.562 -0.745 . . . . 0.0 109.621 173.017 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -67.52 -15.42 63.65 Favored 'General case' 0 N--CA 1.478 0.962 0 C-N-CA 123.963 0.905 . . . . 0.0 113.349 -174.317 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . 0.404 ' HG2' ' O ' ' A' ' 68' ' ' ASN . 21.2 ptmt -94.65 -19.99 19.95 Favored 'General case' 0 N--CA 1.481 1.077 0 O-C-N 121.617 -0.677 . . . . 0.0 111.872 177.691 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 9.0 t -112.84 -15.07 12.99 Favored 'General case' 0 N--CA 1.484 1.23 0 C-N-CA 123.155 0.582 . . . . 0.0 111.716 -176.574 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -110.91 101.56 10.13 Favored 'General case' 0 C--O 1.24 0.56 0 C-N-CA 124.139 0.976 . . . . 0.0 108.41 178.892 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 26.1 p-10 -72.06 160.76 31.93 Favored 'General case' 0 CA--C 1.534 0.353 0 CA-C-N 116.242 -0.436 . . . . 0.0 110.277 177.009 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . 0.461 ' HD3' ' O ' ' A' ' 34' ' ' LEU . 36.8 ttmt -63.84 -33.28 75.34 Favored 'General case' 0 CA--C 1.543 0.704 0 C-N-CA 123.549 0.74 . . . . 0.0 111.708 -173.883 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 21.6 t70 -62.81 -33.18 74.69 Favored 'General case' 0 N--CA 1.485 1.321 0 C-N-CA 123.638 0.775 . . . . 0.0 110.857 178.985 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 40.9 t60 -70.63 -36.89 73.7 Favored 'General case' 0 N--CA 1.477 0.912 0 C-N-CA 124.603 1.161 . . . . 0.0 110.468 174.499 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . 0.404 ' CD1' ' HB2' ' A' ' 41' ' ' LYS . 60.8 mt -71.03 -31.24 67.67 Favored 'General case' 0 N--CA 1.483 1.179 0 C-N-CA 123.137 0.575 . . . . 0.0 111.577 -177.561 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 79' ' ' VAL . . . . . 0.42 HG23 ' O ' ' A' ' 75' ' ' LYS . 99.5 t -64.03 -44.27 97.74 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.759 0 O-C-N 123.959 0.787 . . . . 0.0 109.355 173.641 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 24.6 m -61.62 -42.79 99.38 Favored 'General case' 0 N--CA 1.474 0.746 0 CA-C-N 115.16 -0.927 . . . . 0.0 110.982 176.304 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -67.4 -39.97 85.58 Favored 'General case' 0 N--CA 1.473 0.698 0 C-N-CA 123.085 0.554 . . . . 0.0 111.04 178.271 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 82' ' ' TYR . . . . . 0.509 ' CD2' HD11 ' A' ' 34' ' ' LEU . 64.5 t80 -62.96 -56.97 12.46 Favored 'General case' 0 N--CA 1.472 0.658 0 C-N-CA 124.047 0.939 . . . . 0.0 110.419 -175.363 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 83' ' ' ASN . . . . . . . . . . . . . 27.8 m-80 -62.83 -40.69 98.2 Favored 'General case' 0 N--CA 1.482 1.141 0 C-N-CA 123.293 0.637 . . . . 0.0 111.25 -176.129 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 84' ' ' HIS . . . . . 0.409 ' HA ' ' HB3' ' A' ' 87' ' ' GLU . 13.2 m170 -70.08 -25.49 63.55 Favored 'General case' 0 N--CA 1.481 1.114 0 C-N-CA 123.773 0.829 . . . . 0.0 111.954 -179.465 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 85' ' ' LEU . . . . . 0.426 ' HG ' ' HD2' ' A' ' 91' ' ' PHE . 57.7 tp -56.71 -54.22 48.68 Favored 'General case' 0 N--CA 1.486 1.359 0 CA-C-O 121.912 0.863 . . . . 0.0 110.763 178.809 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 86' ' ' PHE . . . . . 0.43 ' HE1' ' HB2' ' A' ' 25' ' ' PRO . 20.1 m-85 -73.88 -32.06 63.43 Favored 'General case' 0 CA--C 1.554 1.114 0 CA-C-N 113.483 -1.689 . . . . 0.0 110.16 -178.605 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . 0.409 ' HB3' ' HA ' ' A' ' 84' ' ' HIS . 9.7 tp10 -68.85 -23.33 64.23 Favored 'General case' 0 N--CA 1.485 1.292 0 C-N-CA 124.718 1.207 . . . . 0.0 112.285 -174.352 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 19.9 p -128.39 5.24 5.71 Favored 'General case' 0 N--CA 1.487 1.415 0 C-N-CA 123.289 0.636 . . . . 0.0 111.867 179.694 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 14.3 mmmm 60.6 29.71 19.21 Favored 'General case' 0 N--CA 1.487 1.408 0 C-N-CA 124.109 0.964 . . . . 0.0 111.869 175.665 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 90' ' ' ARG . . . . . 0.543 ' HB3' ' HB2' ' A' ' 56' ' ' PHE . 52.2 mtt85 -66.81 -11.19 54.42 Favored 'General case' 0 N--CA 1.496 1.838 0 N-CA-C 114.403 1.26 . . . . 0.0 114.403 -171.079 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 91' ' ' PHE . . . . . 0.542 ' HA ' ' HA2' ' A' ' 52' ' ' GLY . 16.6 p90 -67.74 138.44 56.24 Favored 'General case' 0 CA--C 1.54 0.573 0 N-CA-C 112.484 0.55 . . . . 0.0 112.484 176.852 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 3.8 tmtp? . . . . . 0 CA--C 1.552 1.048 0 C-N-CA 125.153 1.381 . . . . 0.0 109.639 -178.796 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 20' ' ' MET . . . . . . . . . . . . . 23.2 ptt? . . . . . 0 N--CA 1.483 1.203 0 CA-C-O 120.602 0.239 . . . . 0.0 110.746 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -166.64 142.17 4.44 Favored 'General case' 0 N--CA 1.473 0.707 0 C-N-CA 124.355 1.062 . . . . 0.0 108.768 179.279 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . 58.82 37.26 24.92 Favored 'General case' 0 N--CA 1.483 1.179 0 C-N-CA 123.916 0.887 . . . . 0.0 110.771 -175.993 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -86.72 40.76 0.92 Allowed 'General case' 0 N--CA 1.48 1.028 0 C-N-CA 124.123 0.969 . . . . 0.0 110.957 -176.252 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 15.7 m -87.86 153.68 52.38 Favored Pre-proline 0 CA--C 1.547 0.842 0 C-N-CA 124.271 1.028 . . . . 0.0 109.452 179.348 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 96.2 Cg_endo -80.13 112.49 2.82 Favored 'Trans proline' 0 C--N 1.362 1.288 0 C-N-CA 122.366 2.044 . . . . 0.0 111.602 175.209 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 11.0 pt20 -85.57 119.44 25.92 Favored 'General case' 0 C--O 1.242 0.68 0 N-CA-C 105.97 -1.863 . . . . 0.0 105.97 164.769 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -57.85 125.68 24.1 Favored 'General case' 0 C--N 1.353 0.734 0 CA-C-O 122.002 0.906 . . . . 0.0 111.592 -168.892 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -84.36 -21.25 30.96 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 114.28 -1.327 . . . . 0.0 110.118 -178.691 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 29' ' ' TRP . . . . . . . . . . . . . 4.5 m-90 -140.94 147.6 39.06 Favored 'General case' 0 N--CA 1.476 0.833 0 C-N-CA 124.439 1.096 . . . . 0.0 109.614 -176.297 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 36.3 p -83.02 174.29 11.01 Favored 'General case' 0 N--CA 1.476 0.857 0 N-CA-C 109.629 -0.508 . . . . 0.0 109.629 169.098 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . 0.584 HG13 HG11 ' A' ' 79' ' ' VAL . 45.5 t -52.26 -45.52 43.85 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.022 0 C-N-CA 123.821 0.848 . . . . 0.0 111.743 179.781 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -66.31 -42.81 87.75 Favored 'General case' 0 N--CA 1.48 1.059 0 C-N-CA 123.238 0.615 . . . . 0.0 111.395 179.051 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 15.7 mm-40 -64.7 -29.07 70.06 Favored 'General case' 0 N--CA 1.482 1.146 0 C-N-CA 123.253 0.621 . . . . 0.0 110.94 179.883 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.449 ' HA ' HD23 ' A' ' 39' ' ' LEU . 79.0 mt -69.53 -53.67 17.9 Favored 'General case' 0 N--CA 1.469 0.522 0 C-N-CA 123.129 0.572 . . . . 0.0 109.772 172.984 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . 0.406 ' HG3' ' O ' ' A' ' 31' ' ' VAL . 83.0 mtp180 -65.05 -15.15 62.02 Favored 'General case' 0 N--CA 1.485 1.321 0 C-N-CA 123.937 0.895 . . . . 0.0 112.125 -173.706 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 47.8 t -59.72 117.65 5.21 Favored 'General case' 0 CA--C 1.54 0.587 0 N-CA-C 109.29 -0.633 . . . . 0.0 109.29 169.61 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 11.5 pt-20 -65.65 -16.29 63.59 Favored 'General case' 0 N--CA 1.477 0.884 0 C-N-CA 124.3 1.04 . . . . 0.0 111.893 178.954 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 12.7 mm100 -68.64 -25.68 64.95 Favored 'General case' 0 CA--C 1.545 0.753 0 C-N-CA 123.945 0.898 . . . . 0.0 110.639 173.822 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.449 HD23 ' HA ' ' A' ' 34' ' ' LEU . 26.0 tp -88.65 117.77 68.67 Favored Pre-proline 0 CA--C 1.545 0.755 0 N-CA-C 108.252 -1.018 . . . . 0.0 108.252 171.082 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 34.6 Cg_exo -62.08 143.35 94.73 Favored 'Trans proline' 0 C--N 1.374 1.892 0 C-N-CA 122.776 2.318 . . . . 0.0 112.571 177.522 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 54.3 mtmt -60.61 -36.65 79.1 Favored 'General case' 0 N--CA 1.471 0.613 0 CA-C-N 115.538 -0.756 . . . . 0.0 110.693 174.915 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 61.5 pttt -65.51 -33.98 77.19 Favored 'General case' 0 N--CA 1.473 0.698 0 C-N-CA 123.34 0.656 . . . . 0.0 111.152 178.878 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 27.9 t0 -69.1 -31.63 70.48 Favored 'General case' 0 N--CA 1.476 0.868 0 CA-C-O 121.288 0.566 . . . . 0.0 110.696 -178.775 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 53.7 mt -73.59 -47.12 46.09 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.736 0 CA-C-N 115.667 -0.697 . . . . 0.0 110.351 176.125 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 73.5 mt -59.95 -35.24 59.62 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.184 0 C-N-CA 123.507 0.723 . . . . 0.0 110.498 177.225 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 88.0 tttt -60.27 -42.59 95.69 Favored 'General case' 0 CA--C 1.548 0.896 0 C-N-CA 124.308 1.043 . . . . 0.0 110.708 176.822 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 22.3 t80 -67.03 -47.27 71.9 Favored 'General case' 0 CA--C 1.547 0.841 0 CA-C-N 114.1 -1.409 . . . . 0.0 111.231 176.313 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . 0.541 ' HB3' ' HE2' ' A' ' 56' ' ' PHE . 87.4 mt -70.38 -36.95 74.43 Favored 'General case' 0 N--CA 1.473 0.709 0 C-N-CA 124.056 0.942 . . . . 0.0 112.414 -173.921 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 3.1 pt20 -80.56 -32.24 36.69 Favored 'General case' 0 N--CA 1.478 0.959 0 C-N-CA 122.457 0.303 . . . . 0.0 111.059 -175.556 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 44.4 tt0 -59.87 -37.0 78.08 Favored 'General case' 0 N--CA 1.478 0.96 0 C-N-CA 123.278 0.631 . . . . 0.0 111.053 -176.8 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 81.8 m-70 -106.19 -37.13 6.68 Favored 'General case' 0 N--CA 1.476 0.852 0 CA-C-N 115.609 -0.723 . . . . 0.0 111.247 -176.355 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . 0.486 ' HA2' ' HA ' ' A' ' 91' ' ' PHE . . . -60.26 127.31 43.55 Favored Glycine 0 C--N 1.346 1.128 0 O-C-N 123.924 0.765 . . . . 0.0 113.841 -178.349 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 25.7 t -68.28 168.09 13.11 Favored 'General case' 0 CA--C 1.548 0.88 0 C-N-CA 124.274 1.03 . . . . 0.0 110.948 -179.906 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 19.5 m-20 -57.25 -27.79 62.38 Favored 'General case' 0 N--CA 1.486 1.371 0 C-N-CA 124.156 0.983 . . . . 0.0 112.801 -172.877 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 19.6 p -64.57 -50.62 66.52 Favored 'General case' 0 CA--C 1.548 0.878 0 C-N-CA 123.723 0.809 . . . . 0.0 110.925 174.426 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 56' ' ' PHE . . . . . 0.554 ' HB2' ' HB3' ' A' ' 90' ' ' ARG . 58.9 t80 -61.23 -37.22 82.28 Favored 'General case' 0 N--CA 1.482 1.128 0 C-N-CA 123.959 0.904 . . . . 0.0 110.905 178.398 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 84.9 mt -66.41 -41.79 88.74 Favored 'General case' 0 CA--C 1.54 0.578 0 CA-C-N 114.357 -1.292 . . . . 0.0 110.976 176.85 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -71.08 -27.03 63.32 Favored 'General case' 0 N--CA 1.479 1.011 0 C-N-CA 123.894 0.878 . . . . 0.0 112.5 -179.64 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -61.72 -50.24 73.21 Favored 'General case' 0 CA--C 1.547 0.838 0 C-N-CA 123.675 0.79 . . . . 0.0 112.521 -177.467 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 22.4 t-80 -119.07 14.26 13.1 Favored 'General case' 0 N--CA 1.487 1.411 0 N-CA-C 112.568 0.581 . . . . 0.0 112.568 -179.761 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 50.5 mtpt 55.31 49.51 16.9 Favored 'General case' 0 N--CA 1.482 1.175 0 C-N-CA 123.7 0.8 . . . . 0.0 110.962 -172.917 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 0.446 ' HA ' HG11 ' A' ' 69' ' ' VAL . 86.7 mt -79.69 -6.99 58.3 Favored 'General case' 0 N--CA 1.48 1.05 0 C-N-CA 123.759 0.824 . . . . 0.0 110.76 176.349 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . 0.406 ' HG ' ' H ' ' A' ' 63' ' ' LEU . 1.2 pp -76.12 159.86 30.32 Favored 'General case' 0 N--CA 1.475 0.805 0 C-N-CA 123.945 0.898 . . . . 0.0 110.936 173.225 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 86.14 -160.5 33.56 Favored Glycine 0 C--N 1.343 0.947 0 CA-C-N 115.524 -0.762 . . . . 0.0 113.2 179.212 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 16.5 m120 -63.5 123.56 19.09 Favored 'General case' 0 N--CA 1.474 0.73 0 C-N-CA 123.209 0.604 . . . . 0.0 110.4 179.622 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 53.3 mt -56.49 -46.29 82.24 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.657 0 C-N-CA 124.599 1.16 . . . . 0.0 111.73 -175.006 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 62.7 pttt -58.84 -37.43 76.44 Favored 'General case' 0 CA--C 1.556 1.182 0 C-N-CA 123.855 0.862 . . . . 0.0 111.537 178.516 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 68' ' ' ASN . . . . . 0.4 ' O ' ' HG2' ' A' ' 71' ' ' LYS . 5.9 m-20 -70.42 -31.22 68.32 Favored 'General case' 0 N--CA 1.481 1.088 0 C-N-CA 124.201 1.0 . . . . 0.0 110.62 179.695 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 69' ' ' VAL . . . . . 0.446 HG11 ' HA ' ' A' ' 62' ' ' LEU . 30.7 t -74.28 -37.19 45.09 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.937 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.064 172.289 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -68.3 -21.66 64.77 Favored 'General case' 0 N--CA 1.484 1.256 0 C-N-CA 124.059 0.944 . . . . 0.0 112.765 -174.608 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . 0.4 ' HG2' ' O ' ' A' ' 68' ' ' ASN . 20.9 ptmt -83.0 -18.14 40.9 Favored 'General case' 0 N--CA 1.482 1.163 0 C-N-CA 122.758 0.423 . . . . 0.0 111.442 179.714 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 8.9 t -114.11 -5.67 13.08 Favored 'General case' 0 N--CA 1.478 0.969 0 C-N-CA 123.762 0.825 . . . . 0.0 110.605 179.471 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -95.35 131.7 41.17 Favored 'General case' 0 N--CA 1.47 0.537 0 C-N-CA 123.504 0.722 . . . . 0.0 110.378 177.555 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 30.7 t30 -97.14 145.04 26.4 Favored 'General case' 0 C--O 1.242 0.677 0 N-CA-C 108.169 -1.048 . . . . 0.0 108.169 170.37 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 4.6 tppp? -55.85 -43.94 77.56 Favored 'General case' 0 N--CA 1.474 0.748 0 C-N-CA 124.044 0.938 . . . . 0.0 111.754 -178.693 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 22.3 t70 -57.97 -44.03 86.84 Favored 'General case' 0 N--CA 1.479 0.98 0 C-N-CA 123.758 0.823 . . . . 0.0 111.633 -177.842 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 26.2 t60 -75.38 -26.37 58.41 Favored 'General case' 0 N--CA 1.473 0.702 0 C-N-CA 122.639 0.375 . . . . 0.0 111.085 179.729 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 67.6 mt -68.16 -31.11 70.44 Favored 'General case' 0 N--CA 1.486 1.332 0 CA-C-N 118.225 0.466 . . . . 0.0 111.931 176.026 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 79' ' ' VAL . . . . . 0.584 HG11 HG13 ' A' ' 31' ' ' VAL . 97.0 t -69.65 -39.73 78.55 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.734 0 CA-C-N 115.565 -0.743 . . . . 0.0 109.66 171.169 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 37.4 m -63.37 -40.25 96.74 Favored 'General case' 0 CA--C 1.547 0.848 0 C-N-CA 123.524 0.73 . . . . 0.0 111.204 176.576 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -71.44 -40.64 70.25 Favored 'General case' 0 N--CA 1.476 0.833 0 C-N-CA 123.895 0.878 . . . . 0.0 109.592 178.988 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 82' ' ' TYR . . . . . . . . . . . . . 11.7 t80 -54.49 -54.75 36.84 Favored 'General case' 0 N--CA 1.474 0.731 0 C-N-CA 124.648 1.179 . . . . 0.0 110.762 175.741 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 83' ' ' ASN . . . . . . . . . . . . . 45.1 m-80 -67.46 -40.67 85.36 Favored 'General case' 0 N--CA 1.478 0.933 0 C-N-CA 122.475 0.31 . . . . 0.0 110.997 -176.712 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 38.6 m170 -66.65 -24.62 66.31 Favored 'General case' 0 N--CA 1.483 1.21 0 C-N-CA 123.535 0.734 . . . . 0.0 111.663 178.608 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 85' ' ' LEU . . . . . 0.455 ' HG ' ' HD2' ' A' ' 91' ' ' PHE . 35.4 tp -58.6 -53.83 53.93 Favored 'General case' 0 N--CA 1.482 1.148 0 C-N-CA 123.793 0.837 . . . . 0.0 110.653 177.042 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 36.6 m-85 -74.85 -29.78 61.15 Favored 'General case' 0 N--CA 1.474 0.729 0 CA-C-N 114.593 -1.185 . . . . 0.0 111.428 -178.896 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 40.7 tt0 -58.78 -47.69 83.85 Favored 'General case' 0 N--CA 1.477 0.887 0 C-N-CA 125.013 1.325 . . . . 0.0 112.831 -173.367 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 30.2 p -120.18 8.59 10.94 Favored 'General case' 0 N--CA 1.477 0.91 0 C-N-CA 123.634 0.774 . . . . 0.0 111.271 -178.043 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 96.6 mttt 54.78 61.78 2.82 Favored 'General case' 0 N--CA 1.477 0.915 0 C-N-CA 124.277 1.031 . . . . 0.0 111.072 -177.108 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 90' ' ' ARG . . . . . 0.554 ' HB3' ' HB2' ' A' ' 56' ' ' PHE . 44.5 mtt85 -75.63 -8.53 57.02 Favored 'General case' 0 N--CA 1.476 0.831 0 CA-C-N 114.06 -1.427 . . . . 0.0 111.807 178.403 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 91' ' ' PHE . . . . . 0.486 ' HA ' ' HA2' ' A' ' 52' ' ' GLY . 23.2 p90 -81.49 162.02 23.41 Favored 'General case' 0 N--CA 1.469 0.524 0 C-N-CA 124.164 0.986 . . . . 0.0 111.11 172.131 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 6.5 tmtm? . . . . . 0 C--O 1.253 1.265 0 CA-C-N 115.045 -0.98 . . . . 0.0 109.003 175.016 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 20' ' ' MET . . . . . . . . . . . . . 14.3 tpt . . . . . 0 N--CA 1.483 1.202 0 N-CA-C 110.38 -0.23 . . . . 0.0 110.38 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -121.28 89.69 3.17 Favored 'General case' 0 N--CA 1.474 0.771 0 N-CA-C 108.245 -1.021 . . . . 0.0 108.245 171.673 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -64.5 -47.64 78.16 Favored 'General case' 0 N--CA 1.481 1.083 0 C-N-CA 124.025 0.93 . . . . 0.0 110.455 -179.966 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -104.94 105.27 15.24 Favored 'General case' 0 C--O 1.236 0.383 0 N-CA-C 107.647 -1.242 . . . . 0.0 107.647 171.101 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 27.7 m -78.23 148.04 73.78 Favored Pre-proline 0 CA--C 1.548 0.898 0 N-CA-C 109.519 -0.548 . . . . 0.0 109.519 179.083 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 59.7 Cg_endo -73.41 93.1 0.83 Allowed 'Trans proline' 0 C--N 1.365 1.409 0 C-N-CA 122.366 2.044 . . . . 0.0 110.467 174.74 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 19.2 pt20 -76.54 -176.7 3.85 Favored 'General case' 0 C--O 1.244 0.804 0 CA-C-N 113.203 -1.817 . . . . 0.0 110.208 -178.696 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . 0.665 HH21 HG22 ' A' ' 30' ' ' THR . 15.4 ttt180 -60.27 120.89 10.68 Favored 'General case' 0 CA--C 1.549 0.905 0 C-N-CA 123.528 0.731 . . . . 0.0 110.522 175.098 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -90.09 -60.01 2.04 Favored 'General case' 0 CA--C 1.549 0.924 0 CA-C-N 114.589 -1.187 . . . . 0.0 109.456 174.852 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 29' ' ' TRP . . . . . . . . . . . . . 3.8 m-90 -89.67 149.54 22.74 Favored 'General case' 0 N--CA 1.474 0.762 0 C-N-CA 124.121 0.969 . . . . 0.0 111.896 -175.672 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 30' ' ' THR . . . . . 0.665 HG22 HH21 ' A' ' 27' ' ' ARG . 66.8 p -82.07 173.67 11.94 Favored 'General case' 0 N--CA 1.471 0.611 0 C-N-CA 123.328 0.651 . . . . 0.0 109.854 168.494 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . 0.532 ' HA ' HD12 ' A' ' 34' ' ' LEU . 69.3 t -58.99 -38.28 72.81 Favored 'Isoleucine or valine' 0 CA--C 1.554 1.1 0 C-N-CA 123.581 0.753 . . . . 0.0 111.381 -179.013 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 11.6 pt-20 -73.49 -36.25 65.75 Favored 'General case' 0 N--CA 1.482 1.158 0 CA-C-N 116.112 -0.494 . . . . 0.0 111.743 178.402 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 99.5 mt-30 -67.13 -28.17 67.92 Favored 'General case' 0 N--CA 1.482 1.134 0 C-N-CA 123.156 0.582 . . . . 0.0 111.33 175.667 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.584 HD13 ' HA ' ' A' ' 79' ' ' VAL . 89.2 mt -68.04 -52.48 34.93 Favored 'General case' 0 N--CA 1.477 0.918 0 C-N-CA 123.355 0.662 . . . . 0.0 110.963 175.463 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 15.5 ptm180 -74.7 -10.92 59.99 Favored 'General case' 0 N--CA 1.485 1.308 0 C-N-CA 123.154 0.582 . . . . 0.0 111.654 -177.606 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 33.3 t -53.7 121.23 7.43 Favored 'General case' 0 N--CA 1.478 0.965 0 C-N-CA 123.619 0.767 . . . . 0.0 110.719 171.302 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 44.1 mt-10 -67.55 -25.82 66.0 Favored 'General case' 0 N--CA 1.477 0.881 0 C-N-CA 124.234 1.014 . . . . 0.0 111.927 -174.634 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 94.8 mt-30 -65.93 -29.45 69.86 Favored 'General case' 0 N--CA 1.479 0.981 0 C-N-CA 123.812 0.845 . . . . 0.0 110.838 177.004 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 44.0 tp -83.05 117.1 67.54 Favored Pre-proline 0 CA--C 1.549 0.905 0 N-CA-C 107.749 -1.204 . . . . 0.0 107.749 170.88 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 15.9 Cg_exo -70.99 163.73 38.21 Favored 'Trans proline' 0 C--N 1.372 1.791 0 C-N-CA 122.844 2.363 . . . . 0.0 113.272 177.864 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 37.1 mtmm -68.24 -42.48 79.66 Favored 'General case' 0 N--CA 1.475 0.775 0 CA-C-N 115.537 -0.756 . . . . 0.0 110.587 175.984 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 55.2 pttt -61.41 -28.95 69.62 Favored 'General case' 0 N--CA 1.48 1.048 0 C-N-CA 123.947 0.899 . . . . 0.0 111.505 -179.216 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 6.5 t70 -70.81 -43.37 68.76 Favored 'General case' 0 CA--C 1.545 0.779 0 C-N-CA 122.598 0.359 . . . . 0.0 110.469 -179.158 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 27.9 mt -72.3 -45.68 60.08 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.122 0 C-N-CA 122.678 0.391 . . . . 0.0 110.388 179.941 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 45' ' ' ILE . . . . . 0.47 HD12 ' HB2' ' A' ' 70' ' ' ALA . 98.2 mt -58.89 -39.54 77.91 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.556 0 C-N-CA 123.366 0.667 . . . . 0.0 110.915 177.757 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 46' ' ' LYS . . . . . 0.414 ' O ' ' HB2' ' A' ' 50' ' ' GLU . 62.6 tttm -62.28 -46.72 87.54 Favored 'General case' 0 N--CA 1.473 0.723 0 C-N-CA 123.057 0.543 . . . . 0.0 110.347 175.887 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 20.5 t80 -58.56 -51.11 71.26 Favored 'General case' 0 N--CA 1.476 0.866 0 O-C-N 124.362 1.039 . . . . 0.0 110.569 -179.752 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . 0.416 HD21 ' CD1' ' A' ' 82' ' ' TYR . 95.3 mt -70.87 -31.33 67.97 Favored 'General case' 0 N--CA 1.468 0.466 0 CA-C-N 115.536 -0.756 . . . . 0.0 112.084 -173.746 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 1.9 pt20 -81.2 -26.35 36.02 Favored 'General case' 0 N--CA 1.481 1.093 0 N-CA-C 110.079 -0.341 . . . . 0.0 110.079 176.871 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . 0.414 ' HB2' ' O ' ' A' ' 46' ' ' LYS . 7.6 tp10 -59.68 -33.57 71.74 Favored 'General case' 0 N--CA 1.474 0.758 0 C-N-CA 123.694 0.798 . . . . 0.0 110.964 -178.057 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 54.8 p-80 -132.09 -20.18 2.48 Favored 'General case' 0 N--CA 1.479 0.983 0 CA-C-O 117.858 -1.068 . . . . 0.0 113.573 -176.29 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . 0.461 ' HA2' ' HA ' ' A' ' 91' ' ' PHE . . . -67.24 144.97 45.39 Favored Glycine 0 N--CA 1.48 1.575 0 CA-C-N 119.447 1.022 . . . . 0.0 112.362 177.876 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 53.7 m -77.73 163.08 26.47 Favored 'General case' 0 N--CA 1.486 1.344 0 CA-C-N 117.546 0.673 . . . . 0.0 111.92 -177.114 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 9.1 m-20 -54.29 -43.41 71.04 Favored 'General case' 0 N--CA 1.485 1.295 0 C-N-CA 124.533 1.133 . . . . 0.0 113.199 -170.42 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 34.5 t -68.21 -40.71 82.04 Favored 'General case' 0 N--CA 1.479 1.019 0 C-N-CA 123.38 0.672 . . . . 0.0 111.223 -176.224 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 89.8 t80 -63.49 -48.08 79.1 Favored 'General case' 0 N--CA 1.478 0.954 0 C-N-CA 123.257 0.623 . . . . 0.0 109.713 177.386 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 63.6 mt -65.02 -32.45 74.18 Favored 'General case' 0 C--O 1.22 -0.487 0 CA-C-N 115.173 -0.921 . . . . 0.0 111.18 -178.205 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -70.17 -48.43 57.32 Favored 'General case' 0 N--CA 1.475 0.82 0 C-N-CA 123.313 0.645 . . . . 0.0 110.813 179.276 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 55.2 mt-10 -61.66 -36.59 81.26 Favored 'General case' 0 N--CA 1.481 1.078 0 C-N-CA 123.23 0.612 . . . . 0.0 111.947 -179.866 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 94.5 m-70 -99.27 -4.05 32.77 Favored 'General case' 0 N--CA 1.481 1.093 0 C-N-CA 122.517 0.327 . . . . 0.0 111.866 -178.444 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 33.8 mmtp 61.18 30.34 19.26 Favored 'General case' 0 N--CA 1.495 1.807 0 C-N-CA 124.177 0.991 . . . . 0.0 112.108 179.747 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 80.4 mt -80.3 -13.49 59.15 Favored 'General case' 0 N--CA 1.482 1.165 0 C-N-CA 124.177 0.991 . . . . 0.0 111.564 179.653 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -74.33 179.78 4.37 Favored 'General case' 0 N--CA 1.485 1.317 0 C-N-CA 123.484 0.713 . . . . 0.0 111.822 177.644 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 76.43 -160.0 50.51 Favored Glycine 0 C--N 1.342 0.891 0 CA-C-N 115.362 -0.835 . . . . 0.0 113.239 175.734 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 13.3 m120 -67.98 113.51 5.74 Favored 'General case' 0 N--CA 1.479 0.992 0 C-N-CA 123.087 0.555 . . . . 0.0 109.928 -178.88 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 44.2 mt -51.99 -53.06 19.62 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.116 0 C-N-CA 125.313 1.445 . . . . 0.0 112.287 -172.159 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 41.8 mtmt -64.25 -38.41 90.94 Favored 'General case' 0 N--CA 1.482 1.14 0 C-N-CA 124.257 1.023 . . . . 0.0 111.428 -175.674 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 50.6 t30 -66.02 -39.86 90.58 Favored 'General case' 0 N--CA 1.481 1.091 0 C-N-CA 124.113 0.965 . . . . 0.0 110.894 178.49 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 69' ' ' VAL . . . . . 0.417 HG12 HD13 ' A' ' 45' ' ' ILE . 97.5 t -67.39 -39.53 82.86 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.878 0 CA-C-N 115.853 -0.612 . . . . 0.0 109.597 174.129 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 70' ' ' ALA . . . . . 0.47 ' HB2' HD12 ' A' ' 45' ' ' ILE . . . -81.77 12.23 4.15 Favored 'General case' 0 N--CA 1.483 1.209 0 C-N-CA 124.216 1.006 . . . . 0.0 111.743 179.568 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 65.4 tttp -94.43 -31.03 14.15 Favored 'General case' 0 CA--C 1.544 0.731 0 C-N-CA 124.148 0.979 . . . . 0.0 110.123 170.985 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 8.8 t -122.28 -19.86 6.35 Favored 'General case' 0 N--CA 1.482 1.167 0 N-CA-C 112.667 0.618 . . . . 0.0 112.667 -170.759 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -77.89 148.41 34.61 Favored 'General case' 0 N--CA 1.477 0.893 0 C-N-CA 122.794 0.438 . . . . 0.0 109.848 176.771 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 9.4 p30 -98.76 163.87 12.45 Favored 'General case' 0 N--CA 1.483 1.203 0 C-N-CA 122.587 0.355 . . . . 0.0 110.4 176.422 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 19.0 tptm -71.59 -39.39 70.58 Favored 'General case' 0 N--CA 1.478 0.953 0 C-N-CA 123.658 0.783 . . . . 0.0 111.357 -172.75 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 25.2 t70 -63.69 -33.08 74.84 Favored 'General case' 0 N--CA 1.483 1.217 0 C-N-CA 124.412 1.085 . . . . 0.0 111.088 -176.435 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 69.5 t60 -58.43 -43.82 88.88 Favored 'General case' 0 N--CA 1.475 0.786 0 C-N-CA 124.891 1.276 . . . . 0.0 110.26 173.416 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 56.7 mt -68.56 -31.53 70.81 Favored 'General case' 0 N--CA 1.476 0.834 0 CA-C-N 115.389 -0.823 . . . . 0.0 112.076 -174.907 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 79' ' ' VAL . . . . . 0.584 ' HA ' HD13 ' A' ' 34' ' ' LEU . 53.7 t -65.1 -48.45 83.77 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.883 0 O-C-N 124.114 0.884 . . . . 0.0 109.775 177.263 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 56.8 m -62.8 -44.52 95.95 Favored 'General case' 0 N--CA 1.474 0.771 0 CA-C-N 115.193 -0.912 . . . . 0.0 111.58 178.309 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -64.39 -48.24 76.17 Favored 'General case' 0 N--CA 1.476 0.838 0 C-N-CA 123.37 0.668 . . . . 0.0 110.557 -179.137 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 82' ' ' TYR . . . . . 0.535 ' CD2' HD11 ' A' ' 34' ' ' LEU . 74.0 t80 -53.59 -57.44 10.74 Favored 'General case' 0 N--CA 1.471 0.59 0 C-N-CA 124.288 1.035 . . . . 0.0 111.136 -178.133 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 83' ' ' ASN . . . . . . . . . . . . . 46.5 m-80 -66.76 -28.25 68.25 Favored 'General case' 0 N--CA 1.478 0.966 0 CA-C-N 115.359 -0.837 . . . . 0.0 111.913 -172.652 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 10.6 m170 -77.47 -28.47 52.31 Favored 'General case' 0 N--CA 1.482 1.129 0 C-N-CA 123.155 0.582 . . . . 0.0 111.927 177.6 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 34.2 tp -59.89 -53.03 62.69 Favored 'General case' 0 N--CA 1.492 1.657 0 CA-C-O 121.571 0.701 . . . . 0.0 111.21 -177.518 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 86' ' ' PHE . . . . . 0.404 ' HA ' ' HE2' ' A' ' 91' ' ' PHE . 34.5 m-85 -73.9 -29.82 62.26 Favored 'General case' 0 N--CA 1.47 0.556 0 CA-C-N 113.993 -1.458 . . . . 0.0 110.743 -176.074 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 13.9 tp10 -69.19 -36.99 77.9 Favored 'General case' 0 N--CA 1.471 0.616 0 C-N-CA 123.532 0.733 . . . . 0.0 110.957 -176.7 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 60.5 p -106.92 0.49 23.87 Favored 'General case' 0 N--CA 1.478 0.935 0 C-N-CA 123.967 0.907 . . . . 0.0 111.683 -177.561 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 74.4 mmtt 61.88 27.15 16.51 Favored 'General case' 0 N--CA 1.489 1.475 0 C-N-CA 124.49 1.116 . . . . 0.0 112.24 174.919 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 54.2 mtt180 -73.46 4.58 4.62 Favored 'General case' 0 N--CA 1.492 1.628 0 N-CA-C 114.056 1.132 . . . . 0.0 114.056 -172.967 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 91' ' ' PHE . . . . . 0.461 ' HA ' ' HA2' ' A' ' 52' ' ' GLY . 5.8 p90 -70.43 141.92 52.05 Favored 'General case' 0 CA--C 1.551 0.995 0 CA-C-O 121.343 0.592 . . . . 0.0 111.783 169.955 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 13.6 tptp . . . . . 0 C--O 1.25 1.097 0 C-N-CA 127.753 2.421 . . . . 0.0 112.688 -176.856 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 20' ' ' MET . . . . . . . . . . . . . 60.5 mtt . . . . . 0 N--CA 1.478 0.972 0 N-CA-C 109.126 -0.694 . . . . 0.0 109.126 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -104.56 14.39 30.01 Favored 'General case' 0 N--CA 1.481 1.09 0 C-N-CA 123.253 0.621 . . . . 0.0 112.424 -173.462 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . 74.69 -56.45 0.63 Allowed 'General case' 0 N--CA 1.496 1.843 0 C-N-CA 125.715 1.606 . . . . 0.0 113.501 176.799 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -82.7 167.52 18.13 Favored 'General case' 0 N--CA 1.474 0.745 0 C-N-CA 124.118 0.967 . . . . 0.0 112.207 -175.304 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 47.5 t -83.69 120.64 75.55 Favored Pre-proline 0 CA--C 1.552 1.024 0 CA-C-N 115.017 -0.992 . . . . 0.0 109.125 172.892 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 74.2 Cg_exo -52.99 121.17 8.87 Favored 'Trans proline' 0 C--N 1.372 1.807 0 C-N-CA 123.333 2.689 . . . . 0.0 112.823 172.222 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 5.1 pm0 -69.81 115.06 8.6 Favored 'General case' 0 N--CA 1.471 0.615 0 N-CA-C 109.202 -0.666 . . . . 0.0 109.202 175.94 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . 0.505 ' HD3' ' H ' ' A' ' 27' ' ' ARG . 0.0 OUTLIER -62.8 123.0 17.32 Favored 'General case' 0 CA--C 1.537 0.462 0 CA-C-O 121.54 0.686 . . . . 0.0 109.941 174.444 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -79.05 -35.08 43.14 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 114.605 -1.18 . . . . 0.0 110.613 -174.14 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 29' ' ' TRP . . . . . 0.519 ' HB3' ' HB2' ' A' ' 33' ' ' GLN . 3.2 m-90 -115.0 145.89 41.8 Favored 'General case' 0 N--CA 1.472 0.666 0 CA-C-N 115.16 -0.927 . . . . 0.0 110.57 -172.618 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 49.2 p -93.07 174.58 7.16 Favored 'General case' 0 CA--C 1.544 0.729 0 C-N-CA 123.68 0.792 . . . . 0.0 108.865 168.438 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . 0.515 ' HA ' HD12 ' A' ' 34' ' ' LEU . 7.1 p -58.89 -35.66 57.53 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.277 0 C-N-CA 122.907 0.483 . . . . 0.0 112.19 -174.471 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 9.0 pt-20 -66.07 -42.16 89.77 Favored 'General case' 0 N--CA 1.48 1.051 0 C-N-CA 123.657 0.783 . . . . 0.0 111.262 176.695 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 33' ' ' GLN . . . . . 0.519 ' HB2' ' HB3' ' A' ' 29' ' ' TRP . 12.4 mm100 -63.9 -42.34 97.46 Favored 'General case' 0 N--CA 1.477 0.918 0 C-N-CA 123.021 0.528 . . . . 0.0 110.085 178.209 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.515 HD12 ' HA ' ' A' ' 31' ' ' VAL . 70.2 mt -63.23 -49.57 73.65 Favored 'General case' 0 N--CA 1.472 0.649 0 O-C-N 124.485 1.116 . . . . 0.0 111.17 -176.943 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 11.5 ptp180 -73.07 -16.84 61.47 Favored 'General case' 0 N--CA 1.48 1.052 0 O-C-N 124.046 0.841 . . . . 0.0 111.636 -175.166 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 13.4 t -69.46 122.46 19.04 Favored 'General case' 0 CA--C 1.55 0.965 0 N-CA-C 109.514 -0.55 . . . . 0.0 109.514 -178.825 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . 0.407 ' HA ' ' HE2' ' A' ' 75' ' ' LYS . 60.1 mm-40 -63.65 -22.16 66.76 Favored 'General case' 0 N--CA 1.481 1.094 0 C-N-CA 123.903 0.881 . . . . 0.0 113.017 -174.833 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 29.3 pt20 -68.15 -21.69 64.9 Favored 'General case' 0 N--CA 1.482 1.125 0 C-N-CA 123.292 0.637 . . . . 0.0 111.636 179.541 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 2.4 tt -81.26 121.56 80.44 Favored Pre-proline 0 CA--C 1.553 1.091 0 N-CA-C 107.005 -1.48 . . . . 0.0 107.005 174.103 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_exo -56.78 126.1 21.17 Favored 'Trans proline' 0 C--N 1.381 2.254 0 C-N-CA 122.804 2.336 . . . . 0.0 111.972 173.399 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . 0.455 ' HB2' HD11 ' A' ' 78' ' ' LEU . 9.6 ptpp? -58.74 -34.24 71.16 Favored 'General case' 0 N--CA 1.48 1.029 0 C-N-CA 123.261 0.624 . . . . 0.0 111.194 179.925 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 21.3 ptmt -66.49 -33.17 75.08 Favored 'General case' 0 N--CA 1.472 0.669 0 C-N-CA 124.183 0.993 . . . . 0.0 111.849 179.538 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 32.5 t70 -68.1 -33.12 73.92 Favored 'General case' 0 N--CA 1.476 0.871 0 C-N-CA 123.599 0.76 . . . . 0.0 110.33 -178.007 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 53.8 mt -70.17 -46.86 70.65 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.079 0 CA-C-N 115.657 -0.701 . . . . 0.0 109.916 175.266 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 74.6 mt -57.86 -35.77 52.88 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.492 0 C-N-CA 123.199 0.599 . . . . 0.0 110.872 176.882 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 88.6 tttt -65.79 -41.85 91.44 Favored 'General case' 0 CA--C 1.546 0.79 0 C-N-CA 123.306 0.642 . . . . 0.0 110.983 178.756 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 27.2 t80 -57.21 -48.43 78.81 Favored 'General case' 0 N--CA 1.489 1.52 0 C-N-CA 123.278 0.631 . . . . 0.0 110.085 172.892 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . 0.438 ' HB3' ' HE2' ' A' ' 56' ' ' PHE . 96.4 mt -66.77 -35.4 80.0 Favored 'General case' 0 CA--C 1.539 0.553 0 CA-C-N 114.259 -1.337 . . . . 0.0 112.144 -174.111 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . 0.444 ' HA ' ' CD2' ' A' ' 57' ' ' LEU . 3.5 pt20 -82.75 -34.77 27.05 Favored 'General case' 0 N--CA 1.482 1.133 0 CA-C-N 117.903 0.32 . . . . 0.0 111.234 179.25 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 44.5 tt0 -67.47 -37.51 83.01 Favored 'General case' 0 N--CA 1.477 0.895 0 C-N-CA 123.108 0.563 . . . . 0.0 111.247 -177.642 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 97.1 m-70 -108.16 -40.43 5.2 Favored 'General case' 0 N--CA 1.48 1.032 0 CA-C-N 115.679 -0.691 . . . . 0.0 111.822 -171.75 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . 0.538 ' HA2' ' HA ' ' A' ' 91' ' ' PHE . . . -63.88 136.54 41.05 Favored Glycine 0 C--N 1.345 1.031 0 O-C-N 123.596 0.56 . . . . 0.0 113.016 175.178 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . 0.426 ' O ' ' HG ' ' A' ' 57' ' ' LEU . 9.1 t -73.09 172.64 10.67 Favored 'General case' 0 N--CA 1.476 0.851 0 C-N-CA 123.553 0.741 . . . . 0.0 110.309 -177.988 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 4.3 m-20 -55.0 -39.46 69.07 Favored 'General case' 0 N--CA 1.488 1.467 0 C-N-CA 123.845 0.858 . . . . 0.0 111.356 -177.625 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 22.7 t -63.85 -30.72 71.78 Favored 'General case' 0 N--CA 1.479 1.002 0 CA-C-N 114.932 -1.031 . . . . 0.0 111.71 -179.269 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 56' ' ' PHE . . . . . 0.581 ' HB2' ' HB3' ' A' ' 90' ' ' ARG . 46.3 t80 -75.48 -41.9 54.33 Favored 'General case' 0 N--CA 1.473 0.677 0 C-N-CA 123.102 0.561 . . . . 0.0 110.947 176.449 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . 0.444 ' CD2' ' HA ' ' A' ' 49' ' ' GLN . 20.8 mt -74.24 -49.09 24.73 Favored 'General case' 0 N--CA 1.472 0.629 0 CA-C-N 115.094 -0.957 . . . . 0.0 112.077 -168.541 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -61.4 -48.15 82.56 Favored 'General case' 0 N--CA 1.478 0.95 0 C-N-CA 123.383 0.673 . . . . 0.0 111.319 -177.346 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 14.1 mm-40 -60.37 -30.15 69.39 Favored 'General case' 0 N--CA 1.484 1.26 0 C-N-CA 123.521 0.728 . . . . 0.0 112.768 -178.997 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 35.3 m80 -113.18 0.9 15.06 Favored 'General case' 0 N--CA 1.488 1.426 0 N-CA-C 112.331 0.493 . . . . 0.0 112.331 -175.802 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 75.4 mmtt 55.71 44.68 25.93 Favored 'General case' 0 N--CA 1.486 1.34 0 C-N-CA 124.591 1.156 . . . . 0.0 111.729 178.761 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 85.2 mt -95.33 -11.23 28.15 Favored 'General case' 0 N--CA 1.481 1.094 0 C-N-CA 123.994 0.918 . . . . 0.0 111.455 179.605 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -79.96 171.97 14.39 Favored 'General case' 0 N--CA 1.482 1.14 0 C-N-CA 123.176 0.59 . . . . 0.0 111.42 176.657 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 85.62 -153.42 27.29 Favored Glycine 0 C--N 1.34 0.796 0 CA-C-N 114.751 -1.113 . . . . 0.0 112.53 178.418 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 12.5 m120 -69.79 118.52 12.75 Favored 'General case' 0 N--CA 1.469 0.483 0 N-CA-C 108.948 -0.76 . . . . 0.0 108.948 175.364 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 59.0 mt -55.43 -39.19 51.92 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.066 0 C-N-CA 123.94 0.896 . . . . 0.0 110.813 -177.883 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 58.2 pttt -53.74 -42.88 68.62 Favored 'General case' 0 N--CA 1.485 1.311 0 C-N-CA 124.145 0.978 . . . . 0.0 112.48 178.175 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 3.8 m-20 -59.64 -41.62 90.91 Favored 'General case' 0 N--CA 1.489 1.477 0 C-N-CA 123.997 0.919 . . . . 0.0 110.404 179.257 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 21.5 t -71.22 -44.86 73.13 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.073 0 CA-C-N 113.893 -1.503 . . . . 0.0 109.996 179.307 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -82.1 7.12 14.27 Favored 'General case' 0 N--CA 1.485 1.317 0 C-N-CA 124.726 1.211 . . . . 0.0 113.441 -168.242 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 21.1 ptmt -95.26 -18.69 20.64 Favored 'General case' 0 N--CA 1.482 1.137 0 O-C-N 121.907 -0.496 . . . . 0.0 111.079 172.109 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 13.0 t -133.05 -14.09 2.71 Favored 'General case' 0 CA--C 1.553 1.077 0 C-N-CA 123.257 0.623 . . . . 0.0 112.53 -173.668 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -84.17 99.85 10.78 Favored 'General case' 0 C--O 1.244 0.796 0 N-CA-C 108.692 -0.855 . . . . 0.0 108.692 176.827 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 32.4 p30 -68.65 163.45 23.76 Favored 'General case' 0 CA--C 1.539 0.53 0 CA-C-N 115.826 -0.624 . . . . 0.0 110.132 178.819 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . 0.426 ' HB2' ' NZ ' ' A' ' 75' ' ' LYS . 3.5 ttmp? -67.61 -26.75 66.41 Favored 'General case' 0 CA--C 1.548 0.883 0 C-N-CA 123.053 0.541 . . . . 0.0 110.985 -173.686 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 20.8 t70 -61.9 -41.37 97.82 Favored 'General case' 0 CA--C 1.552 1.037 0 C-N-CA 124.463 1.105 . . . . 0.0 110.966 173.741 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 17.4 t60 -62.84 -36.76 84.28 Favored 'General case' 0 N--CA 1.484 1.249 0 C-N-CA 125.292 1.437 . . . . 0.0 109.653 -179.075 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . 0.455 HD11 ' HB2' ' A' ' 41' ' ' LYS . 48.3 mt -75.06 -36.64 61.8 Favored 'General case' 0 N--CA 1.47 0.537 0 CA-C-N 114.584 -1.189 . . . . 0.0 111.922 -172.863 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 61.9 t -67.39 -41.97 86.86 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.899 0 O-C-N 123.82 0.7 . . . . 0.0 109.699 173.182 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 22.9 m -60.22 -43.56 95.92 Favored 'General case' 0 N--CA 1.482 1.132 0 C-N-CA 123.237 0.615 . . . . 0.0 110.936 177.171 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -69.73 -43.94 71.32 Favored 'General case' 0 N--CA 1.473 0.705 0 C-N-CA 123.523 0.729 . . . . 0.0 111.019 179.077 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 82' ' ' TYR . . . . . . . . . . . . . 18.0 t80 -53.62 -55.93 21.54 Favored 'General case' 0 N--CA 1.479 1.017 0 C-N-CA 124.202 1.001 . . . . 0.0 110.598 178.765 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 83' ' ' ASN . . . . . . . . . . . . . 34.2 m-80 -66.28 -41.54 89.71 Favored 'General case' 0 N--CA 1.476 0.849 0 C-N-CA 122.627 0.371 . . . . 0.0 110.822 -175.948 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 84' ' ' HIS . . . . . 0.485 ' HA ' ' HB3' ' A' ' 87' ' ' GLU . 46.1 m170 -64.5 -26.72 68.55 Favored 'General case' 0 N--CA 1.479 0.993 0 C-N-CA 123.169 0.588 . . . . 0.0 111.837 178.779 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 85' ' ' LEU . . . . . 0.403 ' HG ' ' HD2' ' A' ' 91' ' ' PHE . 56.4 tp -58.33 -54.45 46.84 Favored 'General case' 0 N--CA 1.48 1.056 0 CA-C-O 121.711 0.767 . . . . 0.0 110.179 177.796 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 86' ' ' PHE . . . . . 0.441 ' CZ ' ' HB3' ' A' ' 27' ' ' ARG . 27.1 m-85 -75.63 -26.5 57.83 Favored 'General case' 0 CA--C 1.546 0.821 0 CA-C-N 114.273 -1.33 . . . . 0.0 111.308 179.876 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . 0.485 ' HB3' ' HA ' ' A' ' 84' ' ' HIS . 14.9 tp10 -69.55 -25.67 64.12 Favored 'General case' 0 N--CA 1.484 1.262 0 C-N-CA 124.204 1.002 . . . . 0.0 111.745 -176.523 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 39.0 p -123.89 0.86 8.65 Favored 'General case' 0 N--CA 1.474 0.75 0 C-N-CA 123.385 0.674 . . . . 0.0 110.837 179.215 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 34.5 mmtp 54.57 40.05 31.58 Favored 'General case' 0 N--CA 1.483 1.213 0 C-N-CA 124.083 0.953 . . . . 0.0 110.606 -177.109 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 90' ' ' ARG . . . . . 0.581 ' HB3' ' HB2' ' A' ' 56' ' ' PHE . 28.5 mtt180 -73.08 -7.69 52.42 Favored 'General case' 0 N--CA 1.487 1.381 0 C-N-CA 125.323 1.449 . . . . 0.0 113.352 -174.544 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 91' ' ' PHE . . . . . 0.538 ' HA ' ' HA2' ' A' ' 52' ' ' GLY . 3.2 p90 -68.75 164.72 21.13 Favored 'General case' 0 N--CA 1.476 0.86 0 C-N-CA 123.398 0.679 . . . . 0.0 111.347 168.377 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 24.2 ttpp . . . . . 0 CA--C 1.556 1.19 0 O-C-N 124.567 1.167 . . . . 0.0 110.451 171.896 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 20' ' ' MET . . . . . . . . . . . . . 3.1 ppp? . . . . . 0 N--CA 1.478 0.943 0 CA-C-O 120.471 0.177 . . . . 0.0 110.534 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -173.37 101.25 0.12 Allowed 'General case' 0 N--CA 1.473 0.708 0 C-N-CA 125.168 1.387 . . . . 0.0 107.945 178.219 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -67.52 95.15 0.45 Allowed 'General case' 0 N--CA 1.473 0.704 0 N-CA-C 109.426 -0.583 . . . . 0.0 109.426 178.006 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -83.15 57.78 4.12 Favored 'General case' 0 N--CA 1.474 0.733 0 C-N-CA 123.995 0.918 . . . . 0.0 110.294 -175.816 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 35.4 m -77.38 127.05 83.97 Favored Pre-proline 0 CA--C 1.549 0.912 0 CA-C-N 115.061 -0.972 . . . . 0.0 109.058 -178.372 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 25' ' ' PRO . . . . . 0.401 ' HB2' ' CE1' ' A' ' 51' ' ' HIS . 22.8 Cg_exo -61.28 98.53 0.15 Allowed 'Trans proline' 0 C--N 1.381 2.275 0 C-N-CA 122.881 2.387 . . . . 0.0 112.681 -172.809 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 28.1 pt20 -82.69 -168.28 1.96 Allowed 'General case' 0 N--CA 1.474 0.729 0 CA-C-N 114.715 -1.13 . . . . 0.0 110.199 179.899 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 40.4 ttp180 -58.88 118.21 5.5 Favored 'General case' 0 CA--C 1.549 0.935 0 CA-C-O 121.351 0.596 . . . . 0.0 110.779 174.481 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -94.99 -19.6 20.07 Favored 'General case' 0 CA--C 1.549 0.925 0 CA-C-N 114.664 -1.153 . . . . 0.0 111.604 178.621 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 29' ' ' TRP . . . . . . . . . . . . . 2.9 m-90 -135.98 135.0 39.18 Favored 'General case' 0 N--CA 1.483 1.182 0 C-N-CA 124.187 0.995 . . . . 0.0 108.949 -172.705 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 82.1 p -75.63 170.34 16.36 Favored 'General case' 0 CA--C 1.545 0.783 0 N-CA-C 109.804 -0.443 . . . . 0.0 109.804 178.161 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . 0.486 HG22 HD21 ' A' ' 83' ' ' ASN . 91.2 t -59.17 -37.52 68.96 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.273 0 C-N-CA 122.391 0.276 . . . . 0.0 111.186 -177.042 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 10.7 pt-20 -69.09 -34.24 74.79 Favored 'General case' 0 N--CA 1.48 1.072 0 C-N-CA 123.49 0.716 . . . . 0.0 110.918 178.15 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 79.4 mt-30 -70.16 -33.81 72.23 Favored 'General case' 0 N--CA 1.477 0.892 0 C-N-CA 123.005 0.522 . . . . 0.0 110.397 176.233 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.487 HD11 ' CD2' ' A' ' 82' ' ' TYR . 76.2 mt -64.36 -53.7 44.57 Favored 'General case' 0 N--CA 1.477 0.901 0 N-CA-C 109.305 -0.628 . . . . 0.0 109.305 175.651 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 75.9 mtp180 -71.01 -12.02 61.3 Favored 'General case' 0 N--CA 1.477 0.889 0 CA-C-N 114.468 -1.242 . . . . 0.0 111.466 -177.469 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 44.0 t -57.83 143.2 43.2 Favored 'General case' 0 C--N 1.354 0.777 0 C-N-CA 123.482 0.713 . . . . 0.0 111.468 175.496 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 35.7 mt-10 -80.02 -8.31 59.3 Favored 'General case' 0 CA--C 1.55 0.97 0 CA-C-N 114.765 -1.107 . . . . 0.0 111.205 -178.707 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 28.1 mm-40 -86.36 -38.06 17.82 Favored 'General case' 0 N--CA 1.474 0.746 0 C-N-CA 124.038 0.935 . . . . 0.0 110.676 179.509 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 1.3 tt -82.61 112.93 41.07 Favored Pre-proline 0 N--CA 1.476 0.84 0 N-CA-C 108.328 -0.99 . . . . 0.0 108.328 179.096 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 40' ' ' PRO . . . . . 0.522 ' HB2' ' HG2' ' A' ' 42' ' ' LYS . 79.0 Cg_endo -73.81 148.7 41.52 Favored 'Trans proline' 0 C--N 1.372 1.809 0 C-N-CA 121.933 1.755 . . . . 0.0 111.406 -179.638 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 18.8 ptpt -64.52 -28.27 69.54 Favored 'General case' 0 N--CA 1.472 0.669 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.871 -178.429 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . 0.522 ' HG2' ' HB2' ' A' ' 40' ' ' PRO . 19.8 ptpt -65.08 -33.89 77.11 Favored 'General case' 0 N--CA 1.472 0.653 0 C-N-CA 123.453 0.701 . . . . 0.0 111.387 179.571 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 43' ' ' ASP . . . . . 0.412 ' HB2' ' HG2' ' A' ' 40' ' ' PRO . 25.1 t70 -75.37 -31.53 60.52 Favored 'General case' 0 N--CA 1.476 0.845 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.642 -177.515 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 49.4 mt -69.06 -50.18 55.69 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.779 0 N-CA-C 109.657 -0.497 . . . . 0.0 109.657 176.068 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 72.9 mt -57.62 -41.89 80.17 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.335 0 C-N-CA 123.497 0.719 . . . . 0.0 110.468 176.521 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 46' ' ' LYS . . . . . 0.42 ' HD3' HD11 ' A' ' 66' ' ' ILE . 23.1 tptm -53.46 -46.92 70.09 Favored 'General case' 0 N--CA 1.485 1.307 0 C-N-CA 124.555 1.142 . . . . 0.0 110.85 176.53 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 11.9 t80 -66.49 -47.58 72.56 Favored 'General case' 0 N--CA 1.473 0.686 0 CA-C-N 114.916 -1.038 . . . . 0.0 110.897 -179.478 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 93.2 mt -68.12 -33.44 74.5 Favored 'General case' 0 CA--C 1.541 0.627 0 C-N-CA 122.922 0.489 . . . . 0.0 111.842 -173.225 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 3.6 pt20 -83.5 -25.5 31.04 Favored 'General case' 0 N--CA 1.484 1.271 0 C-N-CA 122.464 0.306 . . . . 0.0 111.592 177.623 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 4.2 tm-20 -54.21 -42.5 69.83 Favored 'General case' 0 N--CA 1.49 1.526 0 C-N-CA 124.327 1.051 . . . . 0.0 111.846 -178.919 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 51' ' ' HIS . . . . . 0.401 ' CE1' ' HB2' ' A' ' 25' ' ' PRO . 4.0 p80 -138.74 -20.73 1.01 Allowed 'General case' 0 N--CA 1.481 1.123 0 CA-C-N 116.28 -0.418 . . . . 0.0 112.09 -172.755 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -60.26 135.2 50.18 Favored Glycine 0 C--N 1.352 1.43 0 CA-C-O 119.714 -0.492 . . . . 0.0 112.006 172.032 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . 0.423 ' O ' ' HG ' ' A' ' 57' ' ' LEU . 32.4 t -62.98 148.09 48.66 Favored 'General case' 0 N--CA 1.471 0.622 0 C-N-CA 123.349 0.66 . . . . 0.0 111.868 -175.495 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 25.5 t70 -59.12 -36.95 76.08 Favored 'General case' 0 N--CA 1.481 1.125 0 C-N-CA 124.005 0.922 . . . . 0.0 112.197 -176.038 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 38.4 m -64.0 -37.53 87.74 Favored 'General case' 0 CA--C 1.549 0.931 0 C-N-CA 123.516 0.726 . . . . 0.0 111.367 177.591 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 52.4 t80 -66.5 -47.26 73.53 Favored 'General case' 0 N--CA 1.481 1.085 0 C-N-CA 123.498 0.719 . . . . 0.0 109.593 173.253 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . 0.423 ' HG ' ' O ' ' A' ' 53' ' ' SER . 76.3 mt -60.16 -33.47 72.22 Favored 'General case' 0 N--CA 1.476 0.874 0 CA-C-N 115.203 -0.908 . . . . 0.0 111.377 -175.427 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -65.03 -48.4 73.98 Favored 'General case' 0 N--CA 1.476 0.839 0 C-N-CA 123.626 0.771 . . . . 0.0 111.538 178.646 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 40.2 mt-10 -62.34 -26.47 68.46 Favored 'General case' 0 N--CA 1.482 1.128 0 CA-C-N 115.222 -0.899 . . . . 0.0 112.039 -178.262 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 72.8 m80 -114.37 1.76 14.51 Favored 'General case' 0 N--CA 1.483 1.197 0 C-N-CA 123.3 0.64 . . . . 0.0 112.241 -176.754 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 49.1 mtmt 62.37 22.82 13.48 Favored 'General case' 0 N--CA 1.497 1.881 0 C-N-CA 125.268 1.427 . . . . 0.0 112.6 178.073 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 89.6 mt -80.1 -10.97 59.8 Favored 'General case' 0 N--CA 1.478 0.926 0 C-N-CA 124.186 0.994 . . . . 0.0 112.312 -177.033 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 1.4 pp -74.4 162.48 28.81 Favored 'General case' 0 N--CA 1.48 1.035 0 CA-C-O 121.322 0.582 . . . . 0.0 111.207 175.298 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 89.23 -159.96 29.09 Favored Glycine 0 C--O 1.242 0.649 0 CA-C-N 115.02 -0.991 . . . . 0.0 112.267 178.683 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 65' ' ' ASN . . . . . 0.46 ' OD1' ' HG2' ' A' ' 67' ' ' LYS . 14.0 t-20 -75.63 139.34 41.96 Favored 'General case' 0 N--CA 1.469 0.481 0 N-CA-C 109.441 -0.578 . . . . 0.0 109.441 -179.447 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 66' ' ' ILE . . . . . 0.42 HD11 ' HD3' ' A' ' 46' ' ' LYS . 59.7 mt -61.0 -46.41 96.71 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.797 0 O-C-N 123.69 0.619 . . . . 0.0 112.568 -171.261 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 67' ' ' LYS . . . . . 0.46 ' HG2' ' OD1' ' A' ' 65' ' ' ASN . 8.9 ptpp? -60.48 -36.29 77.95 Favored 'General case' 0 N--CA 1.491 1.617 0 CA-C-N 118.334 0.515 . . . . 0.0 110.83 -178.344 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 7.0 t30 -61.42 -40.5 94.63 Favored 'General case' 0 N--CA 1.48 1.028 0 C-N-CA 124.543 1.137 . . . . 0.0 110.975 176.692 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 32.8 t -73.13 -40.22 57.9 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.808 0 CA-C-N 115.223 -0.899 . . . . 0.0 110.441 175.984 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -72.82 -5.89 41.21 Favored 'General case' 0 N--CA 1.484 1.229 0 C-N-CA 124.614 1.166 . . . . 0.0 113.221 -170.332 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -90.34 -18.94 24.65 Favored 'General case' 0 CA--C 1.548 0.867 0 C-N-CA 122.209 0.203 . . . . 0.0 110.765 176.278 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 10.1 t -120.08 -15.16 8.78 Favored 'General case' 0 N--CA 1.477 0.876 0 C-N-CA 123.927 0.891 . . . . 0.0 111.354 -178.022 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -90.32 97.37 11.14 Favored 'General case' 0 N--CA 1.475 0.777 0 C-N-CA 123.243 0.617 . . . . 0.0 110.317 179.407 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 74' ' ' ASN . . . . . 0.403 ' ND2' ' HB3' ' A' ' 76' ' ' ASP . 54.4 t30 -66.3 156.7 33.64 Favored 'General case' 0 N--CA 1.477 0.876 0 CA-C-N 115.431 -0.804 . . . . 0.0 109.125 173.077 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . 0.442 ' O ' HG23 ' A' ' 79' ' ' VAL . 2.9 tppp? -64.32 -38.76 92.18 Favored 'General case' 0 CA--C 1.548 0.892 0 N-CA-C 110.186 -0.302 . . . . 0.0 110.186 179.734 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 76' ' ' ASP . . . . . 0.403 ' HB3' ' ND2' ' A' ' 74' ' ' ASN . 31.0 t70 -64.53 -34.82 79.12 Favored 'General case' 0 N--CA 1.484 1.253 0 C-N-CA 124.156 0.982 . . . . 0.0 111.28 175.783 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 17.3 t60 -66.45 -38.63 87.77 Favored 'General case' 0 N--CA 1.487 1.386 0 C-N-CA 123.967 0.907 . . . . 0.0 109.376 174.232 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 71.8 mt -74.42 -26.62 60.18 Favored 'General case' 0 N--CA 1.475 0.793 0 C-N-CA 123.401 0.68 . . . . 0.0 112.326 -178.536 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 79' ' ' VAL . . . . . 0.442 HG23 ' O ' ' A' ' 75' ' ' LYS . 88.1 t -68.79 -44.02 82.34 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.018 0 N-CA-C 109.271 -0.64 . . . . 0.0 109.271 172.79 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 59.9 m -58.11 -51.77 68.33 Favored 'General case' 0 CA--C 1.546 0.79 0 CA-C-N 115.041 -0.981 . . . . 0.0 110.783 175.847 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -65.49 -45.88 81.87 Favored 'General case' 0 N--CA 1.475 0.786 0 C-N-CA 123.483 0.713 . . . . 0.0 111.779 -176.864 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 82' ' ' TYR . . . . . 0.487 ' CD2' HD11 ' A' ' 34' ' ' LEU . 79.8 t80 -58.82 -57.34 13.45 Favored 'General case' 0 N--CA 1.474 0.75 0 C-N-CA 124.289 1.036 . . . . 0.0 110.307 -177.712 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 83' ' ' ASN . . . . . 0.486 HD21 HG22 ' A' ' 31' ' ' VAL . 18.2 m-80 -60.56 -42.1 95.91 Favored 'General case' 0 CA--C 1.549 0.913 0 CA-C-N 115.677 -0.692 . . . . 0.0 111.65 -176.037 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 63.5 m-70 -68.22 -25.24 65.11 Favored 'General case' 0 N--CA 1.481 1.097 0 CA-C-O 118.733 -0.651 . . . . 0.0 112.66 178.78 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 57.1 tp -62.08 -53.5 54.55 Favored 'General case' 0 N--CA 1.49 1.553 0 CA-C-N 118.76 0.709 . . . . 0.0 110.876 178.643 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 24.4 m-85 -75.33 -20.64 58.93 Favored 'General case' 0 N--CA 1.477 0.898 0 CA-C-N 114.613 -1.176 . . . . 0.0 110.868 -177.54 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 34.4 tt0 -69.36 -26.6 64.75 Favored 'General case' 0 N--CA 1.479 1.004 0 C-N-CA 123.316 0.647 . . . . 0.0 111.062 175.988 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 26.3 p -112.26 -21.93 11.18 Favored 'General case' 0 N--CA 1.477 0.92 0 C-N-CA 123.897 0.879 . . . . 0.0 110.914 179.385 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 97.3 mttt 55.1 46.87 23.16 Favored 'General case' 0 N--CA 1.481 1.09 0 C-N-CA 124.985 1.314 . . . . 0.0 112.292 -176.131 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 99.2 mtt180 -71.5 -16.05 62.33 Favored 'General case' 0 N--CA 1.493 1.697 0 C-N-CA 124.144 0.978 . . . . 0.0 112.095 177.973 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 91' ' ' PHE . . . . . . . . . . . . . 54.3 p90 -72.57 161.14 31.17 Favored 'General case' 0 CA--C 1.543 0.681 0 C-N-CA 123.631 0.773 . . . . 0.0 111.904 178.435 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 49.2 pttt . . . . . 0 C--O 1.254 1.294 0 N-CA-C 108.313 -0.995 . . . . 0.0 108.313 165.959 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 20' ' ' MET . . . . . . . . . . . . . 96.4 mmm . . . . . 0 N--CA 1.481 1.077 0 N-CA-C 110.093 -0.336 . . . . 0.0 110.093 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -143.03 135.88 27.84 Favored 'General case' 0 N--CA 1.472 0.667 0 C-N-CA 124.032 0.933 . . . . 0.0 108.823 179.886 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -82.27 85.09 6.9 Favored 'General case' 0 N--CA 1.47 0.532 0 C-N-CA 123.351 0.661 . . . . 0.0 110.227 -177.619 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -83.23 163.68 20.6 Favored 'General case' 0 N--CA 1.472 0.636 0 CA-C-N 115.877 -0.601 . . . . 0.0 110.861 178.776 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 24.3 m -114.52 136.15 22.36 Favored Pre-proline 0 CA--C 1.548 0.887 0 C-N-CA 124.144 0.978 . . . . 0.0 109.734 178.855 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 87.4 Cg_exo -50.3 118.71 4.22 Favored 'Trans proline' 0 C--N 1.382 2.301 0 C-N-CA 123.91 3.074 . . . . 0.0 114.462 179.776 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 45.6 mt-30 -76.83 171.02 15.41 Favored 'General case' 0 C--O 1.245 0.847 0 CA-C-N 115.785 -0.643 . . . . 0.0 109.364 165.973 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -63.66 134.19 54.97 Favored 'General case' 0 CA--C 1.544 0.736 0 CA-C-O 120.837 0.351 . . . . 0.0 110.209 175.384 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -77.56 -41.76 37.77 Favored 'General case' 0 N--CA 1.47 0.574 0 N-CA-C 109.101 -0.703 . . . . 0.0 109.101 178.192 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 29' ' ' TRP . . . . . 0.4 ' CH2' ' HB3' ' A' ' 43' ' ' ASP . 10.7 m-90 -138.32 159.68 41.44 Favored 'General case' 0 N--CA 1.477 0.9 0 C-N-CA 124.717 1.207 . . . . 0.0 108.236 175.462 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 67.9 p -85.42 168.55 14.5 Favored 'General case' 0 N--CA 1.483 1.218 0 N-CA-C 108.662 -0.866 . . . . 0.0 108.662 176.525 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 7.2 p -61.0 -39.34 81.86 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.197 0 CA-C-N 118.052 0.387 . . . . 0.0 111.425 -174.859 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -64.26 -35.74 81.83 Favored 'General case' 0 N--CA 1.479 1.015 0 C-N-CA 123.836 0.855 . . . . 0.0 111.42 177.775 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 51.0 mt-30 -69.66 -42.37 74.31 Favored 'General case' 0 C--N 1.353 0.746 0 C-N-CA 123.28 0.632 . . . . 0.0 110.757 175.045 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.442 ' HA ' HD13 ' A' ' 39' ' ' LEU . 89.2 mt -63.51 -53.61 49.23 Favored 'General case' 0 N--CA 1.478 0.974 0 C-N-CA 123.237 0.615 . . . . 0.0 111.094 -175.697 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 8.0 ptm180 -65.01 -22.45 67.0 Favored 'General case' 0 N--CA 1.473 0.719 0 O-C-N 124.176 0.923 . . . . 0.0 112.003 -172.718 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 23.3 t -60.2 132.3 53.49 Favored 'General case' 0 CA--C 1.545 0.756 0 C-N-CA 123.552 0.741 . . . . 0.0 110.457 177.917 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 3.1 mp0 -66.72 -21.15 66.08 Favored 'General case' 0 CA--C 1.546 0.819 0 C-N-CA 123.658 0.783 . . . . 0.0 111.718 -173.395 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 13.8 pt20 -69.47 -29.18 66.79 Favored 'General case' 0 N--CA 1.479 1.011 0 C-N-CA 122.823 0.449 . . . . 0.0 111.211 177.456 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.442 HD13 ' HA ' ' A' ' 34' ' ' LEU . 4.0 tt -86.33 113.09 50.54 Favored Pre-proline 0 N--CA 1.475 0.775 0 N-CA-C 107.967 -1.123 . . . . 0.0 107.967 177.728 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 40' ' ' PRO . . . . . 0.451 ' HB2' ' HG2' ' A' ' 42' ' ' LYS . 98.6 Cg_endo -73.03 149.26 46.41 Favored 'Trans proline' 0 C--N 1.375 1.963 0 C-N-CA 122.509 2.14 . . . . 0.0 112.015 -178.92 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 46.2 mtmt -68.27 -21.12 64.82 Favored 'General case' 0 N--CA 1.472 0.65 0 CA-C-N 114.868 -1.06 . . . . 0.0 112.043 -175.572 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . 0.451 ' HG2' ' HB2' ' A' ' 40' ' ' PRO . 17.3 ptpt -65.08 -34.16 77.76 Favored 'General case' 0 CA--C 1.544 0.747 0 C-N-CA 123.97 0.908 . . . . 0.0 111.149 178.462 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 43' ' ' ASP . . . . . 0.4 ' HB3' ' CH2' ' A' ' 29' ' ' TRP . 0.8 OUTLIER -69.79 -38.79 76.8 Favored 'General case' 0 C--O 1.241 0.616 0 C-N-CA 123.617 0.767 . . . . 0.0 111.161 179.015 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 43.1 mt -68.74 -50.88 51.05 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.596 0 CA-C-N 115.49 -0.777 . . . . 0.0 110.164 -178.457 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 75.7 mt -59.81 -36.09 64.17 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.163 0 C-N-CA 123.277 0.631 . . . . 0.0 110.872 177.471 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 13.4 ttmm -59.48 -48.45 81.62 Favored 'General case' 0 N--CA 1.479 0.996 0 C-N-CA 122.788 0.435 . . . . 0.0 111.023 174.384 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 20.9 t80 -54.88 -45.96 74.71 Favored 'General case' 0 N--CA 1.484 1.254 0 CA-C-O 121.259 0.552 . . . . 0.0 110.73 176.115 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . 0.421 ' HB3' ' HE2' ' A' ' 56' ' ' PHE . 90.8 mt -70.58 -37.93 74.01 Favored 'General case' 0 CA--C 1.544 0.73 0 CA-C-N 115.045 -0.98 . . . . 0.0 112.163 -175.152 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . 0.418 ' HA ' HD11 ' A' ' 57' ' ' LEU . 3.3 pt20 -85.6 -36.43 20.39 Favored 'General case' 0 N--CA 1.489 1.503 0 N-CA-C 113.121 0.786 . . . . 0.0 113.121 -175.935 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 32.5 tt0 -69.1 -37.42 78.41 Favored 'General case' 0 N--CA 1.479 0.991 0 C-N-CA 123.802 0.841 . . . . 0.0 111.599 -170.303 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -141.04 14.0 2.25 Favored 'General case' 0 N--CA 1.48 1.064 0 N-CA-C 113.107 0.78 . . . . 0.0 113.107 -178.93 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -103.9 150.38 17.45 Favored Glycine 0 N--CA 1.478 1.472 0 N-CA-C 110.639 -0.984 . . . . 0.0 110.639 162.564 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . 0.485 ' O ' ' HG ' ' A' ' 57' ' ' LEU . 80.1 p -68.09 159.25 31.28 Favored 'General case' 0 N--CA 1.485 1.308 0 N-CA-C 113.353 0.871 . . . . 0.0 113.353 -170.137 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 22.1 t70 -66.21 -38.85 88.96 Favored 'General case' 0 N--CA 1.48 1.062 0 C-N-CA 124.514 1.126 . . . . 0.0 111.409 -177.331 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 13.3 t -67.49 -31.06 70.93 Favored 'General case' 0 N--CA 1.478 0.965 0 C-N-CA 123.544 0.738 . . . . 0.0 110.992 -179.364 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 56' ' ' PHE . . . . . 0.455 ' HD1' HH11 ' A' ' 90' ' ' ARG . 27.2 t80 -65.56 -48.81 71.14 Favored 'General case' 0 CA--C 1.548 0.874 0 CA-C-N 115.435 -0.802 . . . . 0.0 110.246 170.753 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . 0.485 ' HG ' ' O ' ' A' ' 53' ' ' SER . 72.1 mt -60.97 -45.4 94.9 Favored 'General case' 0 N--CA 1.481 1.122 0 C-N-CA 122.884 0.473 . . . . 0.0 111.347 -177.674 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -52.74 -26.24 13.53 Favored 'General case' 0 CA--C 1.545 0.752 0 C-N-CA 125.918 1.687 . . . . 0.0 113.734 -175.033 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 57.0 mt-10 -57.08 -49.09 76.93 Favored 'General case' 0 N--CA 1.481 1.118 0 C-N-CA 123.812 0.845 . . . . 0.0 111.789 179.81 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 58.7 t-80 -109.93 -5.2 15.55 Favored 'General case' 0 N--CA 1.485 1.276 0 C-N-CA 123.379 0.672 . . . . 0.0 111.013 177.563 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 24.9 mtpp 64.84 59.43 0.9 Allowed 'General case' 0 CA--C 1.545 0.763 0 C-N-CA 124.578 1.151 . . . . 0.0 109.908 -170.692 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 0.507 ' HA ' HG11 ' A' ' 69' ' ' VAL . 84.6 mt -83.49 -0.34 49.78 Favored 'General case' 0 N--CA 1.489 1.518 0 C-N-CA 124.11 0.964 . . . . 0.0 110.848 175.771 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -82.47 158.83 23.07 Favored 'General case' 0 C--O 1.242 0.672 0 C-N-CA 124.631 1.172 . . . . 0.0 110.751 176.093 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 85.67 -146.92 21.76 Favored Glycine 0 C--N 1.337 0.6 0 CA-C-N 115.038 -0.983 . . . . 0.0 113.466 175.91 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 78.1 m-20 -65.36 111.21 2.93 Favored 'General case' 0 N--CA 1.473 0.698 0 C-N-CA 124.182 0.993 . . . . 0.0 109.83 -175.691 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 55.1 mt -56.1 -51.45 61.95 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.107 0 O-C-N 124.31 1.006 . . . . 0.0 112.678 -169.015 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 67' ' ' LYS . . . . . 0.566 ' H ' ' HD2' ' A' ' 67' ' ' LYS . 0.0 OUTLIER -71.69 -32.07 67.44 Favored 'General case' 0 N--CA 1.485 1.293 0 C-N-CA 123.183 0.593 . . . . 0.0 110.28 -174.634 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 49.0 t30 -62.82 -35.67 80.66 Favored 'General case' 0 N--CA 1.482 1.127 0 CA-C-N 115.277 -0.874 . . . . 0.0 110.846 175.326 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 69' ' ' VAL . . . . . 0.507 HG11 ' HA ' ' A' ' 62' ' ' LEU . 64.6 t -73.85 -41.28 53.76 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.859 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.145 172.058 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 70' ' ' ALA . . . . . 0.526 ' HA ' ' HB3' ' A' ' 73' ' ' ALA . . . -69.94 -1.94 11.04 Favored 'General case' 0 N--CA 1.487 1.393 0 C-N-CA 124.377 1.071 . . . . 0.0 113.417 -174.172 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 64.0 pttt -75.91 -33.71 59.91 Favored 'General case' 0 N--CA 1.478 0.966 0 CA-C-N 118.06 0.391 . . . . 0.0 110.131 174.081 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 10.0 t -115.16 -13.92 11.77 Favored 'General case' 0 N--CA 1.472 0.641 0 C-N-CA 123.988 0.915 . . . . 0.0 110.626 -176.906 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . 0.526 ' HB3' ' HA ' ' A' ' 70' ' ' ALA . . . -78.25 94.19 4.75 Favored 'General case' 0 C--N 1.343 0.317 0 N-CA-C 108.976 -0.75 . . . . 0.0 108.976 174.16 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 27.8 p-10 -74.25 155.54 38.17 Favored 'General case' 0 C--O 1.244 0.79 0 N-CA-C 109.372 -0.603 . . . . 0.0 109.372 176.33 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 4.6 tppp? -56.54 -39.05 72.76 Favored 'General case' 0 CA--C 1.549 0.916 0 C-N-CA 123.82 0.848 . . . . 0.0 111.846 -174.476 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 25.9 t70 -59.42 -49.5 77.54 Favored 'General case' 0 N--CA 1.476 0.869 0 C-N-CA 124.055 0.942 . . . . 0.0 112.333 -177.215 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 8.7 t60 -70.76 -28.12 64.45 Favored 'General case' 0 N--CA 1.476 0.869 0 C-N-CA 123.327 0.651 . . . . 0.0 110.696 -176.717 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . 0.463 HD21 ' HB1' ' A' ' 73' ' ' ALA . 82.4 mt -68.72 -33.61 74.23 Favored 'General case' 0 N--CA 1.478 0.925 0 C-N-CA 122.824 0.449 . . . . 0.0 111.972 176.266 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 57.1 t -66.03 -45.48 90.63 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.702 0 O-C-N 124.031 0.832 . . . . 0.0 109.653 171.227 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 33.8 m -58.63 -40.1 82.41 Favored 'General case' 0 N--CA 1.479 1.004 0 C-N-CA 123.855 0.862 . . . . 0.0 111.209 177.571 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -69.55 -46.66 65.93 Favored 'General case' 0 N--CA 1.469 0.514 0 C-N-CA 123.858 0.863 . . . . 0.0 110.527 178.142 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 82' ' ' TYR . . . . . . . . . . . . . 10.6 t80 -52.05 -54.8 25.75 Favored 'General case' 0 N--CA 1.475 0.816 0 C-N-CA 124.857 1.263 . . . . 0.0 110.997 179.349 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 83' ' ' ASN . . . . . . . . . . . . . 62.3 m-80 -65.0 -38.16 90.05 Favored 'General case' 0 N--CA 1.478 0.953 0 C-N-CA 122.825 0.45 . . . . 0.0 111.511 -177.609 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 32.1 m170 -66.64 -26.14 66.92 Favored 'General case' 0 N--CA 1.484 1.269 0 C-N-CA 123.729 0.811 . . . . 0.0 112.054 177.993 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 37.9 tp -58.52 -52.67 64.66 Favored 'General case' 0 N--CA 1.478 0.959 0 CA-C-O 121.386 0.613 . . . . 0.0 110.538 176.948 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 28.6 m-85 -75.44 -32.56 60.72 Favored 'General case' 0 N--CA 1.47 0.562 0 CA-C-N 114.261 -1.336 . . . . 0.0 111.771 -179.11 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 35.9 tt0 -55.99 -45.58 78.95 Favored 'General case' 0 N--CA 1.484 1.229 0 C-N-CA 123.941 0.896 . . . . 0.0 112.306 -172.664 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 16.5 p -112.77 3.41 16.46 Favored 'General case' 0 N--CA 1.477 0.908 0 C-N-CA 123.91 0.884 . . . . 0.0 111.393 178.194 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 47.9 mtpt 52.75 64.66 1.77 Allowed 'General case' 0 N--CA 1.479 0.977 0 C-N-CA 124.664 1.186 . . . . 0.0 110.612 179.182 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 90' ' ' ARG . . . . . 0.455 HH11 ' HD1' ' A' ' 56' ' ' PHE . 99.3 mtt180 -78.5 -33.19 48.27 Favored 'General case' 0 N--CA 1.473 0.701 0 CA-C-N 114.561 -1.199 . . . . 0.0 112.099 -172.374 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 91' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -51.41 160.73 0.54 Allowed 'General case' 0 N--CA 1.483 1.188 0 C-N-CA 124.116 0.966 . . . . 0.0 113.436 178.353 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 92' ' ' LYS . . . . . 0.588 ' HA ' ' HE2' ' A' ' 92' ' ' LYS . 11.0 mmpt? . . . . . 0 C--O 1.254 1.305 0 C-N-CA 124.33 1.052 . . . . 0.0 111.825 178.421 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 20' ' ' MET . . . . . 0.415 ' SD ' ' N ' ' A' ' 20' ' ' MET . 1.1 pmm? . . . . . 0 N--CA 1.476 0.829 0 N-CA-C 109.548 -0.538 . . . . 0.0 109.548 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -98.92 133.66 42.88 Favored 'General case' 0 N--CA 1.476 0.831 0 C-N-CA 123.582 0.753 . . . . 0.0 109.872 -178.884 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -69.27 91.73 0.54 Allowed 'General case' 0 N--CA 1.472 0.652 0 CA-C-O 121.272 0.558 . . . . 0.0 110.021 178.298 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -128.08 35.51 4.43 Favored 'General case' 0 N--CA 1.472 0.662 0 C-N-CA 124.331 1.052 . . . . 0.0 108.738 178.612 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 21.9 m -73.39 147.66 87.66 Favored Pre-proline 0 CA--C 1.55 0.962 0 CA-C-N 114.748 -1.115 . . . . 0.0 110.492 -175.546 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 36.8 Cg_endo -65.1 109.13 1.26 Allowed 'Trans proline' 0 C--N 1.371 1.754 0 C-N-CA 122.127 1.884 . . . . 0.0 111.282 175.139 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 68.0 mt-30 -90.71 170.71 9.91 Favored 'General case' 0 N--CA 1.475 0.82 0 CA-C-N 114.668 -1.151 . . . . 0.0 108.063 174.704 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . 0.535 ' HB2' ' OH ' ' A' ' 82' ' ' TYR . 0.0 OUTLIER -62.06 139.34 58.44 Favored 'General case' 0 N--CA 1.477 0.895 0 CA-C-O 120.889 0.376 . . . . 0.0 111.521 179.577 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -101.51 -43.3 5.95 Favored 'General case' 0 N--CA 1.475 0.818 0 C-N-CA 123.591 0.756 . . . . 0.0 110.878 -174.489 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 29' ' ' TRP . . . . . . . . . . . . . 3.7 m-90 -101.76 152.64 20.63 Favored 'General case' 0 N--CA 1.474 0.731 0 C-N-CA 124.554 1.142 . . . . 0.0 111.605 -169.43 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 64.9 p -92.09 174.16 7.46 Favored 'General case' 0 CA--C 1.542 0.657 0 C-N-CA 123.511 0.724 . . . . 0.0 109.505 170.963 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . 0.428 ' HA ' HD12 ' A' ' 34' ' ' LEU . 12.4 p -56.11 -37.97 51.58 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.36 0 C-N-CA 123.379 0.672 . . . . 0.0 111.973 -177.674 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . 0.41 ' HA ' ' HG2' ' A' ' 35' ' ' ARG . 10.0 pt-20 -73.61 -35.92 65.41 Favored 'General case' 0 N--CA 1.474 0.727 0 C-N-CA 123.666 0.787 . . . . 0.0 111.843 -178.994 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 2.7 mp0 -66.64 -33.42 75.61 Favored 'General case' 0 N--CA 1.482 1.149 0 C-N-CA 122.839 0.455 . . . . 0.0 110.652 176.144 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.543 HD13 ' HA ' ' A' ' 79' ' ' VAL . 79.4 mt -65.48 -50.72 64.28 Favored 'General case' 0 N--CA 1.48 1.041 0 CA-C-O 121.302 0.572 . . . . 0.0 111.127 177.131 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . 0.41 ' HG2' ' HA ' ' A' ' 32' ' ' GLU . 13.8 ptm180 -74.34 -11.51 60.28 Favored 'General case' 0 CA--C 1.548 0.892 0 CA-C-N 114.727 -1.124 . . . . 0.0 112.073 -175.786 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 48.3 t -64.73 143.98 57.55 Favored 'General case' 0 CA--C 1.553 1.079 0 C-N-CA 123.497 0.719 . . . . 0.0 111.113 173.65 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 13.9 pt-20 -73.71 -27.99 61.49 Favored 'General case' 0 N--CA 1.481 1.078 0 C-N-CA 123.307 0.643 . . . . 0.0 110.489 175.816 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 92.9 mt-30 -63.16 -31.16 72.24 Favored 'General case' 0 N--CA 1.474 0.773 0 C-N-CA 124.982 1.313 . . . . 0.0 110.868 -177.18 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.44 HD23 ' HA ' ' A' ' 34' ' ' LEU . 48.7 tp -92.04 109.16 35.54 Favored Pre-proline 0 CA--C 1.549 0.92 0 N-CA-C 108.362 -0.977 . . . . 0.0 108.362 170.713 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 40' ' ' PRO . . . . . 0.498 ' HG2' ' HB2' ' A' ' 43' ' ' ASP . 47.3 Cg_endo -68.61 151.11 75.23 Favored 'Trans proline' 0 C--N 1.378 2.081 0 C-N-CA 122.821 2.347 . . . . 0.0 112.466 -178.587 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 49.7 mtmt -58.21 -42.72 86.84 Favored 'General case' 0 N--CA 1.477 0.883 0 C-N-CA 123.983 0.913 . . . . 0.0 111.325 -179.806 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 17.8 ptpt -63.52 -34.34 77.57 Favored 'General case' 0 CA--C 1.542 0.669 0 CA-C-N 114.442 -1.254 . . . . 0.0 111.763 -176.274 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 43' ' ' ASP . . . . . 0.498 ' HB2' ' HG2' ' A' ' 40' ' ' PRO . 14.0 t70 -73.99 -30.83 62.69 Favored 'General case' 0 N--CA 1.48 1.048 0 O-C-N 123.109 0.256 . . . . 0.0 110.847 -176.941 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 44' ' ' ILE . . . . . 0.605 HD12 HD13 ' A' ' 78' ' ' LEU . 42.8 mt -70.22 -52.16 32.54 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.973 0 C-N-CA 122.827 0.451 . . . . 0.0 110.033 177.036 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 69.5 mt -55.64 -41.84 66.43 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.537 0 C-N-CA 123.612 0.765 . . . . 0.0 110.581 177.008 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 35.1 ttmt -56.25 -48.38 76.64 Favored 'General case' 0 N--CA 1.474 0.763 0 C-N-CA 124.737 1.215 . . . . 0.0 111.241 178.036 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 15.9 t80 -61.37 -46.48 90.02 Favored 'General case' 0 N--CA 1.474 0.74 0 CA-C-N 115.045 -0.979 . . . . 0.0 110.903 178.021 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 88.5 mt -69.42 -32.56 71.61 Favored 'General case' 0 N--CA 1.473 0.705 0 C-N-CA 123.544 0.738 . . . . 0.0 112.14 -174.704 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 3.1 pt20 -82.29 -26.33 33.19 Favored 'General case' 0 N--CA 1.479 0.979 0 CA-C-O 120.779 0.323 . . . . 0.0 110.716 178.788 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 11.3 tp10 -63.43 -26.27 68.66 Favored 'General case' 0 N--CA 1.48 1.046 0 C-N-CA 124.068 0.947 . . . . 0.0 112.07 -176.933 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 51' ' ' HIS . . . . . 0.462 ' O ' ' HG2' ' A' ' 92' ' ' LYS . 0.4 OUTLIER -136.22 -24.94 1.22 Allowed 'General case' 0 N--CA 1.487 1.404 0 N-CA-C 113.428 0.899 . . . . 0.0 113.428 178.764 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -58.04 131.68 52.17 Favored Glycine 0 C--N 1.346 1.089 0 CA-C-N 118.426 0.557 . . . . 0.0 112.761 174.118 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 48.2 t -64.36 160.14 19.63 Favored 'General case' 0 N--CA 1.477 0.914 0 C-N-CA 123.014 0.525 . . . . 0.0 111.34 -177.51 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 4.8 m-20 -56.95 -38.19 72.6 Favored 'General case' 0 N--CA 1.482 1.167 0 C-N-CA 124.111 0.964 . . . . 0.0 111.003 -178.587 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 28.2 t -65.98 -36.45 83.34 Favored 'General case' 0 CA--C 1.548 0.891 0 CA-C-N 114.175 -1.375 . . . . 0.0 110.847 -179.468 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 88.5 t80 -70.75 -51.12 29.23 Favored 'General case' 0 N--CA 1.476 0.862 0 C-N-CA 123.102 0.561 . . . . 0.0 110.099 175.791 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . 0.449 HD22 ' HB2' ' A' ' 62' ' ' LEU . 73.1 mt -62.78 -31.8 72.84 Favored 'General case' 0 N--CA 1.474 0.771 0 CA-C-N 115.19 -0.913 . . . . 0.0 111.561 -173.633 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -62.09 -49.5 75.68 Favored 'General case' 0 N--CA 1.476 0.862 0 C-N-CA 123.587 0.755 . . . . 0.0 111.443 177.286 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 36.1 mt-10 -57.4 -48.74 78.29 Favored 'General case' 0 N--CA 1.483 1.224 0 C-N-CA 123.81 0.844 . . . . 0.0 110.555 179.357 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 64.2 m80 -95.67 1.95 53.79 Favored 'General case' 0 N--CA 1.477 0.876 0 CA-C-N 114.86 -1.064 . . . . 0.0 111.974 -170.532 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 39.4 mtmm 57.34 27.46 13.8 Favored 'General case' 0 N--CA 1.492 1.666 0 C-N-CA 124.496 1.118 . . . . 0.0 112.797 176.951 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 0.456 HD11 ' HB1' ' A' ' 81' ' ' ALA . 85.1 mt -82.32 -11.61 58.5 Favored 'General case' 0 N--CA 1.483 1.183 0 C-N-CA 123.298 0.639 . . . . 0.0 111.671 -176.012 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 2.9 pp -79.54 158.45 27.17 Favored 'General case' 0 N--CA 1.475 0.806 0 CA-C-O 121.103 0.478 . . . . 0.0 110.724 175.347 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 93.42 -168.52 29.58 Favored Glycine 0 C--N 1.339 0.74 0 CA-C-N 115.313 -0.858 . . . . 0.0 112.774 179.76 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 65' ' ' ASN . . . . . 0.416 ' O ' HG23 ' A' ' 69' ' ' VAL . 51.5 t-20 -59.7 111.87 1.6 Allowed 'General case' 0 N--CA 1.478 0.974 0 C-N-CA 124.08 0.952 . . . . 0.0 109.593 -177.521 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 39.8 mt -55.36 -42.69 68.18 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.58 0 C-N-CA 123.873 0.869 . . . . 0.0 111.307 -171.652 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 17.5 mtpp -55.96 -45.73 78.8 Favored 'General case' 0 CA--C 1.545 0.781 0 C-N-CA 124.466 1.106 . . . . 0.0 111.156 178.277 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 2.1 m-20 -74.13 -33.09 63.43 Favored 'General case' 0 N--CA 1.481 1.083 0 C-N-CA 123.31 0.644 . . . . 0.0 111.121 -178.909 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 69' ' ' VAL . . . . . 0.416 HG23 ' O ' ' A' ' 65' ' ' ASN . 89.8 t -63.03 -44.06 99.4 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.061 0 C-N-CA 123.367 0.667 . . . . 0.0 109.936 174.393 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -67.04 -5.18 12.01 Favored 'General case' 0 N--CA 1.484 1.268 0 C-N-CA 124.742 1.217 . . . . 0.0 112.709 -176.101 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 85.6 tttt -72.27 -50.68 25.34 Favored 'General case' 0 CA--C 1.545 0.754 0 C-N-CA 122.738 0.415 . . . . 0.0 109.912 173.908 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 14.5 t -91.53 -21.33 20.93 Favored 'General case' 0 N--CA 1.473 0.716 0 C-N-CA 123.374 0.67 . . . . 0.0 110.889 179.56 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -85.44 85.31 7.44 Favored 'General case' 0 C--O 1.241 0.653 0 CA-C-O 121.681 0.753 . . . . 0.0 109.407 178.428 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 74' ' ' ASN . . . . . 0.455 ' O ' ' HG ' ' A' ' 78' ' ' LEU . 28.0 p-10 -74.92 172.83 11.55 Favored 'General case' 0 N--CA 1.474 0.763 0 CA-C-N 114.494 -1.23 . . . . 0.0 109.885 176.854 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . 0.501 ' HA ' HD12 ' A' ' 78' ' ' LEU . 1.9 tpmt? -54.27 -40.73 68.1 Favored 'General case' 0 CA--C 1.552 1.05 0 C-N-CA 123.867 0.867 . . . . 0.0 111.519 -176.056 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 34.8 t70 -64.68 -40.38 95.3 Favored 'General case' 0 N--CA 1.478 0.943 0 C-N-CA 124.293 1.037 . . . . 0.0 112.122 179.457 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 34.5 t60 -59.35 -42.89 92.58 Favored 'General case' 0 N--CA 1.485 1.32 0 C-N-CA 124.076 0.951 . . . . 0.0 110.363 178.974 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . 0.605 HD13 HD12 ' A' ' 44' ' ' ILE . 34.0 mt -60.32 -46.26 90.51 Favored 'General case' 0 C--O 1.218 -0.578 0 CA-C-N 114.296 -1.32 . . . . 0.0 111.377 -176.174 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 79' ' ' VAL . . . . . 0.543 ' HA ' HD13 ' A' ' 34' ' ' LEU . 60.2 t -63.68 -46.84 93.59 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.631 0 O-C-N 124.367 1.042 . . . . 0.0 110.743 -178.728 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 34.5 m -60.05 -50.51 73.44 Favored 'General case' 0 N--CA 1.478 0.94 0 CA-C-N 115.61 -0.723 . . . . 0.0 111.259 179.392 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 81' ' ' ALA . . . . . 0.456 ' HB1' HD11 ' A' ' 62' ' ' LEU . . . -66.4 -43.55 85.51 Favored 'General case' 0 N--CA 1.474 0.747 0 C-N-CA 123.767 0.827 . . . . 0.0 111.31 -177.286 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 82' ' ' TYR . . . . . 0.535 ' OH ' ' HB2' ' A' ' 27' ' ' ARG . 78.6 t80 -58.22 -58.93 6.3 Favored 'General case' 0 N--CA 1.473 0.721 0 C-N-CA 124.024 0.93 . . . . 0.0 110.379 -178.262 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 83' ' ' ASN . . . . . . . . . . . . . 16.6 m-80 -59.47 -39.69 84.51 Favored 'General case' 0 N--CA 1.48 1.063 0 C-N-CA 123.546 0.738 . . . . 0.0 111.011 -175.042 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 3.7 m-70 -65.07 -33.89 77.11 Favored 'General case' 0 N--CA 1.478 0.943 0 C-N-CA 123.765 0.826 . . . . 0.0 112.605 179.969 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 40.6 tp -59.18 -52.1 67.16 Favored 'General case' 0 N--CA 1.479 1.021 0 CA-C-O 121.519 0.676 . . . . 0.0 110.847 -176.811 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 86' ' ' PHE . . . . . 0.431 ' HA ' ' HE2' ' A' ' 91' ' ' PHE . 21.6 m-85 -76.27 -29.47 57.44 Favored 'General case' 0 N--CA 1.473 0.702 0 CA-C-N 114.106 -1.406 . . . . 0.0 111.165 -177.933 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 11.2 tp10 -61.01 -27.65 68.47 Favored 'General case' 0 N--CA 1.48 1.045 0 C-N-CA 124.734 1.214 . . . . 0.0 111.981 -179.905 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 31.5 p -128.46 -4.37 5.4 Favored 'General case' 0 N--CA 1.484 1.231 0 C-N-CA 123.74 0.816 . . . . 0.0 111.613 -177.761 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 44.7 mtmt 58.05 50.15 10.54 Favored 'General case' 0 N--CA 1.485 1.317 0 C-N-CA 124.614 1.166 . . . . 0.0 112.168 178.687 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 99.5 mtt180 -80.93 -5.43 57.45 Favored 'General case' 0 N--CA 1.481 1.077 0 CA-C-N 115.698 -0.683 . . . . 0.0 111.627 178.208 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 91' ' ' PHE . . . . . 0.431 ' HE2' ' HA ' ' A' ' 86' ' ' PHE . 48.9 p90 -71.98 163.61 27.56 Favored 'General case' 0 N--CA 1.474 0.763 0 C-N-CA 123.53 0.732 . . . . 0.0 110.674 167.416 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 92' ' ' LYS . . . . . 0.462 ' HG2' ' O ' ' A' ' 51' ' ' HIS . 32.2 mmmt . . . . . 0 C--O 1.252 1.194 0 C-N-CA 123.466 0.707 . . . . 0.0 110.674 -176.226 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 20' ' ' MET . . . . . . . . . . . . . 77.8 mtp . . . . . 0 N--CA 1.483 1.207 0 N-CA-C 110.168 -0.308 . . . . 0.0 110.168 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -88.18 155.97 19.48 Favored 'General case' 0 C--O 1.244 0.794 0 N-CA-C 109.303 -0.628 . . . . 0.0 109.303 169.481 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -71.5 114.66 9.81 Favored 'General case' 0 N--CA 1.47 0.574 0 C-N-CA 123.42 0.688 . . . . 0.0 109.904 178.851 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -75.7 78.36 2.67 Favored 'General case' 0 N--CA 1.471 0.621 0 C-N-CA 123.215 0.606 . . . . 0.0 109.513 174.426 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 6.1 m -117.58 79.85 12.85 Favored Pre-proline 0 CA--C 1.551 0.993 0 C-N-CA 124.239 1.015 . . . . 0.0 109.404 -176.811 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 61.3 Cg_endo -68.92 117.09 4.81 Favored 'Trans proline' 0 C--N 1.375 1.924 0 C-N-CA 122.993 2.462 . . . . 0.0 112.521 -173.602 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 88.0 mt-30 -78.73 154.09 30.33 Favored 'General case' 0 C--O 1.248 0.986 0 N-CA-C 108.144 -1.058 . . . . 0.0 108.144 170.352 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -59.47 141.08 55.52 Favored 'General case' 0 CA--C 1.542 0.664 0 O-C-N 123.508 0.505 . . . . 0.0 111.177 178.604 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -85.1 -42.4 14.83 Favored 'General case' 0 N--CA 1.474 0.753 0 C-N-CA 123.5 0.72 . . . . 0.0 109.423 178.197 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 29' ' ' TRP . . . . . . . . . . . . . 6.6 m-90 -123.48 153.7 40.14 Favored 'General case' 0 N--CA 1.476 0.835 0 C-N-CA 124.571 1.148 . . . . 0.0 108.935 177.966 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 30' ' ' THR . . . . . 0.426 ' O ' ' HG ' ' A' ' 34' ' ' LEU . 55.9 p -87.49 170.59 11.21 Favored 'General case' 0 N--CA 1.475 0.812 0 C-N-CA 123.007 0.523 . . . . 0.0 110.095 -178.92 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 8.1 p -56.13 -46.23 80.98 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.312 0 C-N-CA 123.909 0.884 . . . . 0.0 113.206 -168.435 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 1.2 pm0 -75.77 -29.85 58.93 Favored 'General case' 0 N--CA 1.48 1.035 0 C-N-CA 123.615 0.766 . . . . 0.0 111.416 178.553 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 43.1 mt-30 -62.63 -29.04 70.33 Favored 'General case' 0 N--CA 1.491 1.605 0 CA-C-N 118.227 0.467 . . . . 0.0 110.705 172.538 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.43 ' HA ' HD23 ' A' ' 39' ' ' LEU . 42.1 mt -72.85 -39.61 66.38 Favored 'General case' 0 N--CA 1.472 0.662 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.49 174.798 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 47.5 mtm105 -71.68 -20.23 61.96 Favored 'General case' 0 N--CA 1.478 0.945 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.967 176.444 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 46.9 t -64.23 123.25 18.63 Favored 'General case' 0 C--O 1.238 0.494 0 C-N-CA 123.455 0.702 . . . . 0.0 110.334 179.819 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 33.4 mt-10 -62.58 -19.22 63.48 Favored 'General case' 0 CA--C 1.547 0.836 0 C-N-CA 124.484 1.114 . . . . 0.0 111.512 178.909 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 82.9 mt-30 -61.8 -50.29 72.91 Favored 'General case' 0 N--CA 1.472 0.633 0 C-N-CA 124.37 1.068 . . . . 0.0 110.341 176.487 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.43 HD23 ' HA ' ' A' ' 34' ' ' LEU . 62.1 tp -72.62 123.67 89.83 Favored Pre-proline 0 CA--C 1.55 0.948 0 CA-C-N 115.396 -0.82 . . . . 0.0 109.783 -178.917 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 39.9 Cg_exo -61.7 149.43 89.97 Favored 'Trans proline' 0 C--N 1.378 2.095 0 C-N-CA 123.157 2.571 . . . . 0.0 113.532 175.105 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . 0.633 ' HG2' ' HD3' ' A' ' 75' ' ' LYS . 42.4 mtpt -67.01 -43.51 82.68 Favored 'General case' 0 N--CA 1.477 0.897 0 C-N-CA 124.321 1.048 . . . . 0.0 110.211 179.05 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 11.9 ptmm? -56.18 -36.63 68.57 Favored 'General case' 0 N--CA 1.476 0.859 0 C-N-CA 125.193 1.397 . . . . 0.0 112.864 179.458 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -64.87 -41.08 95.94 Favored 'General case' 0 N--CA 1.476 0.871 0 O-C-N 123.753 0.658 . . . . 0.0 111.281 179.888 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 43.8 mt -67.35 -48.23 78.46 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.961 0 C-N-CA 122.927 0.491 . . . . 0.0 110.085 179.206 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 82.1 mt -59.5 -43.96 91.86 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.05 0 CA-C-N 115.529 -0.76 . . . . 0.0 110.795 -179.875 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 88.3 tttt -63.81 -37.61 88.03 Favored 'General case' 0 N--CA 1.476 0.864 0 O-C-N 123.972 0.795 . . . . 0.0 111.159 -179.859 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 37.8 t80 -63.51 -54.03 42.76 Favored 'General case' 0 N--CA 1.477 0.901 0 CA-C-N 115.266 -0.879 . . . . 0.0 110.638 176.185 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 86.6 mt -68.65 -30.74 69.5 Favored 'General case' 0 N--CA 1.478 0.94 0 C-N-CA 123.642 0.777 . . . . 0.0 111.892 -173.108 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . 0.578 ' HA ' HD21 ' A' ' 57' ' ' LEU . 3.5 pt20 -81.62 -26.6 34.72 Favored 'General case' 0 N--CA 1.483 1.185 0 N-CA-C 111.62 0.23 . . . . 0.0 111.62 -179.085 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 12.1 tp10 -62.07 -38.7 89.8 Favored 'General case' 0 N--CA 1.479 1.014 0 C-N-CA 123.7 0.8 . . . . 0.0 111.815 -179.118 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 16.5 p80 -122.09 -25.67 4.88 Favored 'General case' 0 N--CA 1.493 1.71 0 N-CA-C 112.814 0.672 . . . . 0.0 112.814 -175.832 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . 0.493 ' HA2' ' HA ' ' A' ' 91' ' ' PHE . . . -61.54 139.58 47.12 Favored Glycine 0 C--N 1.347 1.145 0 CA-C-O 119.628 -0.54 . . . . 0.0 112.374 173.761 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . 0.476 ' O ' ' HG ' ' A' ' 57' ' ' LEU . 28.7 t -63.57 151.88 40.26 Favored 'General case' 0 N--CA 1.481 1.084 0 C-N-CA 123.523 0.729 . . . . 0.0 111.476 -179.008 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 26.9 t70 -55.45 -37.04 67.2 Favored 'General case' 0 N--CA 1.483 1.189 0 O-C-N 124.309 1.006 . . . . 0.0 111.727 178.046 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 46.0 m -66.13 -42.19 89.45 Favored 'General case' 0 CA--C 1.543 0.71 0 O-C-N 123.84 0.712 . . . . 0.0 111.142 177.312 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 56' ' ' PHE . . . . . 0.43 ' HB2' ' HB3' ' A' ' 90' ' ' ARG . 27.6 t80 -60.57 -41.86 95.48 Favored 'General case' 0 N--CA 1.482 1.174 0 C-N-CA 123.714 0.805 . . . . 0.0 110.365 174.497 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . 0.578 HD21 ' HA ' ' A' ' 49' ' ' GLN . 65.0 mt -69.95 -37.73 75.92 Favored 'General case' 0 N--CA 1.47 0.539 0 CA-C-N 115.514 -0.767 . . . . 0.0 111.079 -176.815 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -67.38 -49.2 64.91 Favored 'General case' 0 N--CA 1.482 1.142 0 C-N-CA 123.332 0.653 . . . . 0.0 110.865 -179.74 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 47.1 mt-10 -59.87 -32.04 70.34 Favored 'General case' 0 N--CA 1.477 0.885 0 CA-C-N 115.318 -0.855 . . . . 0.0 111.96 178.183 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 41.1 m80 -116.13 14.39 15.95 Favored 'General case' 0 N--CA 1.485 1.278 0 N-CA-C 112.881 0.697 . . . . 0.0 112.881 -174.805 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 57.6 mttp 57.07 20.6 5.62 Favored 'General case' 0 N--CA 1.498 1.962 0 N-CA-C 114.167 1.173 . . . . 0.0 114.167 172.995 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 94.9 mt -83.64 -10.7 58.04 Favored 'General case' 0 N--CA 1.482 1.172 0 C-N-CA 122.822 0.449 . . . . 0.0 111.951 -174.847 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 2.5 pp -81.96 176.33 9.64 Favored 'General case' 0 N--CA 1.481 1.112 0 CA-C-O 121.31 0.576 . . . . 0.0 111.144 175.481 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 90.17 -148.9 19.97 Favored Glycine 0 C--N 1.336 0.583 0 CA-C-N 114.686 -1.143 . . . . 0.0 111.823 177.973 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 9.8 m120 -77.03 119.77 21.22 Favored 'General case' 0 N--CA 1.468 0.441 0 N-CA-C 108.68 -0.859 . . . . 0.0 108.68 176.283 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 64.1 mt -54.08 -48.06 65.49 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.051 0 C-N-CA 123.709 0.804 . . . . 0.0 110.157 178.698 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 61.3 pttt -54.12 -38.75 65.75 Favored 'General case' 0 N--CA 1.485 1.293 0 C-N-CA 124.022 0.929 . . . . 0.0 112.461 178.563 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 8.1 t30 -68.32 -45.64 72.41 Favored 'General case' 0 N--CA 1.478 0.941 0 C-N-CA 123.319 0.647 . . . . 0.0 110.692 179.524 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 69' ' ' VAL . . . . . 0.445 ' HA ' HG22 ' A' ' 72' ' ' THR . 44.9 t -71.94 -31.88 42.22 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.974 0 CA-C-N 115.58 -0.737 . . . . 0.0 110.714 -178.075 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -73.09 -14.94 61.49 Favored 'General case' 0 N--CA 1.479 1.007 0 C-N-CA 123.697 0.799 . . . . 0.0 112.212 -177.413 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 16.8 ptpt -99.3 -48.78 4.69 Favored 'General case' 0 CA--C 1.547 0.851 0 CA-C-N 118.11 0.414 . . . . 0.0 111.41 170.605 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 72' ' ' THR . . . . . 0.445 HG22 ' HA ' ' A' ' 69' ' ' VAL . 7.6 t -73.39 -35.34 65.89 Favored 'General case' 0 N--CA 1.487 1.419 0 C-N-CA 122.937 0.495 . . . . 0.0 112.027 -171.157 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -100.92 130.55 46.94 Favored 'General case' 0 N--CA 1.472 0.669 0 C-N-CA 123.699 0.799 . . . . 0.0 109.425 177.485 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 74' ' ' ASN . . . . . 0.401 ' O ' ' HG ' ' A' ' 78' ' ' LEU . 29.1 p-10 -82.98 173.81 11.46 Favored 'General case' 0 N--CA 1.484 1.27 0 C-N-CA 123.491 0.716 . . . . 0.0 111.216 -174.45 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . 0.633 ' HD3' ' HG2' ' A' ' 41' ' ' LYS . 15.7 tptm -64.25 -39.8 94.7 Favored 'General case' 0 N--CA 1.477 0.898 0 C-N-CA 123.676 0.79 . . . . 0.0 111.176 -174.403 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 22.3 t70 -64.41 -38.41 90.93 Favored 'General case' 0 N--CA 1.482 1.142 0 C-N-CA 124.009 0.924 . . . . 0.0 111.053 -177.212 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 77' ' ' HIS . . . . . 0.424 ' HD2' HD23 ' A' ' 78' ' ' LEU . 33.0 t60 -55.39 -43.58 75.31 Favored 'General case' 0 N--CA 1.481 1.076 0 C-N-CA 124.696 1.198 . . . . 0.0 110.56 173.902 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . 0.424 HD23 ' HD2' ' A' ' 77' ' ' HIS . 25.5 mt -67.74 -40.26 84.15 Favored 'General case' 0 N--CA 1.477 0.894 0 C-N-CA 123.882 0.873 . . . . 0.0 111.103 -175.663 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 79' ' ' VAL . . . . . 0.414 HG23 ' O ' ' A' ' 75' ' ' LYS . 45.2 t -66.55 -45.01 89.79 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.821 0 C-N-CA 123.801 0.841 . . . . 0.0 110.118 179.276 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 33.1 m -60.72 -42.91 98.23 Favored 'General case' 0 N--CA 1.482 1.171 0 C-N-CA 123.599 0.76 . . . . 0.0 111.117 179.08 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -66.87 -39.9 87.69 Favored 'General case' 0 N--CA 1.476 0.868 0 C-N-CA 123.705 0.802 . . . . 0.0 110.992 178.87 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 82' ' ' TYR . . . . . 0.444 ' O ' ' HB3' ' A' ' 85' ' ' LEU . 5.5 t80 -56.67 -55.64 31.47 Favored 'General case' 0 C--O 1.218 -0.557 0 C-N-CA 124.663 1.185 . . . . 0.0 110.908 177.035 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 83' ' ' ASN . . . . . . . . . . . . . 59.7 m-80 -67.33 -40.51 85.91 Favored 'General case' 0 N--CA 1.486 1.352 0 C-N-CA 122.52 0.328 . . . . 0.0 111.143 -174.58 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 55.4 m170 -66.51 -24.3 66.37 Favored 'General case' 0 N--CA 1.483 1.222 0 C-N-CA 123.771 0.829 . . . . 0.0 111.612 177.415 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 85' ' ' LEU . . . . . 0.444 ' HB3' ' O ' ' A' ' 82' ' ' TYR . 53.9 tp -59.3 -54.73 43.44 Favored 'General case' 0 N--CA 1.479 0.982 0 CA-C-O 121.327 0.584 . . . . 0.0 110.822 175.16 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 45.0 m-85 -73.77 -30.4 62.75 Favored 'General case' 0 N--CA 1.475 0.777 0 CA-C-N 114.515 -1.22 . . . . 0.0 110.798 -176.627 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 44.3 tt0 -65.29 -24.6 67.34 Favored 'General case' 0 N--CA 1.482 1.137 0 C-N-CA 124.076 0.95 . . . . 0.0 112.48 -175.95 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 10.1 p -125.16 -4.2 7.44 Favored 'General case' 0 N--CA 1.478 0.949 0 C-N-CA 123.731 0.812 . . . . 0.0 110.921 177.765 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 94.3 mttt 56.23 49.75 14.73 Favored 'General case' 0 N--CA 1.485 1.293 0 C-N-CA 124.364 1.066 . . . . 0.0 111.48 -175.806 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 90' ' ' ARG . . . . . 0.43 ' HB3' ' HB2' ' A' ' 56' ' ' PHE . 54.4 mtt85 -68.95 -13.27 62.34 Favored 'General case' 0 N--CA 1.488 1.44 0 C-N-CA 124.791 1.237 . . . . 0.0 112.891 178.018 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 91' ' ' PHE . . . . . 0.493 ' HA ' ' HA2' ' A' ' 52' ' ' GLY . 4.2 p90 -68.14 139.96 56.16 Favored 'General case' 0 N--CA 1.475 0.816 0 C-N-CA 122.442 0.297 . . . . 0.0 110.787 175.295 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 C--O 1.256 1.406 0 C-N-CA 124.441 1.097 . . . . 0.0 108.286 172.357 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 20' ' ' MET . . . . . . . . . . . . . 25.6 ttt . . . . . 0 N--CA 1.476 0.865 0 N-CA-C 109.263 -0.643 . . . . 0.0 109.263 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -127.64 156.49 42.23 Favored 'General case' 0 N--CA 1.47 0.542 0 C-N-CA 123.549 0.74 . . . . 0.0 110.308 -178.643 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -136.94 178.0 7.42 Favored 'General case' 0 C--O 1.241 0.615 0 C-N-CA 124.052 0.941 . . . . 0.0 109.31 178.976 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -158.97 135.67 9.44 Favored 'General case' 0 C--O 1.24 0.605 0 C-N-CA 123.855 0.862 . . . . 0.0 109.325 -179.656 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . 0.415 ' HA ' ' HD3' ' A' ' 25' ' ' PRO . 30.8 m -76.29 131.78 74.43 Favored Pre-proline 0 CA--C 1.55 0.955 0 N-CA-C 109.245 -0.65 . . . . 0.0 109.245 172.424 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 25' ' ' PRO . . . . . 0.415 ' HD3' ' HA ' ' A' ' 24' ' ' VAL . 18.7 Cg_exo -65.09 113.71 2.51 Favored 'Trans proline' 0 C--N 1.376 2.022 0 C-N-CA 123.0 2.467 . . . . 0.0 109.946 178.355 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 76.2 mm-40 -62.21 96.48 0.07 Allowed 'General case' 0 C--O 1.241 0.654 0 N-CA-C 108.061 -1.088 . . . . 0.0 108.061 178.094 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 27.7 ptt180 -61.91 130.51 45.97 Favored 'General case' 0 CA--C 1.543 0.683 0 CA-C-N 114.149 -1.387 . . . . 0.0 110.457 -164.14 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -74.84 -22.38 58.72 Favored 'General case' 0 CA--C 1.54 0.575 0 CA-C-N 114.912 -1.04 . . . . 0.0 112.668 -167.047 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 29' ' ' TRP . . . . . 0.421 ' HB3' ' HB2' ' A' ' 33' ' ' GLN . 3.9 m-90 -138.89 150.71 46.27 Favored 'General case' 0 N--CA 1.478 0.945 0 C-N-CA 123.829 0.852 . . . . 0.0 110.902 -168.529 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 37.7 p -90.4 173.78 7.92 Favored 'General case' 0 N--CA 1.471 0.593 0 CA-C-N 115.37 -0.832 . . . . 0.0 109.05 170.404 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . 0.524 ' HA ' HD12 ' A' ' 34' ' ' LEU . 10.5 p -59.29 -34.3 53.57 Favored 'Isoleucine or valine' 0 CA--C 1.557 1.248 0 C-N-CA 123.741 0.816 . . . . 0.0 112.362 -174.689 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 12.5 pt-20 -70.48 -35.67 73.41 Favored 'General case' 0 N--CA 1.481 1.098 0 C-N-CA 123.589 0.756 . . . . 0.0 111.028 176.816 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 33' ' ' GLN . . . . . 0.421 ' HB2' ' HB3' ' A' ' 29' ' ' TRP . 22.5 mm-40 -72.64 -30.4 64.27 Favored 'General case' 0 CA--C 1.546 0.803 0 C-N-CA 123.103 0.561 . . . . 0.0 110.798 176.184 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.54 ' HB3' HG22 ' A' ' 79' ' ' VAL . 93.1 mt -72.27 -37.78 68.98 Favored 'General case' 0 N--CA 1.476 0.839 0 C-N-CA 123.674 0.79 . . . . 0.0 112.287 -179.0 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 12.0 ptt180 -76.43 -22.56 54.5 Favored 'General case' 0 N--CA 1.479 1.019 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.275 176.508 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 41.5 t -58.39 109.91 0.87 Allowed 'General case' 0 C--N 1.356 0.859 0 O-C-N 124.017 0.823 . . . . 0.0 111.829 -173.593 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 9.9 pt-20 -62.27 -21.08 64.93 Favored 'General case' 0 N--CA 1.484 1.261 0 C-N-CA 124.771 1.228 . . . . 0.0 112.541 179.453 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 12.0 mm100 -67.85 -32.82 73.61 Favored 'General case' 0 N--CA 1.473 0.715 0 C-N-CA 123.941 0.896 . . . . 0.0 110.356 176.437 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 3.5 tt -73.38 127.59 88.71 Favored Pre-proline 0 CA--C 1.547 0.861 0 N-CA-C 108.024 -1.102 . . . . 0.0 108.024 175.866 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 53.0 Cg_exo -55.41 126.35 22.21 Favored 'Trans proline' 0 C--N 1.378 2.088 0 C-N-CA 122.546 2.164 . . . . 0.0 112.365 174.015 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . 0.756 ' HG2' ' HD3' ' A' ' 75' ' ' LYS . 35.9 mtmm -58.08 -37.78 75.13 Favored 'General case' 0 N--CA 1.48 1.069 0 C-N-CA 124.348 1.059 . . . . 0.0 110.483 177.58 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 18.8 ptpt -62.19 -35.9 80.25 Favored 'General case' 0 N--CA 1.472 0.626 0 CA-C-N 114.777 -1.101 . . . . 0.0 111.9 175.498 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 30.2 t70 -69.82 -32.72 71.3 Favored 'General case' 0 CA--C 1.545 0.757 0 C-N-CA 122.444 0.298 . . . . 0.0 110.82 -174.338 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 56.2 mt -66.57 -52.4 46.45 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.148 0 N-CA-C 109.575 -0.528 . . . . 0.0 109.575 174.217 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 45' ' ' ILE . . . . . 0.48 HD13 HG12 ' A' ' 69' ' ' VAL . 76.4 mt -58.49 -33.38 48.0 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.333 0 C-N-CA 124.451 1.1 . . . . 0.0 111.654 178.95 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 33.0 ttmt -61.68 -41.94 98.24 Favored 'General case' 0 N--CA 1.48 1.028 0 C-N-CA 124.394 1.078 . . . . 0.0 110.796 179.233 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 2.0 t80 -70.89 -37.66 73.01 Favored 'General case' 0 CA--C 1.548 0.884 0 CA-C-N 114.488 -1.233 . . . . 0.0 109.858 177.698 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . 0.483 HD21 ' HA ' ' A' ' 82' ' ' TYR . 93.1 mt -68.89 -31.84 71.05 Favored 'General case' 0 N--CA 1.476 0.862 0 C-N-CA 123.481 0.712 . . . . 0.0 112.488 -178.73 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . 0.568 ' HA ' HD21 ' A' ' 57' ' ' LEU . 3.8 pt20 -85.07 -28.03 25.91 Favored 'General case' 0 N--CA 1.479 1.012 0 C-N-CA 122.103 0.161 . . . . 0.0 111.393 176.081 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 42.7 tt0 -61.22 -35.17 76.48 Favored 'General case' 0 N--CA 1.479 1.007 0 O-C-N 123.767 0.667 . . . . 0.0 111.26 -178.176 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 59.7 m-70 -112.86 -44.68 3.27 Favored 'General case' 0 N--CA 1.469 0.524 0 CA-C-N 115.798 -0.637 . . . . 0.0 110.022 -179.066 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . 0.422 ' HA2' ' HA ' ' A' ' 91' ' ' PHE . . . -57.07 131.28 51.97 Favored Glycine 0 C--N 1.354 1.564 0 O-C-N 123.912 0.757 . . . . 0.0 114.318 -175.328 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 44.1 m -72.58 166.12 23.34 Favored 'General case' 0 CA--C 1.54 0.57 0 C-N-CA 124.07 0.948 . . . . 0.0 111.736 -177.159 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 23.3 t70 -54.17 -38.77 65.93 Favored 'General case' 0 N--CA 1.481 1.083 0 CA-C-N 115.001 -0.999 . . . . 0.0 112.574 -175.233 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 20.2 t -67.05 -37.98 85.04 Favored 'General case' 0 CA--C 1.55 0.966 0 O-C-N 123.55 0.531 . . . . 0.0 111.098 -179.532 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 56' ' ' PHE . . . . . 0.501 ' HD1' HH11 ' A' ' 90' ' ' ARG . 53.4 t80 -67.02 -41.04 87.3 Favored 'General case' 0 N--CA 1.486 1.332 0 C-N-CA 123.632 0.773 . . . . 0.0 110.109 176.049 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . 0.568 HD21 ' HA ' ' A' ' 49' ' ' GLN . 39.0 mt -69.56 -55.25 10.68 Favored 'General case' 0 N--CA 1.471 0.595 0 CA-C-N 115.829 -0.623 . . . . 0.0 110.666 -175.802 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -61.55 -29.1 69.79 Favored 'General case' 0 N--CA 1.487 1.386 0 C-N-CA 124.394 1.078 . . . . 0.0 112.742 -174.109 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 50.6 mt-10 -54.39 -45.64 72.94 Favored 'General case' 0 N--CA 1.484 1.246 0 C-N-CA 122.798 0.439 . . . . 0.0 111.497 174.508 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 37.5 t-80 -114.07 4.14 15.54 Favored 'General case' 0 N--CA 1.48 1.042 0 C-N-CA 122.845 0.458 . . . . 0.0 111.345 -176.104 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 32.5 mmtp 49.29 60.5 3.72 Favored 'General case' 0 N--CA 1.476 0.831 0 C-N-CA 124.672 1.189 . . . . 0.0 111.301 -171.867 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 0.52 ' HA ' HG11 ' A' ' 69' ' ' VAL . 95.2 mt -85.17 -14.77 45.89 Favored 'General case' 0 N--CA 1.481 1.11 0 CA-C-N 115.013 -0.994 . . . . 0.0 110.214 174.417 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 1.1 pp -76.66 171.11 15.22 Favored 'General case' 0 CA--C 1.545 0.769 0 C-N-CA 124.098 0.959 . . . . 0.0 110.739 173.556 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 88.4 -146.62 19.62 Favored Glycine 0 C--N 1.341 0.821 0 CA-C-N 115.61 -0.723 . . . . 0.0 111.921 -179.922 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 65' ' ' ASN . . . . . 0.414 ' O ' HG23 ' A' ' 69' ' ' VAL . 38.8 m-80 -72.73 113.12 9.41 Favored 'General case' 0 N--CA 1.478 0.947 0 N-CA-C 108.578 -0.897 . . . . 0.0 108.578 175.228 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 17.9 mt -55.9 -39.63 57.98 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.208 0 O-C-N 124.266 0.979 . . . . 0.0 110.335 -177.5 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 60.9 pttt -60.9 -39.76 90.54 Favored 'General case' 0 N--CA 1.478 0.961 0 C-N-CA 124.928 1.291 . . . . 0.0 112.246 178.302 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 28.3 t-20 -73.86 -36.47 64.86 Favored 'General case' 0 N--CA 1.477 0.899 0 C-N-CA 123.704 0.802 . . . . 0.0 109.984 -177.061 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 69' ' ' VAL . . . . . 0.52 HG11 ' HA ' ' A' ' 62' ' ' LEU . 58.7 t -63.53 -45.55 97.46 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.622 0 CA-C-N 114.984 -1.007 . . . . 0.0 109.522 172.17 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -67.59 -17.95 64.81 Favored 'General case' 0 N--CA 1.477 0.925 0 C-N-CA 124.582 1.153 . . . . 0.0 112.363 -177.068 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 25.3 ttpp -76.43 -43.66 39.19 Favored 'General case' 0 CA--C 1.539 0.55 0 C-N-CA 123.122 0.569 . . . . 0.0 110.469 175.524 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 15.1 t -99.94 -9.6 22.61 Favored 'General case' 0 CA--C 1.558 1.286 0 C-N-CA 123.848 0.859 . . . . 0.0 113.092 -171.304 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -87.79 160.02 18.2 Favored 'General case' 0 N--CA 1.484 1.25 0 C-N-CA 123.257 0.623 . . . . 0.0 110.553 179.544 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 50.4 t30 -110.16 129.99 55.62 Favored 'General case' 0 N--CA 1.48 1.066 0 C-N-CA 124.3 1.04 . . . . 0.0 109.321 -175.822 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . 0.756 ' HD3' ' HG2' ' A' ' 41' ' ' LYS . 22.7 tptp -59.48 -40.23 86.29 Favored 'General case' 0 N--CA 1.492 1.652 0 C-N-CA 123.977 0.911 . . . . 0.0 112.165 -169.932 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 3.5 p30 -74.74 -29.02 61.02 Favored 'General case' 0 N--CA 1.484 1.257 0 O-C-N 123.227 0.329 . . . . 0.0 111.05 -177.347 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 27.7 t60 -73.47 -28.74 62.11 Favored 'General case' 0 CA--C 1.549 0.935 0 C-N-CA 123.005 0.522 . . . . 0.0 110.062 173.341 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 83.1 mt -65.47 -32.84 74.67 Favored 'General case' 0 N--CA 1.49 1.547 0 C-N-CA 122.918 0.487 . . . . 0.0 110.596 175.147 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 79' ' ' VAL . . . . . 0.54 HG22 ' HB3' ' A' ' 34' ' ' LEU . 40.8 t -62.18 -47.94 90.75 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.139 0 C-N-CA 124.193 0.997 . . . . 0.0 109.658 172.718 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 16.0 m -64.53 -48.13 76.22 Favored 'General case' 0 N--CA 1.47 0.548 0 CA-C-N 114.176 -1.374 . . . . 0.0 111.841 -175.785 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -67.55 -34.02 76.22 Favored 'General case' 0 N--CA 1.477 0.923 0 C-N-CA 123.766 0.826 . . . . 0.0 111.176 -177.601 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 82' ' ' TYR . . . . . 0.483 ' HA ' HD21 ' A' ' 48' ' ' LEU . 81.4 t80 -60.19 -54.95 39.72 Favored 'General case' 0 N--CA 1.469 0.519 0 C-N-CA 124.487 1.115 . . . . 0.0 110.669 177.788 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 83' ' ' ASN . . . . . . . . . . . . . 90.6 m-20 -69.77 -31.11 68.88 Favored 'General case' 0 CA--C 1.54 0.565 0 CA-C-N 114.847 -1.069 . . . . 0.0 110.574 -178.021 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 2.8 m-70 -70.32 -28.44 65.16 Favored 'General case' 0 N--CA 1.485 1.282 0 C-N-CA 123.576 0.75 . . . . 0.0 111.607 174.734 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 44.9 tp -60.29 -53.26 59.72 Favored 'General case' 0 N--CA 1.478 0.968 0 CA-C-O 121.739 0.781 . . . . 0.0 109.911 -178.724 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 86' ' ' PHE . . . . . 0.46 ' HA ' ' HE2' ' A' ' 91' ' ' PHE . 6.3 m-85 -75.48 -31.4 60.22 Favored 'General case' 0 CA--C 1.549 0.935 0 CA-C-N 113.771 -1.559 . . . . 0.0 111.079 -175.42 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 10.4 tp10 -69.16 -40.49 78.15 Favored 'General case' 0 N--CA 1.482 1.158 0 C-N-CA 124.103 0.961 . . . . 0.0 111.719 -173.436 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 37.0 p -109.56 2.8 20.61 Favored 'General case' 0 N--CA 1.484 1.256 0 C-N-CA 123.28 0.632 . . . . 0.0 111.689 -178.622 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 89' ' ' LYS . . . . . 0.453 ' HA ' ' CE2' ' A' ' 91' ' ' PHE . 48.7 mtpt 59.34 44.7 14.94 Favored 'General case' 0 N--CA 1.478 0.949 0 C-N-CA 124.391 1.076 . . . . 0.0 112.225 179.843 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 90' ' ' ARG . . . . . 0.501 HH11 ' HD1' ' A' ' 56' ' ' PHE . 20.5 mtt180 -67.94 -7.39 28.16 Favored 'General case' 0 N--CA 1.486 1.355 0 C-N-CA 124.426 1.09 . . . . 0.0 113.266 178.547 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 91' ' ' PHE . . . . . 0.46 ' HE2' ' HA ' ' A' ' 86' ' ' PHE . 36.7 p90 -77.67 161.91 27.41 Favored 'General case' 0 CA--C 1.541 0.603 0 C-N-CA 124.118 0.967 . . . . 0.0 111.651 171.622 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 61.7 tttm . . . . . 0 C--O 1.25 1.112 0 C-N-CA 124.177 0.991 . . . . 0.0 109.581 178.178 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 20' ' ' MET . . . . . . . . . . . . . 26.6 ptt? . . . . . 0 N--CA 1.486 1.367 0 CA-C-O 120.969 0.414 . . . . 0.0 110.958 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -128.35 141.92 51.28 Favored 'General case' 0 N--CA 1.476 0.851 0 N-CA-C 108.463 -0.94 . . . . 0.0 108.463 172.3 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -76.39 80.15 3.12 Favored 'General case' 0 C--O 1.243 0.719 0 CA-C-O 121.168 0.509 . . . . 0.0 109.664 177.721 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -80.05 76.05 6.79 Favored 'General case' 0 C--O 1.24 0.563 0 CA-C-N 115.446 -0.797 . . . . 0.0 109.098 179.987 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 29.3 m -73.49 149.59 88.75 Favored Pre-proline 0 CA--C 1.543 0.698 0 CA-C-N 114.924 -1.035 . . . . 0.0 109.866 -175.771 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 25' ' ' PRO . . . . . 0.571 ' HG3' ' HB3' ' A' ' 51' ' ' HIS . 9.2 Cg_exo -67.01 102.84 0.68 Allowed 'Trans proline' 0 C--N 1.377 2.034 0 C-N-CA 122.794 2.33 . . . . 0.0 112.024 -171.313 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 15.2 mm-40 -71.92 104.44 3.5 Favored 'General case' 0 C--O 1.241 0.621 0 N-CA-C 106.642 -1.614 . . . . 0.0 106.642 172.621 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 9.8 ptp85 -55.16 141.35 35.27 Favored 'General case' 0 CA--C 1.544 0.75 0 O-C-N 123.79 0.682 . . . . 0.0 111.132 -174.855 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -95.78 -15.85 22.29 Favored 'General case' 0 N--CA 1.476 0.871 0 C-N-CA 123.185 0.594 . . . . 0.0 110.936 -176.237 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 29' ' ' TRP . . . . . . . . . . . . . 8.5 m-90 -142.94 157.78 44.24 Favored 'General case' 0 N--CA 1.482 1.155 0 C-N-CA 123.983 0.913 . . . . 0.0 109.879 -174.623 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 11.9 m -82.49 161.71 22.29 Favored 'General case' 0 CA--C 1.549 0.928 0 N-CA-C 108.065 -1.087 . . . . 0.0 108.065 168.495 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . 0.553 ' HA ' HD12 ' A' ' 34' ' ' LEU . 4.6 p -52.92 -39.64 32.91 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.399 0 C-N-CA 123.924 0.89 . . . . 0.0 111.796 -179.757 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 11.4 pt-20 -66.39 -43.21 86.49 Favored 'General case' 0 N--CA 1.479 1.022 0 C-N-CA 124.716 1.206 . . . . 0.0 111.263 177.483 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 48.1 mt-30 -64.7 -32.68 74.46 Favored 'General case' 0 N--CA 1.477 0.923 0 C-N-CA 123.525 0.73 . . . . 0.0 110.935 -179.038 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.553 HD12 ' HA ' ' A' ' 31' ' ' VAL . 51.6 mt -66.36 -50.35 63.83 Favored 'General case' 0 N--CA 1.47 0.548 0 O-C-N 124.112 0.883 . . . . 0.0 110.965 176.012 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 29.8 mtp180 -68.72 -18.99 64.34 Favored 'General case' 0 N--CA 1.475 0.795 0 C-N-CA 124.38 1.072 . . . . 0.0 111.665 -178.139 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 46.6 t -60.34 123.85 18.52 Favored 'General case' 0 CA--C 1.544 0.742 0 O-C-N 123.657 0.598 . . . . 0.0 110.251 176.162 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -55.53 -28.94 57.76 Favored 'General case' 0 CA--C 1.549 0.935 0 C-N-CA 125.057 1.343 . . . . 0.0 112.981 -177.056 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 91.3 mt-30 -65.17 -34.97 79.66 Favored 'General case' 0 N--CA 1.48 1.041 0 C-N-CA 123.927 0.891 . . . . 0.0 112.362 -177.774 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.432 HD23 ' HD2' ' A' ' 40' ' ' PRO . 1.2 tt -69.2 123.09 87.53 Favored Pre-proline 0 N--CA 1.488 1.433 0 N-CA-C 109.154 -0.684 . . . . 0.0 109.154 -178.904 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 40' ' ' PRO . . . . . 0.468 ' HB2' ' HG2' ' A' ' 42' ' ' LYS . 35.1 Cg_endo -62.82 128.95 24.57 Favored 'Trans proline' 0 C--N 1.37 1.709 0 C-N-CA 122.149 1.899 . . . . 0.0 112.02 173.278 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 35.9 mtmm -56.71 -36.7 69.98 Favored 'General case' 0 N--CA 1.483 1.186 0 C-N-CA 123.922 0.889 . . . . 0.0 111.671 178.603 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . 0.468 ' HG2' ' HB2' ' A' ' 40' ' ' PRO . 19.2 ptpt -58.9 -34.39 71.62 Favored 'General case' 0 N--CA 1.474 0.772 0 C-N-CA 124.015 0.926 . . . . 0.0 111.6 -177.856 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 3.4 t70 -73.47 -36.22 65.81 Favored 'General case' 0 CA--C 1.54 0.594 0 CA-C-N 115.457 -0.792 . . . . 0.0 109.707 -176.415 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 44' ' ' ILE . . . . . 0.437 ' HB ' HD13 ' A' ' 78' ' ' LEU . 38.1 mt -68.61 -46.79 79.4 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.927 0 CA-C-N 115.742 -0.663 . . . . 0.0 110.023 177.702 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 74.7 mt -55.52 -42.82 69.92 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.593 0 C-N-CA 123.754 0.821 . . . . 0.0 110.495 174.88 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 38.2 ttpt -59.24 -36.43 75.44 Favored 'General case' 0 CA--C 1.55 0.945 0 C-N-CA 124.516 1.126 . . . . 0.0 111.178 179.154 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 18.7 t80 -69.69 -47.72 62.2 Favored 'General case' 0 N--CA 1.48 1.057 0 CA-C-N 115.634 -0.712 . . . . 0.0 111.027 176.272 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 90.5 mt -71.82 -32.79 67.92 Favored 'General case' 0 N--CA 1.476 0.851 0 C-N-CA 123.935 0.894 . . . . 0.0 112.885 -171.588 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . 0.446 ' HA ' HD21 ' A' ' 57' ' ' LEU . 3.5 pt20 -82.44 -27.95 31.61 Favored 'General case' 0 N--CA 1.484 1.264 0 CA-C-N 117.747 0.249 . . . . 0.0 111.231 -179.989 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 9.9 tp10 -69.69 -33.66 72.86 Favored 'General case' 0 N--CA 1.475 0.79 0 C-N-CA 123.353 0.661 . . . . 0.0 110.797 -179.402 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 51' ' ' HIS . . . . . 0.571 ' HB3' ' HG3' ' A' ' 25' ' ' PRO . 66.2 m80 -112.06 -43.15 3.61 Favored 'General case' 0 N--CA 1.474 0.756 0 CA-C-N 115.309 -0.86 . . . . 0.0 112.381 -171.182 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . 0.418 ' HA2' ' HA ' ' A' ' 91' ' ' PHE . . . -65.41 132.74 35.64 Favored Glycine 0 N--CA 1.47 0.923 0 CA-C-O 119.346 -0.696 . . . . 0.0 111.899 171.976 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 20.1 t -80.28 168.52 18.95 Favored 'General case' 0 N--CA 1.48 1.073 0 CA-C-N 117.342 0.571 . . . . 0.0 110.165 -178.074 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 6.2 p-10 -58.87 -34.61 71.8 Favored 'General case' 0 N--CA 1.488 1.463 0 C-N-CA 124.345 1.058 . . . . 0.0 113.661 -169.313 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 23.1 m -72.93 -24.99 60.88 Favored 'General case' 0 N--CA 1.484 1.249 0 C-N-CA 122.748 0.419 . . . . 0.0 111.733 -179.421 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 56' ' ' PHE . . . . . 0.479 ' HB2' ' HB3' ' A' ' 90' ' ' ARG . 63.9 t80 -75.68 -49.93 16.89 Favored 'General case' 0 C--O 1.241 0.641 0 C-N-CA 123.445 0.698 . . . . 0.0 109.264 169.002 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . 0.446 HD21 ' HA ' ' A' ' 49' ' ' GLN . 62.0 mt -59.72 -50.64 73.04 Favored 'General case' 0 C--O 1.211 -0.938 0 CA-C-N 114.879 -1.055 . . . . 0.0 112.068 -168.892 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -60.42 -38.64 84.7 Favored 'General case' 0 N--CA 1.482 1.169 0 C-N-CA 123.497 0.719 . . . . 0.0 112.215 -175.403 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 12.3 mm-40 -67.27 -23.25 65.66 Favored 'General case' 0 N--CA 1.478 0.939 0 C-N-CA 123.176 0.59 . . . . 0.0 112.114 179.297 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 88.1 m-70 -115.99 7.28 14.31 Favored 'General case' 0 N--CA 1.484 1.274 0 C-N-CA 123.554 0.742 . . . . 0.0 111.332 176.275 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 48.3 mtpt 47.33 44.81 16.49 Favored 'General case' 0 N--CA 1.488 1.472 0 C-N-CA 125.119 1.368 . . . . 0.0 112.948 -178.934 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 66.8 mt -94.04 -11.42 30.76 Favored 'General case' 0 N--CA 1.478 0.951 0 C-N-CA 124.04 0.936 . . . . 0.0 111.931 -179.07 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 1.4 pp -79.44 -178.06 6.09 Favored 'General case' 0 N--CA 1.484 1.254 0 CA-C-O 121.357 0.598 . . . . 0.0 111.793 178.762 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 77.35 -142.44 27.14 Favored Glycine 0 C--N 1.341 0.828 0 CA-C-N 114.827 -1.078 . . . . 0.0 112.17 177.557 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 79.3 m-20 -82.04 131.06 35.24 Favored 'General case' 0 N--CA 1.469 0.481 0 N-CA-C 109.173 -0.677 . . . . 0.0 109.173 177.866 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 69.8 mt -57.49 -40.47 74.85 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.055 0 C-N-CA 123.478 0.711 . . . . 0.0 110.568 179.519 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 38.8 mtmm -55.19 -48.22 74.14 Favored 'General case' 0 N--CA 1.485 1.285 0 C-N-CA 123.332 0.653 . . . . 0.0 111.69 177.01 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 68' ' ' ASN . . . . . 0.415 ' O ' HG22 ' A' ' 72' ' ' THR . 3.3 m-20 -54.46 -41.71 69.79 Favored 'General case' 0 N--CA 1.49 1.558 0 C-N-CA 123.742 0.817 . . . . 0.0 111.606 177.905 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 22.3 t -73.07 -38.77 56.16 Favored 'Isoleucine or valine' 0 CA--C 1.551 0.996 0 CA-C-N 115.648 -0.705 . . . . 0.0 110.454 179.396 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -73.78 -26.46 60.65 Favored 'General case' 0 N--CA 1.488 1.432 0 C-N-CA 123.485 0.714 . . . . 0.0 112.592 -173.254 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 22.4 ptmt -81.88 -18.66 43.0 Favored 'General case' 0 N--CA 1.485 1.293 0 C-N-CA 122.704 0.402 . . . . 0.0 111.817 -176.232 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 72' ' ' THR . . . . . 0.415 HG22 ' O ' ' A' ' 68' ' ' ASN . 9.5 t -118.42 -34.8 3.94 Favored 'General case' 0 N--CA 1.484 1.234 0 C-N-CA 123.146 0.578 . . . . 0.0 111.754 -174.56 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . 0.444 ' HB1' ' ND1' ' A' ' 77' ' ' HIS . . . -98.35 141.25 31.47 Favored 'General case' 0 N--CA 1.471 0.586 0 C-N-CA 123.455 0.702 . . . . 0.0 110.219 -174.332 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 74' ' ' ASN . . . . . 0.441 ' ND2' ' HB3' ' A' ' 76' ' ' ASP . 26.9 p-10 -97.25 175.5 6.25 Favored 'General case' 0 N--CA 1.474 0.761 0 C-N-CA 123.603 0.761 . . . . 0.0 111.014 -176.043 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . 0.461 ' O ' HG23 ' A' ' 79' ' ' VAL . 32.0 ttmt -70.06 -38.82 75.88 Favored 'General case' 0 CA--C 1.541 0.602 0 C-N-CA 123.958 0.903 . . . . 0.0 111.269 -177.357 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 76' ' ' ASP . . . . . 0.441 ' HB3' ' ND2' ' A' ' 74' ' ' ASN . 24.0 t70 -58.77 -37.14 75.63 Favored 'General case' 0 N--CA 1.488 1.467 0 C-N-CA 123.577 0.751 . . . . 0.0 110.929 179.022 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 77' ' ' HIS . . . . . 0.444 ' ND1' ' HB1' ' A' ' 73' ' ' ALA . 4.1 t-80 -59.09 -47.56 84.81 Favored 'General case' 0 N--CA 1.476 0.86 0 C-N-CA 124.543 1.137 . . . . 0.0 110.818 173.262 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . 0.437 HD13 ' HB ' ' A' ' 44' ' ' ILE . 70.7 mt -65.68 -41.33 92.56 Favored 'General case' 0 N--CA 1.477 0.898 0 C-N-CA 123.372 0.669 . . . . 0.0 111.58 -172.268 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 79' ' ' VAL . . . . . 0.539 HG22 ' HB3' ' A' ' 34' ' ' LEU . 45.7 t -67.14 -44.71 87.75 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.697 0 C-N-CA 123.985 0.914 . . . . 0.0 110.552 -179.243 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 99.6 m -59.33 -50.01 75.62 Favored 'General case' 0 N--CA 1.477 0.876 0 C-N-CA 123.535 0.734 . . . . 0.0 110.924 176.185 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -62.35 -38.02 87.91 Favored 'General case' 0 N--CA 1.477 0.895 0 C-N-CA 123.545 0.738 . . . . 0.0 111.028 179.618 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 82' ' ' TYR . . . . . 0.422 ' O ' ' HB3' ' A' ' 85' ' ' LEU . 7.6 t80 -56.31 -54.16 48.75 Favored 'General case' 0 N--CA 1.476 0.854 0 C-N-CA 124.867 1.267 . . . . 0.0 111.614 177.67 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 83' ' ' ASN . . . . . . . . . . . . . 64.7 m-80 -66.14 -45.71 80.07 Favored 'General case' 0 N--CA 1.483 1.182 0 C-N-CA 122.849 0.46 . . . . 0.0 110.524 -176.953 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 15.2 m-70 -64.58 -26.16 68.29 Favored 'General case' 0 N--CA 1.481 1.097 0 C-N-CA 124.096 0.958 . . . . 0.0 111.295 -179.35 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 85' ' ' LEU . . . . . 0.429 HD11 ' HB3' ' A' ' 91' ' ' PHE . 25.2 tp -58.18 -54.28 48.72 Favored 'General case' 0 N--CA 1.481 1.109 0 C-N-CA 123.679 0.792 . . . . 0.0 110.724 176.59 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 86' ' ' PHE . . . . . 0.402 ' HA ' ' HE2' ' A' ' 91' ' ' PHE . 8.8 m-85 -74.87 -30.59 61.37 Favored 'General case' 0 CA--C 1.544 0.713 0 CA-C-N 113.539 -1.664 . . . . 0.0 111.0 -176.873 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 10.9 tp10 -67.69 -32.5 73.2 Favored 'General case' 0 N--CA 1.475 0.811 0 C-N-CA 124.144 0.978 . . . . 0.0 111.476 -174.436 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 43.3 p -113.94 -9.07 13.07 Favored 'General case' 0 N--CA 1.477 0.923 0 C-N-CA 123.972 0.909 . . . . 0.0 110.982 179.806 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 52.6 mtpt 62.93 41.1 8.82 Favored 'General case' 0 N--CA 1.481 1.081 0 C-N-CA 124.492 1.117 . . . . 0.0 112.415 174.338 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 90' ' ' ARG . . . . . 0.479 ' HB3' ' HB2' ' A' ' 56' ' ' PHE . 54.2 mtt180 -76.82 -5.81 49.79 Favored 'General case' 0 N--CA 1.487 1.423 0 C-N-CA 124.189 0.996 . . . . 0.0 112.735 -178.893 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 91' ' ' PHE . . . . . 0.429 ' HB3' HD11 ' A' ' 85' ' ' LEU . 5.5 p90 -61.9 150.8 36.52 Favored 'General case' 0 N--CA 1.472 0.664 0 C-N-CA 123.041 0.536 . . . . 0.0 112.309 175.475 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 86.2 tttt . . . . . 0 CA--C 1.549 0.914 0 CA-C-N 114.819 -1.082 . . . . 0.0 109.631 -179.155 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 20' ' ' MET . . . . . . . . . . . . . 26.2 ptt? . . . . . 0 N--CA 1.478 0.964 0 N-CA-C 110.017 -0.364 . . . . 0.0 110.017 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -77.51 77.96 4.03 Favored 'General case' 0 C--O 1.245 0.82 0 C-N-CA 123.13 0.572 . . . . 0.0 109.681 177.869 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -170.88 76.73 0.07 Allowed 'General case' 0 N--CA 1.469 0.523 0 C-N-CA 124.52 1.128 . . . . 0.0 108.624 -175.975 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -70.7 94.07 0.99 Allowed 'General case' 0 N--CA 1.473 0.719 0 C-N-CA 123.663 0.785 . . . . 0.0 109.695 179.664 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 34.6 m -66.96 128.31 93.83 Favored Pre-proline 0 CA--C 1.553 1.077 0 C-N-CA 123.036 0.534 . . . . 0.0 110.53 -175.879 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 31.5 Cg_endo -68.71 99.91 0.67 Allowed 'Trans proline' 0 C--N 1.369 1.648 0 C-N-CA 121.834 1.689 . . . . 0.0 110.688 170.108 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 25.8 pt20 -73.08 -179.89 3.48 Favored 'General case' 0 C--O 1.239 0.536 0 CA-C-N 114.216 -1.356 . . . . 0.0 109.144 170.209 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -51.34 137.11 23.91 Favored 'General case' 0 N--CA 1.475 0.785 0 C-N-CA 123.304 0.642 . . . . 0.0 112.566 -177.808 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -89.68 -29.51 18.73 Favored 'General case' 0 CA--C 1.544 0.748 0 CA-C-N 115.888 -0.597 . . . . 0.0 109.423 174.125 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 29' ' ' TRP . . . . . . . . . . . . . 6.8 m-90 -141.12 160.59 39.76 Favored 'General case' 0 N--CA 1.487 1.418 0 C-N-CA 124.301 1.041 . . . . 0.0 110.018 -177.925 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 74.5 p -88.44 170.23 11.09 Favored 'General case' 0 N--CA 1.472 0.643 0 C-N-CA 123.172 0.589 . . . . 0.0 109.463 175.261 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . 0.5 ' HA ' HD12 ' A' ' 34' ' ' LEU . 14.5 p -62.22 -37.15 77.84 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.416 0 C-N-CA 123.154 0.582 . . . . 0.0 111.817 -173.143 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 9.9 pt-20 -70.32 -34.04 72.22 Favored 'General case' 0 N--CA 1.479 0.98 0 C-N-CA 124.167 0.987 . . . . 0.0 111.304 177.682 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 16.0 mm100 -70.82 -36.17 72.82 Favored 'General case' 0 N--CA 1.475 0.785 0 C-N-CA 122.809 0.444 . . . . 0.0 110.701 173.385 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.56 ' HA ' HD23 ' A' ' 39' ' ' LEU . 92.1 mt -66.07 -53.58 36.53 Favored 'General case' 0 N--CA 1.475 0.792 0 C-N-CA 123.195 0.598 . . . . 0.0 110.614 -177.383 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 9.7 ptp180 -66.35 -21.19 66.24 Favored 'General case' 0 N--CA 1.477 0.879 0 CA-C-N 115.071 -0.968 . . . . 0.0 111.742 -174.323 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 42.0 t -57.11 126.78 28.76 Favored 'General case' 0 C--N 1.354 0.766 0 C-N-CA 123.941 0.897 . . . . 0.0 110.84 176.372 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 16.4 mp0 -63.91 -32.92 74.61 Favored 'General case' 0 CA--C 1.544 0.741 0 C-N-CA 123.339 0.655 . . . . 0.0 110.864 -179.616 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 1.8 mp0 -78.2 0.65 24.26 Favored 'General case' 0 N--CA 1.478 0.959 0 C-N-CA 123.597 0.759 . . . . 0.0 112.318 179.237 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.56 HD23 ' HA ' ' A' ' 34' ' ' LEU . 62.4 tp -97.96 111.22 58.64 Favored Pre-proline 0 C--O 1.248 0.996 0 N-CA-C 106.5 -1.667 . . . . 0.0 106.5 158.58 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 32.5 Cg_exo -58.02 135.48 68.92 Favored 'Trans proline' 0 C--N 1.382 2.303 0 C-N-CA 122.662 2.241 . . . . 0.0 112.459 -178.981 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . 0.577 ' HG2' ' HE3' ' A' ' 75' ' ' LYS . 53.7 mtpt -56.71 -37.57 71.12 Favored 'General case' 0 N--CA 1.476 0.861 0 C-N-CA 124.885 1.274 . . . . 0.0 111.372 179.675 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 18.1 ptpt -63.31 -32.16 73.5 Favored 'General case' 0 C--O 1.217 -0.622 0 O-C-N 124.117 0.886 . . . . 0.0 112.08 -178.2 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 2.5 m-20 -65.32 -41.17 94.26 Favored 'General case' 0 N--CA 1.487 1.376 0 CA-C-O 120.782 0.325 . . . . 0.0 110.868 176.187 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 57.7 mt -69.16 -50.48 52.5 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.887 0 C-N-CA 123.468 0.707 . . . . 0.0 110.34 -178.835 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 75.8 mt -62.02 -38.5 80.93 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.062 0 C-N-CA 123.513 0.725 . . . . 0.0 110.867 179.495 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -58.09 -50.34 73.8 Favored 'General case' 0 N--CA 1.482 1.141 0 N-CA-C 108.86 -0.793 . . . . 0.0 108.86 175.63 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 27.7 t80 -58.65 -51.92 67.86 Favored 'General case' 0 CA--C 1.548 0.866 0 O-C-N 124.515 1.135 . . . . 0.0 111.069 -178.813 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 92.6 mt -69.62 -30.55 68.3 Favored 'General case' 0 N--CA 1.475 0.803 0 C-N-CA 123.822 0.849 . . . . 0.0 112.203 -173.826 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 2.9 pt20 -82.07 -26.11 33.96 Favored 'General case' 0 N--CA 1.484 1.258 0 C-N-CA 122.384 0.273 . . . . 0.0 110.629 177.174 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 43.1 tt0 -68.71 -22.47 64.34 Favored 'General case' 0 N--CA 1.484 1.243 0 C-N-CA 124.07 0.948 . . . . 0.0 111.811 -177.69 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 56.5 p-80 -127.79 -26.53 2.93 Favored 'General case' 0 N--CA 1.487 1.406 0 N-CA-C 112.635 0.606 . . . . 0.0 112.635 178.013 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -66.57 138.82 36.26 Favored Glycine 0 C--N 1.344 1.007 0 CA-C-O 119.506 -0.608 . . . . 0.0 112.715 178.924 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . 0.448 ' O ' ' HG ' ' A' ' 57' ' ' LEU . 47.4 t -65.77 147.25 53.68 Favored 'General case' 0 N--CA 1.478 0.933 0 N-CA-C 109.677 -0.49 . . . . 0.0 109.677 178.515 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 8.8 p-10 -61.58 -28.18 69.16 Favored 'General case' 0 N--CA 1.485 1.303 0 C-N-CA 123.529 0.732 . . . . 0.0 111.937 -174.872 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 42.0 p -62.85 -44.13 96.96 Favored 'General case' 0 CA--C 1.552 1.05 0 C-N-CA 124.371 1.068 . . . . 0.0 111.141 174.836 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 67.2 t80 -64.27 -45.78 86.58 Favored 'General case' 0 N--CA 1.482 1.146 0 C-N-CA 124.277 1.031 . . . . 0.0 109.733 174.185 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . 0.448 ' HG ' ' O ' ' A' ' 53' ' ' SER . 75.7 mt -63.6 -29.7 70.91 Favored 'General case' 0 C--O 1.214 -0.775 0 CA-C-N 114.415 -1.266 . . . . 0.0 111.161 -176.073 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -71.34 -47.96 53.27 Favored 'General case' 0 N--CA 1.475 0.788 0 C-N-CA 123.237 0.615 . . . . 0.0 110.884 176.189 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 41.0 mt-10 -58.35 -36.12 72.97 Favored 'General case' 0 N--CA 1.491 1.583 0 C-N-CA 123.907 0.883 . . . . 0.0 111.661 178.082 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 41.2 m-70 -107.42 -2.05 20.9 Favored 'General case' 0 N--CA 1.486 1.339 0 C-N-CA 123.465 0.706 . . . . 0.0 112.062 -174.454 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 95.8 mttt 54.33 38.61 29.77 Favored 'General case' 0 N--CA 1.492 1.648 0 C-N-CA 124.678 1.191 . . . . 0.0 112.775 -179.935 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 85.9 mt -88.26 -8.89 54.53 Favored 'General case' 0 N--CA 1.479 0.986 0 C-N-CA 123.15 0.58 . . . . 0.0 111.164 176.653 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -80.17 166.78 21.12 Favored 'General case' 0 N--CA 1.485 1.318 0 CA-C-O 120.917 0.389 . . . . 0.0 111.168 174.632 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 92.63 -168.76 30.8 Favored Glycine 0 C--N 1.34 0.799 0 CA-C-N 115.22 -0.9 . . . . 0.0 112.155 -179.477 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 16.0 m120 -60.79 120.43 10.11 Favored 'General case' 0 N--CA 1.472 0.626 0 C-N-CA 123.232 0.613 . . . . 0.0 109.668 179.306 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 26.9 mt -61.33 -47.9 91.36 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.766 0 C-N-CA 124.039 0.936 . . . . 0.0 111.65 -167.069 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.66 -31.85 72.8 Favored 'General case' 0 N--CA 1.487 1.4 0 C-N-CA 123.748 0.819 . . . . 0.0 111.369 177.615 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 6.0 t30 -69.89 -36.43 75.43 Favored 'General case' 0 N--CA 1.483 1.22 0 C-N-CA 124.429 1.092 . . . . 0.0 110.609 178.396 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 47.7 t -73.06 -34.98 46.97 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.925 0 CA-C-N 115.83 -0.623 . . . . 0.0 109.502 172.274 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -73.44 -6.7 47.99 Favored 'General case' 0 N--CA 1.477 0.922 0 C-N-CA 124.207 1.003 . . . . 0.0 113.062 -174.538 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 22.3 ptmt -97.5 -26.66 14.75 Favored 'General case' 0 N--CA 1.48 1.052 0 CA-C-N 118.507 0.594 . . . . 0.0 112.271 173.454 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 8.8 t -112.08 -36.72 5.27 Favored 'General case' 0 N--CA 1.484 1.236 0 N-CA-C 112.787 0.662 . . . . 0.0 112.787 -166.734 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -91.2 102.46 15.18 Favored 'General case' 0 N--CA 1.472 0.661 0 N-CA-C 107.927 -1.138 . . . . 0.0 107.927 177.558 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 74' ' ' ASN . . . . . 0.449 ' O ' ' HG ' ' A' ' 78' ' ' LEU . 9.4 p30 -65.96 167.67 9.35 Favored 'General case' 0 N--CA 1.486 1.35 0 C-N-CA 123.863 0.865 . . . . 0.0 112.093 -169.687 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . 0.577 ' HE3' ' HG2' ' A' ' 41' ' ' LYS . 4.7 tppp? -63.08 -41.32 99.39 Favored 'General case' 0 CA--C 1.55 0.965 0 C-N-CA 122.9 0.48 . . . . 0.0 112.257 -174.014 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 19.1 t70 -60.38 -36.92 79.18 Favored 'General case' 0 N--CA 1.492 1.674 0 C-N-CA 123.52 0.728 . . . . 0.0 110.817 178.561 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 77' ' ' HIS . . . . . 0.415 ' HB3' ' O ' ' A' ' 74' ' ' ASN . 29.9 t60 -63.78 -39.73 94.95 Favored 'General case' 0 N--CA 1.479 0.983 0 C-N-CA 125.257 1.423 . . . . 0.0 110.466 175.206 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . 0.449 ' HG ' ' O ' ' A' ' 74' ' ' ASN . 40.9 mt -70.42 -38.89 74.66 Favored 'General case' 0 N--CA 1.487 1.417 0 C-N-CA 123.427 0.691 . . . . 0.0 111.91 -177.742 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 69.1 t -64.52 -46.09 93.7 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.904 0 C-N-CA 123.994 0.918 . . . . 0.0 110.27 179.526 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 51.1 m -62.14 -42.63 99.43 Favored 'General case' 0 N--CA 1.479 0.986 0 C-N-CA 123.418 0.687 . . . . 0.0 111.259 177.497 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -62.74 -43.4 98.9 Favored 'General case' 0 N--CA 1.477 0.882 0 C-N-CA 123.585 0.754 . . . . 0.0 110.837 177.676 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 82' ' ' TYR . . . . . . . . . . . . . 17.4 t80 -52.92 -57.9 8.74 Favored 'General case' 0 N--CA 1.473 0.691 0 C-N-CA 124.754 1.221 . . . . 0.0 110.519 178.751 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 83' ' ' ASN . . . . . . . . . . . . . 52.9 m-80 -64.9 -43.9 91.33 Favored 'General case' 0 N--CA 1.481 1.092 0 N-CA-C 112.429 0.529 . . . . 0.0 112.429 -171.067 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 88.6 m-70 -70.88 -24.42 62.49 Favored 'General case' 0 N--CA 1.48 1.062 0 C-N-CA 123.687 0.795 . . . . 0.0 112.083 -178.397 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 17.3 tp -58.76 -53.45 58.19 Favored 'General case' 0 N--CA 1.485 1.279 0 CA-C-O 121.903 0.858 . . . . 0.0 110.888 175.859 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 86' ' ' PHE . . . . . 0.417 ' HA ' ' HE2' ' A' ' 91' ' ' PHE . 56.7 m-85 -72.81 -36.35 67.52 Favored 'General case' 0 C--O 1.234 0.261 0 CA-C-N 113.937 -1.483 . . . . 0.0 110.87 -178.419 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 40.2 tt0 -59.33 -48.85 80.09 Favored 'General case' 0 N--CA 1.473 0.692 0 O-C-N 124.008 0.817 . . . . 0.0 112.202 -171.835 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 19.0 p -109.99 16.32 21.98 Favored 'General case' 0 N--CA 1.475 0.808 0 C-N-CA 123.241 0.616 . . . . 0.0 111.542 -178.897 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 47.3 mmtm 57.61 37.66 27.55 Favored 'General case' 0 N--CA 1.488 1.447 0 C-N-CA 123.95 0.9 . . . . 0.0 111.98 170.743 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 52.6 mtt-85 -70.79 -8.32 51.54 Favored 'General case' 0 N--CA 1.482 1.136 0 C-N-CA 124.126 0.97 . . . . 0.0 112.78 -176.621 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 91' ' ' PHE . . . . . 0.417 ' HE2' ' HA ' ' A' ' 86' ' ' PHE . 13.9 p90 -76.98 157.19 31.39 Favored 'General case' 0 N--CA 1.469 0.491 0 C-N-CA 123.139 0.576 . . . . 0.0 111.499 173.747 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 11.7 tmtt? . . . . . 0 CA--C 1.544 0.733 0 N-CA-C 107.062 -1.458 . . . . 0.0 107.062 -179.502 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 20' ' ' MET . . . . . . . . . . . . . 28.2 ttt . . . . . 0 N--CA 1.482 1.155 0 N-CA-C 108.283 -1.006 . . . . 0.0 108.283 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -58.57 122.31 13.11 Favored 'General case' 0 N--CA 1.481 1.091 0 C-N-CA 124.173 0.989 . . . . 0.0 111.485 -172.79 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . 73.18 -59.02 0.58 Allowed 'General case' 0 N--CA 1.475 0.778 0 C-N-CA 125.944 1.698 . . . . 0.0 112.112 -176.259 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -75.08 80.02 2.24 Favored 'General case' 0 CA--C 1.543 0.7 0 C-N-CA 123.812 0.845 . . . . 0.0 111.955 -175.926 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 28.5 m -119.9 153.62 54.99 Favored Pre-proline 0 CA--C 1.543 0.686 0 N-CA-C 107.806 -1.183 . . . . 0.0 107.806 169.767 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 51.2 Cg_exo -55.51 129.95 37.88 Favored 'Trans proline' 0 C--N 1.372 1.8 0 C-N-CA 121.961 1.774 . . . . 0.0 111.869 169.325 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 11.3 pt20 -89.68 -158.82 0.54 Allowed 'General case' 0 N--CA 1.475 0.783 0 N-CA-C 108.051 -1.092 . . . . 0.0 108.051 168.782 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -59.02 153.05 18.51 Favored 'General case' 0 N--CA 1.475 0.804 0 C-N-CA 122.841 0.456 . . . . 0.0 111.572 173.708 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -108.98 -39.47 5.29 Favored 'General case' 0 N--CA 1.476 0.839 0 C-N-CA 123.23 0.612 . . . . 0.0 110.551 179.941 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 29' ' ' TRP . . . . . . . . . . . . . 3.6 m-90 -128.92 144.98 51.34 Favored 'General case' 0 N--CA 1.481 1.079 0 C-N-CA 123.972 0.909 . . . . 0.0 109.023 -176.495 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 20.2 p -83.53 169.6 15.27 Favored 'General case' 0 N--CA 1.474 0.77 0 C-N-CA 122.947 0.499 . . . . 0.0 109.789 -178.519 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . 0.584 ' HA ' HD12 ' A' ' 34' ' ' LEU . 7.4 p -56.98 -34.9 45.76 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.378 0 C-N-CA 122.887 0.475 . . . . 0.0 111.737 -173.844 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 12.9 pt-20 -67.19 -41.18 86.3 Favored 'General case' 0 N--CA 1.474 0.742 0 C-N-CA 123.814 0.846 . . . . 0.0 111.457 177.251 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 12.9 mm-40 -68.9 -35.24 76.62 Favored 'General case' 0 N--CA 1.477 0.902 0 C-N-CA 123.328 0.651 . . . . 0.0 111.266 178.792 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.584 HD12 ' HA ' ' A' ' 31' ' ' VAL . 66.3 mt -65.73 -45.64 81.88 Favored 'General case' 0 N--CA 1.472 0.643 0 O-C-N 123.618 0.573 . . . . 0.0 111.0 -179.693 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . 0.404 ' HG2' HG21 ' A' ' 79' ' ' VAL . 93.0 mtt-85 -79.01 -15.86 57.67 Favored 'General case' 0 CA--C 1.546 0.815 0 CA-C-N 115.419 -0.81 . . . . 0.0 111.352 179.637 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 40.0 t -63.83 138.65 58.57 Favored 'General case' 0 N--CA 1.48 1.057 0 C-N-CA 123.235 0.614 . . . . 0.0 111.414 -179.597 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 12.4 pt-20 -65.65 -18.86 65.63 Favored 'General case' 0 CA--C 1.551 1.014 0 C-N-CA 124.563 1.145 . . . . 0.0 111.97 179.989 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 76.3 mt-30 -73.42 -51.36 17.53 Favored 'General case' 0 CA--C 1.54 0.568 0 C-N-CA 124.116 0.966 . . . . 0.0 111.072 -177.984 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 46.7 tp -70.62 120.43 78.8 Favored Pre-proline 0 N--CA 1.478 0.941 0 CA-C-O 118.702 -0.666 . . . . 0.0 110.399 -176.189 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 24.6 Cg_exo -63.61 138.83 66.65 Favored 'Trans proline' 0 C--N 1.385 2.451 0 C-N-CA 122.747 2.298 . . . . 0.0 112.059 -179.19 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 21.5 ptmt -69.84 -32.36 70.72 Favored 'General case' 0 CA--C 1.537 0.444 0 C-N-CA 123.585 0.754 . . . . 0.0 110.825 -177.335 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 21.6 pttp -70.61 -28.83 65.15 Favored 'General case' 0 N--CA 1.474 0.753 0 C-N-CA 123.527 0.731 . . . . 0.0 110.915 175.994 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 28.0 t70 -69.24 -36.5 77.25 Favored 'General case' 0 N--CA 1.477 0.896 0 C-N-CA 122.543 0.337 . . . . 0.0 110.298 176.194 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 47.8 mt -66.34 -53.57 35.02 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.988 0 C-N-CA 122.878 0.471 . . . . 0.0 109.979 176.551 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 86.7 mt -55.91 -39.98 59.97 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.388 0 C-N-CA 123.959 0.903 . . . . 0.0 111.162 179.746 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 40.1 ttmt -57.49 -45.53 84.78 Favored 'General case' 0 N--CA 1.473 0.694 0 C-N-CA 123.703 0.801 . . . . 0.0 110.891 178.591 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 11.8 t80 -63.73 -48.29 77.63 Favored 'General case' 0 N--CA 1.471 0.606 0 O-C-N 123.897 0.748 . . . . 0.0 110.357 177.843 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 85.3 mt -68.86 -31.19 69.96 Favored 'General case' 0 CA--C 1.544 0.746 0 C-N-CA 123.201 0.6 . . . . 0.0 112.314 -172.742 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . 0.413 ' HA ' HD21 ' A' ' 57' ' ' LEU . 3.2 pt20 -84.61 -36.36 22.07 Favored 'General case' 0 N--CA 1.484 1.25 0 N-CA-C 111.674 0.25 . . . . 0.0 111.674 179.79 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 12.6 tp10 -69.14 -39.17 78.99 Favored 'General case' 0 N--CA 1.481 1.125 0 CA-C-O 121.587 0.708 . . . . 0.0 110.252 179.781 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 3.0 t60 -93.43 -49.85 5.72 Favored 'General case' 0 N--CA 1.47 0.548 0 CA-C-N 114.63 -1.168 . . . . 0.0 110.467 -173.349 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . 0.473 ' HA2' ' HA ' ' A' ' 91' ' ' PHE . . . -65.0 144.9 48.76 Favored Glycine 0 C--N 1.349 1.262 0 O-C-N 123.527 0.517 . . . . 0.0 113.185 173.253 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 34.5 t -89.67 166.45 13.59 Favored 'General case' 0 CA--C 1.55 0.971 0 C-N-CA 123.744 0.817 . . . . 0.0 110.669 -178.494 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 48.7 m-20 -58.0 -36.16 72.26 Favored 'General case' 0 N--CA 1.494 1.757 0 C-N-CA 123.912 0.885 . . . . 0.0 112.978 -169.175 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 40.2 t -64.0 -31.59 72.83 Favored 'General case' 0 N--CA 1.476 0.847 0 C-N-CA 123.605 0.762 . . . . 0.0 111.493 -178.299 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 85.4 t80 -76.21 -45.7 31.85 Favored 'General case' 0 CA--C 1.546 0.825 0 C-N-CA 123.497 0.719 . . . . 0.0 110.282 171.285 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . 0.413 HD21 ' HA ' ' A' ' 49' ' ' GLN . 45.7 mt -65.03 -33.44 76.04 Favored 'General case' 0 N--CA 1.478 0.935 0 CA-C-N 115.175 -0.921 . . . . 0.0 112.845 -169.701 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -68.4 -48.53 64.46 Favored 'General case' 0 N--CA 1.475 0.784 0 C-N-CA 122.62 0.368 . . . . 0.0 110.475 178.739 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 10.0 mm-40 -62.31 -33.5 74.8 Favored 'General case' 0 N--CA 1.476 0.87 0 CA-C-N 115.771 -0.649 . . . . 0.0 111.045 -178.484 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 34.5 m-70 -105.99 4.33 29.29 Favored 'General case' 0 N--CA 1.479 0.99 0 C-N-CA 123.223 0.609 . . . . 0.0 112.297 -178.214 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 46.0 mmtm 56.14 28.2 12.67 Favored 'General case' 0 N--CA 1.498 1.933 0 C-N-CA 124.377 1.071 . . . . 0.0 113.164 174.855 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 0.487 HD11 ' HB1' ' A' ' 81' ' ' ALA . 92.2 mt -88.43 -8.85 54.3 Favored 'General case' 0 N--CA 1.481 1.094 0 C-N-CA 123.609 0.763 . . . . 0.0 112.061 -178.214 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 1.4 pp -67.48 167.34 12.94 Favored 'General case' 0 N--CA 1.477 0.913 0 C-N-CA 122.92 0.488 . . . . 0.0 111.44 177.727 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 77.01 -154.81 43.62 Favored Glycine 0 C--N 1.338 0.674 0 CA-C-N 115.653 -0.703 . . . . 0.0 113.623 174.695 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 65' ' ' ASN . . . . . 0.414 ' O ' HG23 ' A' ' 69' ' ' VAL . 15.9 m120 -64.57 124.66 22.44 Favored 'General case' 0 N--CA 1.472 0.658 0 C-N-CA 123.698 0.799 . . . . 0.0 110.609 -176.952 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 49.7 mt -58.03 -45.83 88.1 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.974 0 C-N-CA 124.127 0.971 . . . . 0.0 110.546 -179.327 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 17.7 mtpp -51.46 -46.02 62.94 Favored 'General case' 0 N--CA 1.482 1.175 0 C-N-CA 124.642 1.177 . . . . 0.0 111.714 174.714 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 68' ' ' ASN . . . . . 0.447 ' O ' ' HG2' ' A' ' 71' ' ' LYS . 7.8 t30 -64.57 -40.77 96.16 Favored 'General case' 0 N--CA 1.478 0.943 0 C-N-CA 123.484 0.714 . . . . 0.0 111.02 -179.169 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 69' ' ' VAL . . . . . 0.414 HG23 ' O ' ' A' ' 65' ' ' ASN . 18.4 t -71.4 -32.14 45.59 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.094 0 CA-C-O 121.018 0.437 . . . . 0.0 110.038 178.074 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -76.55 -16.33 59.64 Favored 'General case' 0 N--CA 1.485 1.288 0 C-N-CA 123.635 0.774 . . . . 0.0 112.229 -177.122 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . 0.447 ' HG2' ' O ' ' A' ' 68' ' ' ASN . 20.0 ptmt -94.76 -17.35 22.25 Favored 'General case' 0 N--CA 1.479 1.003 0 C-N-CA 122.367 0.267 . . . . 0.0 111.521 178.925 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 13.1 t -114.29 -35.32 5.02 Favored 'General case' 0 N--CA 1.479 1.006 0 C-N-CA 122.89 0.476 . . . . 0.0 111.777 -172.087 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -99.59 119.66 38.42 Favored 'General case' 0 N--CA 1.47 0.544 0 C-N-CA 124.048 0.939 . . . . 0.0 109.702 -176.082 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 74' ' ' ASN . . . . . 0.401 ' O ' ' HG ' ' A' ' 78' ' ' LEU . 27.8 p-10 -74.67 169.7 17.29 Favored 'General case' 0 N--CA 1.481 1.096 0 C-N-CA 123.563 0.745 . . . . 0.0 111.226 -177.171 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 15.0 tptm -60.23 -39.05 85.29 Favored 'General case' 0 N--CA 1.481 1.081 0 C-N-CA 124.029 0.932 . . . . 0.0 110.929 -174.122 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 29.7 t70 -64.4 -38.46 91.11 Favored 'General case' 0 N--CA 1.475 0.793 0 C-N-CA 124.125 0.97 . . . . 0.0 111.338 -179.099 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 31.1 t60 -59.8 -37.43 79.11 Favored 'General case' 0 N--CA 1.481 1.084 0 C-N-CA 124.213 1.005 . . . . 0.0 110.446 176.492 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . 0.401 ' HG ' ' O ' ' A' ' 74' ' ' ASN . 27.2 mt -72.72 -35.36 67.56 Favored 'General case' 0 N--CA 1.478 0.931 0 CA-C-N 115.78 -0.645 . . . . 0.0 111.278 -174.954 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 79' ' ' VAL . . . . . 0.404 HG21 ' HG2' ' A' ' 35' ' ' ARG . 21.5 t -69.86 -40.72 79.23 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.69 0 C-N-CA 123.306 0.642 . . . . 0.0 109.712 175.11 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 43.3 m -57.73 -45.1 86.26 Favored 'General case' 0 N--CA 1.478 0.928 0 C-N-CA 123.783 0.833 . . . . 0.0 110.489 175.118 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 81' ' ' ALA . . . . . 0.487 ' HB1' HD11 ' A' ' 62' ' ' LEU . . . -66.48 -43.53 85.18 Favored 'General case' 0 CA--C 1.534 0.335 0 CA-C-N 115.719 -0.673 . . . . 0.0 110.927 -179.592 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 82' ' ' TYR . . . . . 0.551 ' HD1' HD22 ' A' ' 83' ' ' ASN . 18.4 t80 -53.67 -56.39 17.69 Favored 'General case' 0 CA--C 1.543 0.676 0 C-N-CA 124.079 0.952 . . . . 0.0 110.409 176.816 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 83' ' ' ASN . . . . . 0.551 HD22 ' HD1' ' A' ' 82' ' ' TYR . 0.9 OUTLIER -55.68 -51.24 67.94 Favored 'General case' 0 N--CA 1.489 1.493 0 C-N-CA 123.46 0.704 . . . . 0.0 111.081 -175.824 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 66.4 m-70 -70.43 -22.83 62.67 Favored 'General case' 0 CA--C 1.543 0.707 0 C-N-CA 124.553 1.141 . . . . 0.0 112.567 -175.771 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 42.4 tp -63.19 -55.32 26.08 Favored 'General case' 0 N--CA 1.483 1.212 0 CA-C-O 121.603 0.716 . . . . 0.0 110.986 177.96 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 86' ' ' PHE . . . . . 0.49 ' HA ' ' HE1' ' A' ' 91' ' ' PHE . 37.2 m-85 -75.86 -28.78 58.31 Favored 'General case' 0 N--CA 1.474 0.735 0 CA-C-N 114.101 -1.409 . . . . 0.0 111.83 -175.744 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 11.6 tp10 -68.61 -18.49 64.32 Favored 'General case' 0 N--CA 1.479 1.017 0 C-N-CA 123.12 0.568 . . . . 0.0 112.063 -176.343 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 18.1 p -129.04 -1.42 5.21 Favored 'General case' 0 N--CA 1.479 0.985 0 C-N-CA 123.761 0.824 . . . . 0.0 111.811 -179.722 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 73.1 mmtt 59.57 38.78 22.1 Favored 'General case' 0 N--CA 1.487 1.397 0 C-N-CA 124.558 1.143 . . . . 0.0 111.71 177.301 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 62.2 mtt180 -73.23 -11.04 60.37 Favored 'General case' 0 N--CA 1.49 1.556 0 C-N-CA 123.625 0.77 . . . . 0.0 112.765 -178.232 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 91' ' ' PHE . . . . . 0.49 ' HE1' ' HA ' ' A' ' 86' ' ' PHE . 50.3 p90 -81.88 156.24 24.91 Favored 'General case' 0 C--O 1.242 0.666 0 C-N-CA 123.244 0.618 . . . . 0.0 110.946 171.872 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 33.2 ttpt . . . . . 0 C--O 1.253 1.272 0 N-CA-C 107.425 -1.324 . . . . 0.0 107.425 170.671 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 20' ' ' MET . . . . . . . . . . . . . 56.2 mtt . . . . . 0 N--CA 1.476 0.836 0 N-CA-C 109.631 -0.507 . . . . 0.0 109.631 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -91.03 143.4 26.74 Favored 'General case' 0 N--CA 1.474 0.754 0 C-N-CA 123.68 0.792 . . . . 0.0 110.09 178.02 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -70.38 97.07 1.21 Allowed 'General case' 0 N--CA 1.47 0.549 0 N-CA-C 108.547 -0.908 . . . . 0.0 108.547 174.894 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -84.88 49.78 1.79 Allowed 'General case' 0 N--CA 1.477 0.906 0 C-N-CA 123.887 0.875 . . . . 0.0 111.425 -173.231 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 16.4 m -60.51 123.4 73.7 Favored Pre-proline 0 CA--C 1.558 1.274 0 C-N-CA 124.499 1.12 . . . . 0.0 111.307 -177.605 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 58.9 Cg_endo -72.29 107.48 2.28 Favored 'Trans proline' 0 C--N 1.375 1.934 0 C-N-CA 122.125 1.883 . . . . 0.0 112.89 -174.692 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 17.8 pt20 -88.3 150.09 23.43 Favored 'General case' 0 C--O 1.247 0.97 0 N-CA-C 108.043 -1.095 . . . . 0.0 108.043 167.521 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -61.53 132.33 53.03 Favored 'General case' 0 CA--C 1.539 0.529 0 O-C-N 123.455 0.472 . . . . 0.0 110.734 179.129 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -78.82 -31.96 46.02 Favored 'General case' 0 N--CA 1.467 0.412 0 CA-C-N 115.452 -0.795 . . . . 0.0 109.643 176.243 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 29' ' ' TRP . . . . . . . . . . . . . 3.4 m-90 -129.25 142.67 50.78 Favored 'General case' 0 N--CA 1.463 0.192 0 C-N-CA 124.439 1.096 . . . . 0.0 109.043 -175.456 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 42.7 p -82.03 174.75 10.95 Favored 'General case' 0 N--CA 1.473 0.691 0 C-N-CA 123.085 0.554 . . . . 0.0 109.597 173.648 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 7.5 p -58.62 -39.01 74.61 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.328 0 C-N-CA 122.732 0.413 . . . . 0.0 111.423 -176.799 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 11.4 pt-20 -69.32 -39.43 78.21 Favored 'General case' 0 N--CA 1.48 1.074 0 C-N-CA 123.58 0.752 . . . . 0.0 111.53 178.311 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 52.9 mt-30 -63.56 -36.76 84.85 Favored 'General case' 0 N--CA 1.481 1.083 0 C-N-CA 122.888 0.475 . . . . 0.0 110.807 177.963 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 89.7 mt -60.94 -51.48 69.09 Favored 'General case' 0 N--CA 1.48 1.045 0 O-C-N 123.473 0.483 . . . . 0.0 109.866 176.878 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 43.7 mtm105 -65.36 -18.87 65.66 Favored 'General case' 0 C--N 1.353 0.74 0 CA-C-N 114.43 -1.259 . . . . 0.0 111.865 -175.718 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 44.8 t -56.47 123.91 16.38 Favored 'General case' 0 C--N 1.354 0.789 0 N-CA-C 109.649 -0.5 . . . . 0.0 109.649 173.316 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 28.9 mt-10 -57.98 -37.1 73.58 Favored 'General case' 0 N--CA 1.474 0.749 0 C-N-CA 124.452 1.101 . . . . 0.0 111.278 -177.854 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 74.7 mt-30 -64.25 -30.21 71.27 Favored 'General case' 0 N--CA 1.475 0.794 0 C-N-CA 123.79 0.836 . . . . 0.0 111.484 -178.14 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 4.1 tt -81.05 113.0 37.39 Favored Pre-proline 0 CA--C 1.549 0.935 0 N-CA-C 107.553 -1.277 . . . . 0.0 107.553 172.692 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 40' ' ' PRO . . . . . 0.546 ' HB2' ' HG2' ' A' ' 42' ' ' LYS . 11.3 Cg_exo -70.55 147.34 57.59 Favored 'Trans proline' 0 C--N 1.371 1.717 0 C-N-CA 122.906 2.404 . . . . 0.0 112.81 -179.222 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 52.4 mtmt -56.83 -29.11 62.49 Favored 'General case' 0 N--CA 1.478 0.951 0 C-N-CA 124.602 1.161 . . . . 0.0 112.23 177.026 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . 0.546 ' HG2' ' HB2' ' A' ' 40' ' ' PRO . 17.4 ptpt -66.3 -36.91 84.16 Favored 'General case' 0 N--CA 1.47 0.533 0 C-N-CA 123.342 0.657 . . . . 0.0 111.71 -179.754 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 43' ' ' ASP . . . . . 0.474 ' HA ' ' HE2' ' A' ' 46' ' ' LYS . 2.3 m-20 -67.16 -35.36 79.52 Favored 'General case' 0 N--CA 1.479 1.009 0 O-C-N 123.293 0.37 . . . . 0.0 111.229 178.948 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 44' ' ' ILE . . . . . 0.4 ' O ' ' HG ' ' A' ' 48' ' ' LEU . 37.6 mt -65.65 -54.12 31.43 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.748 0 O-C-N 123.708 0.63 . . . . 0.0 109.635 177.949 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 68.0 mt -58.02 -39.52 72.62 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.253 0 C-N-CA 123.489 0.716 . . . . 0.0 111.096 177.945 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 46' ' ' LYS . . . . . 0.474 ' HE2' ' HA ' ' A' ' 43' ' ' ASP . 36.5 ttpt -59.92 -43.24 95.0 Favored 'General case' 0 N--CA 1.478 0.956 0 C-N-CA 124.086 0.955 . . . . 0.0 110.88 179.301 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 22.5 t80 -64.4 -47.13 80.36 Favored 'General case' 0 CA--C 1.548 0.889 0 CA-C-N 114.962 -1.017 . . . . 0.0 110.947 176.874 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . 0.4 ' HG ' ' O ' ' A' ' 44' ' ' ILE . 87.3 mt -70.82 -30.53 66.99 Favored 'General case' 0 N--CA 1.472 0.665 0 CA-C-N 115.326 -0.852 . . . . 0.0 111.741 -174.723 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . 0.507 ' HA ' HD21 ' A' ' 57' ' ' LEU . 3.4 pt20 -84.15 -27.5 28.08 Favored 'General case' 0 N--CA 1.482 1.13 0 C-N-CA 122.639 0.375 . . . . 0.0 110.909 177.748 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 14.4 tp10 -56.72 -37.26 70.71 Favored 'General case' 0 N--CA 1.475 0.816 0 C-N-CA 124.167 0.987 . . . . 0.0 111.505 179.699 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 31.9 m80 -129.99 -21.59 2.98 Favored 'General case' 0 N--CA 1.476 0.83 0 N-CA-C 113.032 0.753 . . . . 0.0 113.032 -177.46 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -60.18 136.34 49.73 Favored Glycine 0 N--CA 1.474 1.204 0 CA-C-N 118.694 0.679 . . . . 0.0 112.818 176.27 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . 0.425 ' O ' ' HG ' ' A' ' 57' ' ' LEU . 39.7 t -64.08 158.71 22.03 Favored 'General case' 0 N--CA 1.481 1.089 0 C-N-CA 123.618 0.767 . . . . 0.0 110.752 179.133 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 7.2 p-10 -66.14 -29.58 69.9 Favored 'General case' 0 N--CA 1.483 1.181 0 C-N-CA 123.37 0.668 . . . . 0.0 111.396 -171.853 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 42.1 t -71.85 -38.43 70.09 Favored 'General case' 0 N--CA 1.473 0.694 0 C-N-CA 123.555 0.742 . . . . 0.0 110.722 175.397 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 57.4 t80 -63.44 -44.35 94.79 Favored 'General case' 0 N--CA 1.479 0.995 0 N-CA-C 109.14 -0.689 . . . . 0.0 109.14 174.771 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . 0.507 HD21 ' HA ' ' A' ' 49' ' ' GLN . 62.0 mt -68.05 -31.65 71.45 Favored 'General case' 0 C--O 1.222 -0.345 0 CA-C-N 115.243 -0.889 . . . . 0.0 111.081 -178.599 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -71.19 -50.06 37.16 Favored 'General case' 0 N--CA 1.472 0.65 0 C-N-CA 123.001 0.52 . . . . 0.0 111.212 177.632 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 27.1 mm-40 -73.79 -16.41 61.16 Favored 'General case' 0 N--CA 1.477 0.912 0 N-CA-C 112.335 0.495 . . . . 0.0 112.335 -176.851 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 44.6 m-70 -114.19 1.18 14.46 Favored 'General case' 0 N--CA 1.489 1.48 0 C-N-CA 123.176 0.59 . . . . 0.0 111.74 176.8 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 74.6 mmtt 58.09 30.51 19.4 Favored 'General case' 0 N--CA 1.493 1.708 0 C-N-CA 124.613 1.165 . . . . 0.0 113.103 174.499 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 0.444 HD11 ' HB1' ' A' ' 81' ' ' ALA . 65.6 mt -90.41 -6.96 54.32 Favored 'General case' 0 N--CA 1.487 1.394 0 C-N-CA 123.755 0.822 . . . . 0.0 111.988 -176.415 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -74.57 173.73 10.0 Favored 'General case' 0 N--CA 1.477 0.923 0 C-N-CA 123.06 0.544 . . . . 0.0 111.699 177.196 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 82.6 -165.84 44.75 Favored Glycine 0 C--O 1.246 0.868 0 CA-C-N 115.353 -0.839 . . . . 0.0 112.919 178.278 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 45.5 t-20 -68.2 125.09 25.28 Favored 'General case' 0 C--O 1.241 0.646 0 N-CA-C 109.014 -0.735 . . . . 0.0 109.014 176.884 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 66' ' ' ILE . . . . . 0.437 HD13 ' HB2' ' A' ' 46' ' ' LYS . 32.5 mt -58.5 -53.22 49.71 Favored 'Isoleucine or valine' 0 C--O 1.214 -0.811 0 O-C-N 124.317 1.01 . . . . 0.0 111.707 -169.885 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 22.9 pttp -59.41 -34.92 73.06 Favored 'General case' 0 N--CA 1.489 1.489 0 C-N-CA 123.886 0.875 . . . . 0.0 112.99 -172.051 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 47.9 t30 -65.4 -45.29 84.55 Favored 'General case' 0 N--CA 1.473 0.692 0 C-N-CA 123.452 0.701 . . . . 0.0 110.115 178.86 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 97.3 t -70.61 -43.44 77.63 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.787 0 CA-C-N 115.162 -0.926 . . . . 0.0 110.91 178.167 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -59.22 -50.56 73.54 Favored 'General case' 0 N--CA 1.479 1.009 0 C-N-CA 124.875 1.27 . . . . 0.0 112.603 -167.121 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 19.4 ptpt -55.53 -45.41 77.19 Favored 'General case' 0 CA--C 1.558 1.26 0 O-C-N 123.863 0.727 . . . . 0.0 112.063 -179.545 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 13.3 t -93.0 -9.72 38.83 Favored 'General case' 0 N--CA 1.479 1.01 0 C-N-CA 123.662 0.785 . . . . 0.0 111.874 -173.981 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -93.41 118.03 30.81 Favored 'General case' 0 N--CA 1.472 0.662 0 N-CA-C 108.62 -0.881 . . . . 0.0 108.62 173.306 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 29.2 p-10 -73.98 148.54 42.0 Favored 'General case' 0 C--O 1.239 0.535 0 N-CA-C 109.78 -0.452 . . . . 0.0 109.78 176.9 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 39.2 ttmt -63.94 -26.71 68.71 Favored 'General case' 0 CA--C 1.541 0.602 0 C-N-CA 123.559 0.744 . . . . 0.0 111.124 -174.435 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 28.3 t70 -59.74 -40.66 88.83 Favored 'General case' 0 CA--C 1.544 0.739 0 C-N-CA 124.272 1.029 . . . . 0.0 111.28 177.758 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 75.0 t60 -66.37 -39.34 89.05 Favored 'General case' 0 N--CA 1.474 0.77 0 C-N-CA 123.955 0.902 . . . . 0.0 110.086 175.66 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 29.7 mt -69.87 -36.46 75.5 Favored 'General case' 0 N--CA 1.481 1.1 0 C-N-CA 123.348 0.659 . . . . 0.0 112.009 -174.693 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 77.2 t -67.83 -42.83 86.3 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.668 0 C-N-CA 123.849 0.859 . . . . 0.0 109.659 177.295 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 51.5 m -61.09 -40.38 93.5 Favored 'General case' 0 CA--C 1.549 0.91 0 C-N-CA 122.882 0.473 . . . . 0.0 110.725 175.046 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 81' ' ' ALA . . . . . 0.444 ' HB1' HD11 ' A' ' 62' ' ' LEU . . . -65.82 -40.64 92.01 Favored 'General case' 0 N--CA 1.474 0.745 0 C-N-CA 123.497 0.719 . . . . 0.0 111.011 177.414 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 82' ' ' TYR . . . . . . . . . . . . . 13.9 t80 -58.59 -55.34 36.32 Favored 'General case' 0 CA--C 1.541 0.629 0 CA-C-N 114.532 -1.213 . . . . 0.0 110.989 179.206 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 83' ' ' ASN . . . . . . . . . . . . . 67.3 m-80 -64.7 -44.08 91.41 Favored 'General case' 0 N--CA 1.483 1.176 0 C-N-CA 122.454 0.302 . . . . 0.0 111.161 -174.129 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 25.2 m-70 -64.3 -26.63 68.57 Favored 'General case' 0 N--CA 1.485 1.315 0 C-N-CA 123.708 0.803 . . . . 0.0 111.845 179.155 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 85' ' ' LEU . . . . . 0.491 HD12 ' HB2' ' A' ' 90' ' ' ARG . 53.6 tp -58.34 -52.95 63.43 Favored 'General case' 0 N--CA 1.482 1.13 0 CA-C-O 121.219 0.533 . . . . 0.0 111.163 177.327 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 45.3 m-85 -75.61 -35.68 60.47 Favored 'General case' 0 N--CA 1.475 0.807 0 CA-C-N 115.041 -0.981 . . . . 0.0 111.65 -178.65 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 17.4 tp10 -60.29 -47.05 87.65 Favored 'General case' 0 N--CA 1.473 0.68 0 C-N-CA 124.162 0.985 . . . . 0.0 111.613 -172.516 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 7.6 p -117.04 11.84 14.38 Favored 'General case' 0 CA--C 1.548 0.87 0 C-N-CA 123.999 0.919 . . . . 0.0 111.236 -179.583 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 27.2 mtpp 55.14 56.8 6.11 Favored 'General case' 0 N--CA 1.486 1.336 0 C-N-CA 125.241 1.416 . . . . 0.0 112.251 168.604 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 90' ' ' ARG . . . . . 0.491 ' HB2' HD12 ' A' ' 85' ' ' LEU . 11.7 mmm180 -73.26 -16.81 61.38 Favored 'General case' 0 N--CA 1.484 1.266 0 CA-C-N 115.163 -0.926 . . . . 0.0 111.864 -176.971 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 91' ' ' PHE . . . . . . . . . . . . . 3.4 p90 -69.08 144.26 53.99 Favored 'General case' 0 CA--C 1.544 0.747 0 CA-C-O 121.631 0.729 . . . . 0.0 111.865 -179.533 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 6.7 mtpm? . . . . . 0 C--O 1.247 0.941 0 C-N-CA 125.379 1.472 . . . . 0.0 108.78 170.675 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 20' ' ' MET . . . . . . . . . . . . . 25.9 ptt? . . . . . 0 N--CA 1.486 1.344 0 N-CA-C 109.991 -0.374 . . . . 0.0 109.991 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -69.88 89.39 0.58 Allowed 'General case' 0 CA--C 1.542 0.67 0 O-C-N 123.793 0.683 . . . . 0.0 110.22 174.364 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -161.33 15.56 0.1 Allowed 'General case' 0 N--CA 1.476 0.829 0 C-N-CA 124.339 1.056 . . . . 0.0 110.49 -177.291 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -157.11 125.94 5.82 Favored 'General case' 0 CA--C 1.537 0.457 0 C-N-CA 123.916 0.886 . . . . 0.0 109.255 -173.204 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 61.1 t -76.56 122.28 86.34 Favored Pre-proline 0 CA--C 1.546 0.825 0 C-N-CA 123.415 0.686 . . . . 0.0 109.646 178.506 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 90.7 Cg_endo -81.73 131.03 7.02 Favored 'Trans proline' 0 C--N 1.369 1.619 0 C-N-CA 122.636 2.224 . . . . 0.0 113.212 176.146 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 49.2 mt-30 -98.02 148.95 22.98 Favored 'General case' 0 C--O 1.245 0.827 0 N-CA-C 106.049 -1.834 . . . . 0.0 106.049 153.407 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -56.37 128.24 34.95 Favored 'General case' 0 CA--C 1.544 0.737 0 CA-C-O 120.867 0.365 . . . . 0.0 110.515 -178.13 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -85.72 -38.86 17.82 Favored 'General case' 0 N--CA 1.472 0.638 0 CA-C-N 115.841 -0.618 . . . . 0.0 109.372 179.127 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 29' ' ' TRP . . . . . . . . . . . . . 5.1 m-90 -137.34 154.54 50.02 Favored 'General case' 0 N--CA 1.476 0.828 0 C-N-CA 124.669 1.188 . . . . 0.0 108.636 178.649 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 77.2 p -85.82 173.16 10.22 Favored 'General case' 0 N--CA 1.477 0.901 0 N-CA-C 109.683 -0.488 . . . . 0.0 109.683 174.266 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 8.0 p -56.96 -40.8 74.8 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.139 0 C-N-CA 123.762 0.825 . . . . 0.0 111.766 -177.396 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 10.2 pt-20 -71.43 -37.51 71.43 Favored 'General case' 0 N--CA 1.476 0.835 0 C-N-CA 123.782 0.833 . . . . 0.0 111.563 179.377 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 49.9 mt-30 -66.33 -36.06 81.95 Favored 'General case' 0 N--CA 1.474 0.736 0 C-N-CA 123.023 0.529 . . . . 0.0 110.99 175.915 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.459 ' HB3' HG22 ' A' ' 79' ' ' VAL . 84.2 mt -65.05 -50.06 67.69 Favored 'General case' 0 N--CA 1.475 0.812 0 C-N-CA 123.21 0.604 . . . . 0.0 110.941 -179.788 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . 0.585 ' HA ' ' HD3' ' A' ' 75' ' ' LYS . 17.8 ptm180 -73.87 -14.89 61.15 Favored 'General case' 0 N--CA 1.477 0.923 0 CA-C-N 115.699 -0.682 . . . . 0.0 111.707 -178.325 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 47.7 t -56.56 129.46 40.96 Favored 'General case' 0 N--CA 1.478 0.944 0 C-N-CA 123.389 0.676 . . . . 0.0 111.043 179.242 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 33.5 mt-10 -67.67 -18.83 65.07 Favored 'General case' 0 N--CA 1.479 1.012 0 C-N-CA 124.353 1.061 . . . . 0.0 111.883 -177.659 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 13.7 mm100 -70.8 -28.29 64.54 Favored 'General case' 0 CA--C 1.542 0.645 0 C-N-CA 123.52 0.728 . . . . 0.0 111.309 175.406 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 4.6 tt -91.99 127.24 50.35 Favored Pre-proline 0 CA--C 1.561 1.38 0 N-CA-C 108.229 -1.026 . . . . 0.0 108.229 178.5 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 24.5 Cg_exo -68.8 -149.06 0.02 OUTLIER 'Trans proline' 0 C--N 1.378 2.117 0 C-N-CA 123.571 2.847 . . . . 0.0 113.524 171.512 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -122.83 -30.65 3.8 Favored 'General case' 0 N--CA 1.482 1.134 0 C-N-CA 123.526 0.731 . . . . 0.0 111.169 177.559 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . 0.526 ' HA ' HD12 ' A' ' 45' ' ' ILE . 19.3 pttp -61.03 -39.27 89.15 Favored 'General case' 0 N--CA 1.486 1.335 0 C-N-CA 123.899 0.88 . . . . 0.0 112.776 -171.799 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 15.4 p-10 -69.7 -32.75 71.52 Favored 'General case' 0 CA--C 1.544 0.735 0 C-N-CA 122.697 0.399 . . . . 0.0 111.372 176.678 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 42.3 mt -67.18 -44.1 88.02 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.357 0 C-N-CA 122.315 0.246 . . . . 0.0 110.343 176.378 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 45' ' ' ILE . . . . . 0.526 HD12 ' HA ' ' A' ' 42' ' ' LYS . 67.3 mt -55.33 -44.27 74.74 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.325 0 C-N-CA 123.506 0.722 . . . . 0.0 110.011 175.21 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 46' ' ' LYS . . . . . 0.429 ' O ' ' HB2' ' A' ' 50' ' ' GLU . 55.0 tttp -58.37 -44.63 88.94 Favored 'General case' 0 CA--C 1.542 0.67 0 O-C-N 124.213 0.946 . . . . 0.0 110.845 178.414 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 23.7 t80 -59.63 -49.47 77.63 Favored 'General case' 0 N--CA 1.483 1.218 0 O-C-N 123.773 0.671 . . . . 0.0 111.219 177.318 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 97.7 mt -70.0 -31.8 69.67 Favored 'General case' 0 CA--C 1.544 0.731 0 C-N-CA 123.579 0.752 . . . . 0.0 112.115 -174.472 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . 0.418 ' HA ' HD21 ' A' ' 57' ' ' LEU . 3.4 pt20 -84.23 -31.1 25.2 Favored 'General case' 0 N--CA 1.488 1.458 0 CA-C-N 117.711 0.232 . . . . 0.0 111.556 179.004 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . 0.429 ' HB2' ' O ' ' A' ' 46' ' ' LYS . 7.1 tp10 -63.9 -27.41 69.13 Favored 'General case' 0 N--CA 1.486 1.363 0 C-N-CA 124.168 0.987 . . . . 0.0 111.539 -175.576 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 52.0 m80 -120.95 -33.02 3.83 Favored 'General case' 0 N--CA 1.469 0.519 0 CA-C-N 115.072 -0.967 . . . . 0.0 111.422 -173.624 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -75.97 156.5 47.55 Favored Glycine 0 C--N 1.352 1.418 0 O-C-N 123.314 0.384 . . . . 0.0 113.597 -174.746 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 20.7 t -87.79 172.06 9.93 Favored 'General case' 0 N--CA 1.476 0.841 0 C-N-CA 123.583 0.753 . . . . 0.0 110.898 177.715 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 14.9 m-20 -60.27 -42.19 94.86 Favored 'General case' 0 N--CA 1.479 0.993 0 C-N-CA 124.436 1.094 . . . . 0.0 112.811 -171.206 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 32.9 t -70.42 -27.92 64.65 Favored 'General case' 0 N--CA 1.477 0.911 0 C-N-CA 123.299 0.64 . . . . 0.0 111.25 -176.545 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 56' ' ' PHE . . . . . 0.475 ' HD1' HH11 ' A' ' 90' ' ' ARG . 32.3 t80 -67.73 -46.22 72.79 Favored 'General case' 0 N--CA 1.482 1.155 0 CA-C-O 121.443 0.64 . . . . 0.0 110.085 174.149 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . 0.418 HD21 ' HA ' ' A' ' 49' ' ' GLN . 66.0 mt -69.97 -44.87 68.57 Favored 'General case' 0 CA--C 1.538 0.492 0 CA-C-N 114.81 -1.086 . . . . 0.0 110.577 -175.854 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -54.65 -24.44 21.62 Favored 'General case' 0 N--CA 1.484 1.26 0 C-N-CA 125.674 1.59 . . . . 0.0 113.399 -176.815 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 53.8 mt-10 -54.37 -51.35 65.08 Favored 'General case' 0 N--CA 1.482 1.144 0 C-N-CA 123.512 0.725 . . . . 0.0 111.354 -179.459 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 15.9 t60 -119.03 13.79 13.05 Favored 'General case' 0 N--CA 1.487 1.384 0 C-N-CA 122.697 0.399 . . . . 0.0 111.241 175.778 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 61.7 mttp 56.82 65.29 1.43 Allowed 'General case' 0 N--CA 1.478 0.931 0 C-N-CA 124.417 1.087 . . . . 0.0 111.175 -176.184 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 0.55 ' HA ' HG11 ' A' ' 69' ' ' VAL . 77.9 mt -86.24 -9.5 56.38 Favored 'General case' 0 N--CA 1.477 0.921 0 C-N-CA 123.972 0.909 . . . . 0.0 110.042 176.767 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 1.5 pp -80.43 156.06 26.8 Favored 'General case' 0 CA--C 1.545 0.783 0 C-N-CA 124.303 1.041 . . . . 0.0 110.781 177.201 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 90.03 -149.69 20.51 Favored Glycine 0 C--N 1.34 0.79 0 CA-C-N 115.696 -0.684 . . . . 0.0 112.732 178.327 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 65' ' ' ASN . . . . . 0.451 ' O ' HG23 ' A' ' 69' ' ' VAL . 82.3 m-20 -65.05 113.45 3.92 Favored 'General case' 0 N--CA 1.48 1.025 0 C-N-CA 123.927 0.891 . . . . 0.0 110.427 -177.001 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 70.4 mt -59.44 -42.92 89.24 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.125 0 C-N-CA 123.928 0.891 . . . . 0.0 110.605 -176.591 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 17.9 mtpp -55.61 -47.62 76.24 Favored 'General case' 0 CA--C 1.545 0.757 0 C-N-CA 124.063 0.945 . . . . 0.0 111.208 177.643 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 68' ' ' ASN . . . . . 0.52 ' O ' ' HG2' ' A' ' 71' ' ' LYS . 7.0 t30 -61.8 -42.83 99.5 Favored 'General case' 0 N--CA 1.479 0.984 0 C-N-CA 123.599 0.759 . . . . 0.0 111.336 176.068 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 69' ' ' VAL . . . . . 0.55 HG11 ' HA ' ' A' ' 62' ' ' LEU . 87.9 t -68.93 -30.13 45.76 Favored 'Isoleucine or valine' 0 CA--C 1.554 1.109 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.856 -178.988 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -65.82 -8.12 19.91 Favored 'General case' 0 N--CA 1.492 1.652 0 N-CA-C 114.363 1.246 . . . . 0.0 114.363 -173.929 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . 0.52 ' HG2' ' O ' ' A' ' 68' ' ' ASN . 64.7 pttt -91.54 -24.47 19.61 Favored 'General case' 0 N--CA 1.483 1.198 0 C-N-CA 122.88 0.472 . . . . 0.0 111.328 178.593 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 6.9 t -111.9 -27.94 8.25 Favored 'General case' 0 N--CA 1.474 0.772 0 C-N-CA 123.584 0.754 . . . . 0.0 110.996 -176.465 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . 0.467 ' HB1' HD21 ' A' ' 78' ' ' LEU . . . -73.39 85.28 1.48 Allowed 'General case' 0 C--O 1.243 0.756 0 N-CA-C 108.586 -0.894 . . . . 0.0 108.586 178.435 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 7.6 p30 -73.92 142.93 45.93 Favored 'General case' 0 C--O 1.239 0.529 0 CA-C-N 113.559 -1.655 . . . . 0.0 109.023 179.347 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . 0.585 ' HD3' ' HA ' ' A' ' 35' ' ' ARG . 40.4 ttmt -60.49 -34.16 73.65 Favored 'General case' 0 CA--C 1.538 0.492 0 C-N-CA 124.383 1.073 . . . . 0.0 111.419 -174.294 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 27.8 t70 -58.04 -39.91 79.58 Favored 'General case' 0 N--CA 1.472 0.671 0 C-N-CA 123.626 0.77 . . . . 0.0 111.175 177.922 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 73.6 t60 -71.21 -42.42 68.97 Favored 'General case' 0 C--O 1.213 -0.856 0 C-N-CA 123.633 0.773 . . . . 0.0 110.253 176.186 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . 0.467 HD21 ' HB1' ' A' ' 73' ' ' ALA . 98.2 mt -67.36 -31.21 71.3 Favored 'General case' 0 N--CA 1.483 1.187 0 N-CA-C 113.051 0.76 . . . . 0.0 113.051 -170.893 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 79' ' ' VAL . . . . . 0.459 HG22 ' HB3' ' A' ' 34' ' ' LEU . 60.0 t -71.58 -46.55 62.41 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.782 0 C-N-CA 123.407 0.683 . . . . 0.0 109.66 174.335 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 34.9 m -63.73 -32.38 73.86 Favored 'General case' 0 N--CA 1.477 0.877 0 CA-C-N 115.431 -0.804 . . . . 0.0 110.921 176.775 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -74.96 -37.52 61.93 Favored 'General case' 0 N--CA 1.473 0.713 0 C-N-CA 124.183 0.993 . . . . 0.0 110.358 179.639 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 82' ' ' TYR . . . . . . . . . . . . . 35.7 t80 -55.25 -55.22 33.87 Favored 'General case' 0 N--CA 1.472 0.673 0 C-N-CA 124.428 1.091 . . . . 0.0 109.954 173.676 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 83' ' ' ASN . . . . . . . . . . . . . 68.5 m-80 -64.59 -41.68 96.09 Favored 'General case' 0 N--CA 1.482 1.133 0 C-N-CA 122.639 0.376 . . . . 0.0 110.842 -178.396 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 16.6 t-160 -67.47 -27.45 67.03 Favored 'General case' 0 N--CA 1.485 1.28 0 C-N-CA 124.037 0.935 . . . . 0.0 110.787 -178.684 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -59.72 -53.05 62.53 Favored 'General case' 0 N--CA 1.48 1.075 0 C-N-CA 124.182 0.993 . . . . 0.0 109.822 -179.448 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 32.2 m-85 -74.08 -28.28 61.31 Favored 'General case' 0 CA--C 1.547 0.849 0 CA-C-N 114.22 -1.354 . . . . 0.0 111.462 -179.963 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 9.4 tm-20 -73.19 -26.76 61.29 Favored 'General case' 0 N--CA 1.48 1.058 0 C-N-CA 124.149 0.979 . . . . 0.0 111.498 -174.345 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 23.0 p -116.79 -7.16 11.51 Favored 'General case' 0 N--CA 1.479 0.98 0 C-N-CA 123.315 0.646 . . . . 0.0 111.403 178.05 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 41.5 mtmt 59.79 35.29 22.03 Favored 'General case' 0 N--CA 1.487 1.387 0 C-N-CA 124.197 0.999 . . . . 0.0 111.901 175.212 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 90' ' ' ARG . . . . . 0.475 HH11 ' HD1' ' A' ' 56' ' ' PHE . 99.4 mtt180 -62.91 -15.74 56.39 Favored 'General case' 0 N--CA 1.49 1.569 0 N-CA-C 113.562 0.949 . . . . 0.0 113.562 -173.26 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 91' ' ' PHE . . . . . . . . . . . . . 21.9 p90 -71.37 162.08 30.02 Favored 'General case' 0 C--N 1.321 -0.654 0 C-N-CA 123.722 0.809 . . . . 0.0 111.904 172.645 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 1.4 tmtp? . . . . . 0 C--O 1.243 0.734 0 N-CA-C 105.668 -1.975 . . . . 0.0 105.668 167.294 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 20' ' ' MET . . . . . . . . . . . . . 14.6 tpt . . . . . 0 N--CA 1.48 1.072 0 N-CA-C 110.325 -0.25 . . . . 0.0 110.325 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -73.85 91.17 1.95 Allowed 'General case' 0 N--CA 1.47 0.545 0 C-N-CA 123.186 0.594 . . . . 0.0 109.602 173.772 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -144.66 88.68 1.93 Allowed 'General case' 0 N--CA 1.468 0.46 0 C-N-CA 123.622 0.769 . . . . 0.0 109.598 -177.941 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -77.6 99.03 5.6 Favored 'General case' 0 N--CA 1.472 0.66 0 N-CA-C 109.289 -0.634 . . . . 0.0 109.289 178.918 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 31.0 m -64.86 132.24 95.4 Favored Pre-proline 0 CA--C 1.555 1.162 0 N-CA-C 109.865 -0.42 . . . . 0.0 109.865 176.568 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 73.8 Cg_endo -68.71 169.16 18.13 Favored 'Trans proline' 0 C--N 1.369 1.61 0 C-N-CA 122.842 2.361 . . . . 0.0 113.085 -173.598 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 29.6 pt20 -119.01 147.86 43.62 Favored 'General case' 0 C--O 1.245 0.827 0 CA-C-N 114.751 -1.113 . . . . 0.0 108.952 -178.941 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 36.0 ttp180 -72.3 108.0 5.2 Favored 'General case' 0 CA--C 1.534 0.334 0 N-CA-C 108.542 -0.91 . . . . 0.0 108.542 169.862 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -89.64 -18.02 27.29 Favored 'General case' 0 CA--C 1.543 0.703 0 CA-C-N 114.324 -1.307 . . . . 0.0 111.751 -172.498 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 29' ' ' TRP . . . . . . . . . . . . . 5.7 m-90 -130.51 139.25 50.51 Favored 'General case' 0 N--CA 1.473 0.718 0 C-N-CA 123.856 0.863 . . . . 0.0 109.792 -174.221 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 73.8 p -80.27 167.31 20.44 Favored 'General case' 0 C--O 1.242 0.702 0 N-CA-C 108.329 -0.989 . . . . 0.0 108.329 171.796 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . 0.579 ' HA ' HD12 ' A' ' 34' ' ' LEU . 9.5 p -62.81 -30.04 48.51 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.89 0 CA-C-N 117.572 0.169 . . . . 0.0 111.376 -174.946 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 9.9 pt-20 -68.76 -40.49 79.72 Favored 'General case' 0 C--N 1.359 0.981 0 C-N-CA 123.067 0.547 . . . . 0.0 110.706 175.185 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 52.6 mt-30 -64.14 -41.71 97.09 Favored 'General case' 0 N--CA 1.482 1.148 0 C-N-CA 123.002 0.521 . . . . 0.0 110.599 178.151 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.579 HD12 ' HA ' ' A' ' 31' ' ' VAL . 84.3 mt -60.29 -52.99 62.91 Favored 'General case' 0 N--CA 1.47 0.555 0 O-C-N 124.361 1.038 . . . . 0.0 111.219 -178.539 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 16.6 ptm180 -72.74 -23.19 60.81 Favored 'General case' 0 N--CA 1.475 0.818 0 O-C-N 124.418 1.074 . . . . 0.0 110.768 -175.876 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 24.7 t -63.19 123.3 18.28 Favored 'General case' 0 C--N 1.356 0.853 0 C-N-CA 123.032 0.533 . . . . 0.0 110.291 -177.788 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 12.0 pt-20 -65.01 -21.01 66.78 Favored 'General case' 0 N--CA 1.474 0.754 0 C-N-CA 123.858 0.863 . . . . 0.0 112.521 -177.653 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 94.8 mt-30 -68.56 -26.91 65.65 Favored 'General case' 0 CA--C 1.542 0.655 0 C-N-CA 123.749 0.82 . . . . 0.0 110.905 177.265 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 60.5 tp -83.14 117.97 70.23 Favored Pre-proline 0 N--CA 1.478 0.942 0 N-CA-C 108.363 -0.976 . . . . 0.0 108.363 169.511 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 40' ' ' PRO . . . . . 0.603 ' HB2' ' HG2' ' A' ' 42' ' ' LYS . 30.1 Cg_endo -64.01 141.23 76.21 Favored 'Trans proline' 0 C--N 1.376 2.004 0 C-N-CA 122.175 1.916 . . . . 0.0 112.254 176.414 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 50.5 mtmt -61.24 -32.68 72.47 Favored 'General case' 0 N--CA 1.474 0.748 0 C-N-CA 124.203 1.001 . . . . 0.0 111.026 178.832 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . 0.603 ' HG2' ' HB2' ' A' ' 40' ' ' PRO . 17.8 ptpt -65.99 -31.52 72.46 Favored 'General case' 0 N--CA 1.469 0.517 0 C-N-CA 123.858 0.863 . . . . 0.0 111.021 -179.568 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 43' ' ' ASP . . . . . 0.603 ' HB2' ' HG2' ' A' ' 40' ' ' PRO . 2.4 t70 -67.05 -38.05 85.13 Favored 'General case' 0 N--CA 1.481 1.089 0 N-CA-C 109.391 -0.596 . . . . 0.0 109.391 -178.246 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 44' ' ' ILE . . . . . 0.518 ' O ' ' HG ' ' A' ' 48' ' ' LEU . 23.6 mt -67.34 -53.93 28.3 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.765 0 CA-C-N 115.17 -0.923 . . . . 0.0 109.705 177.411 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 73.8 mt -60.09 -36.18 66.03 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.733 0 C-N-CA 123.655 0.782 . . . . 0.0 111.955 -178.453 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 33.8 ttpt -53.86 -45.19 70.91 Favored 'General case' 0 N--CA 1.48 1.052 0 C-N-CA 124.364 1.066 . . . . 0.0 110.479 174.314 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 31.9 t80 -67.51 -45.62 75.26 Favored 'General case' 0 CA--C 1.551 1.0 0 CA-C-N 114.353 -1.294 . . . . 0.0 111.442 177.384 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . 0.518 ' HG ' ' O ' ' A' ' 44' ' ' ILE . 73.9 mt -65.55 -34.25 77.81 Favored 'General case' 0 N--CA 1.477 0.923 0 C-N-CA 123.857 0.863 . . . . 0.0 111.673 -172.903 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . 0.464 ' HA ' HD21 ' A' ' 57' ' ' LEU . 3.4 pt20 -83.92 -28.03 28.16 Favored 'General case' 0 N--CA 1.481 1.081 0 C-N-CA 122.637 0.375 . . . . 0.0 110.766 176.004 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 11.5 tp10 -61.83 -48.91 78.47 Favored 'General case' 0 N--CA 1.482 1.134 0 C-N-CA 123.699 0.8 . . . . 0.0 110.73 179.1 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 1.1 m80 -140.59 22.86 2.32 Favored 'General case' 0 N--CA 1.482 1.135 0 N-CA-C 113.203 0.816 . . . . 0.0 113.203 -171.23 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -84.99 -144.18 6.76 Favored Glycine 0 CA--C 1.534 1.243 0 N-CA-C 109.375 -1.49 . . . . 0.0 109.375 157.467 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . 0.461 ' O ' ' HG ' ' A' ' 57' ' ' LEU . 28.1 t -149.67 162.68 39.75 Favored 'General case' 0 N--CA 1.478 0.932 0 CA-C-N 117.59 0.695 . . . . 0.0 109.847 174.77 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 4.0 p30 -52.48 -36.04 54.07 Favored 'General case' 0 N--CA 1.487 1.377 0 C-N-CA 124.485 1.114 . . . . 0.0 112.988 -174.424 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 20.4 m -70.69 -43.43 69.04 Favored 'General case' 0 CA--C 1.546 0.791 0 C-N-CA 123.706 0.802 . . . . 0.0 110.762 179.623 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 56' ' ' PHE . . . . . 0.42 ' HE2' ' HB3' ' A' ' 48' ' ' LEU . 66.2 t80 -60.41 -38.92 85.56 Favored 'General case' 0 N--CA 1.483 1.196 0 C-N-CA 124.16 0.984 . . . . 0.0 110.348 174.474 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . 0.464 HD21 ' HA ' ' A' ' 49' ' ' GLN . 51.6 mt -73.9 -32.49 63.6 Favored 'General case' 0 C--O 1.211 -0.936 0 CA-C-N 115.012 -0.994 . . . . 0.0 110.485 -178.983 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -69.92 -47.15 63.55 Favored 'General case' 0 N--CA 1.483 1.18 0 C-N-CA 123.334 0.654 . . . . 0.0 111.391 179.024 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 42.2 mt-10 -55.15 -47.11 75.58 Favored 'General case' 0 N--CA 1.486 1.364 0 C-N-CA 123.631 0.773 . . . . 0.0 111.003 179.196 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 28.6 m80 -107.76 4.68 25.88 Favored 'General case' 0 CA--C 1.543 0.705 0 CA-C-N 115.583 -0.735 . . . . 0.0 111.871 -170.088 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 48.9 mtmt 55.73 39.24 30.81 Favored 'General case' 0 N--CA 1.492 1.639 0 C-N-CA 123.91 0.884 . . . . 0.0 111.824 176.754 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 0.558 ' HA ' HG11 ' A' ' 69' ' ' VAL . 73.2 mt -88.12 -6.48 57.87 Favored 'General case' 0 N--CA 1.479 0.998 0 C-N-CA 123.93 0.892 . . . . 0.0 111.099 -179.723 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . 0.417 ' H ' ' HG ' ' A' ' 63' ' ' LEU . 1.8 pp -73.04 159.99 32.75 Favored 'General case' 0 N--CA 1.474 0.771 0 C-N-CA 124.011 0.924 . . . . 0.0 111.513 174.34 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 92.22 -168.46 31.1 Favored Glycine 0 CA--C 1.524 0.621 0 CA-C-N 115.518 -0.764 . . . . 0.0 112.682 179.729 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 16.1 m120 -62.37 126.15 26.35 Favored 'General case' 0 N--CA 1.478 0.948 0 C-N-CA 123.635 0.774 . . . . 0.0 109.831 -179.58 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 54.8 mt -57.09 -48.12 82.53 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.86 0 O-C-N 124.268 0.98 . . . . 0.0 112.434 -168.543 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 22.4 pttp -65.38 -31.55 72.72 Favored 'General case' 0 N--CA 1.482 1.159 0 C-N-CA 123.688 0.795 . . . . 0.0 111.575 -178.137 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 48.9 t30 -66.75 -41.77 87.26 Favored 'General case' 0 N--CA 1.481 1.121 0 C-N-CA 123.372 0.669 . . . . 0.0 109.862 176.458 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 69' ' ' VAL . . . . . 0.558 HG11 ' HA ' ' A' ' 62' ' ' LEU . 38.4 t -69.04 -34.57 64.56 Favored 'Isoleucine or valine' 0 C--O 1.212 -0.889 0 CA-C-N 115.03 -0.986 . . . . 0.0 109.644 175.31 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -75.37 -2.14 27.11 Favored 'General case' 0 N--CA 1.484 1.23 0 C-N-CA 123.683 0.793 . . . . 0.0 111.341 179.372 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 40.2 ttmt -95.06 -49.63 5.44 Favored 'General case' 0 CA--C 1.547 0.83 0 C-N-CA 123.554 0.742 . . . . 0.0 110.347 172.313 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 15.1 t -83.03 -33.63 26.44 Favored 'General case' 0 CA--C 1.555 1.167 0 C-N-CA 123.435 0.694 . . . . 0.0 111.955 -172.679 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -92.41 118.16 30.66 Favored 'General case' 0 N--CA 1.47 0.563 0 C-N-CA 123.972 0.909 . . . . 0.0 109.735 -179.452 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 74' ' ' ASN . . . . . 0.437 ' O ' ' HB3' ' A' ' 77' ' ' HIS . 24.0 p-10 -76.73 168.41 20.13 Favored 'General case' 0 N--CA 1.476 0.835 0 C-N-CA 123.173 0.589 . . . . 0.0 110.042 173.328 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . 0.416 ' HD3' ' O ' ' A' ' 34' ' ' LEU . 32.3 ttmt -71.99 -32.3 67.08 Favored 'General case' 0 CA--C 1.543 0.703 0 C-N-CA 122.78 0.432 . . . . 0.0 111.709 -175.184 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 33.9 t70 -60.74 -28.58 68.8 Favored 'General case' 0 N--CA 1.487 1.409 0 C-N-CA 123.283 0.633 . . . . 0.0 111.527 177.354 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 77' ' ' HIS . . . . . 0.474 ' HD2' HD23 ' A' ' 78' ' ' LEU . 42.1 t60 -71.2 -48.91 48.68 Favored 'General case' 0 CA--C 1.552 1.045 0 C-N-CA 125.055 1.342 . . . . 0.0 109.978 172.211 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . 0.474 HD23 ' HD2' ' A' ' 77' ' ' HIS . 77.6 mt -67.22 -45.79 75.76 Favored 'General case' 0 N--CA 1.487 1.408 0 N-CA-C 113.454 0.909 . . . . 0.0 113.454 -169.132 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 79' ' ' VAL . . . . . 0.524 HG22 ' HB3' ' A' ' 34' ' ' LEU . 61.9 t -59.53 -42.06 86.83 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.218 0 O-C-N 123.941 0.775 . . . . 0.0 110.207 -177.812 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 24.8 m -62.54 -44.41 96.4 Favored 'General case' 0 N--CA 1.476 0.847 0 CA-C-N 115.203 -0.908 . . . . 0.0 111.496 177.815 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -66.42 -39.35 88.89 Favored 'General case' 0 N--CA 1.48 1.041 0 C-N-CA 123.55 0.74 . . . . 0.0 110.7 -179.803 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 82' ' ' TYR . . . . . 0.455 ' CD2' HD11 ' A' ' 34' ' ' LEU . 86.6 t80 -63.13 -54.56 35.87 Favored 'General case' 0 N--CA 1.471 0.621 0 C-N-CA 124.387 1.075 . . . . 0.0 111.105 -177.328 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 83' ' ' ASN . . . . . . . . . . . . . 67.8 m-80 -68.71 -35.76 77.57 Favored 'General case' 0 N--CA 1.481 1.115 0 C-N-CA 123.055 0.542 . . . . 0.0 110.96 -177.492 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 37.9 t60 -63.97 -30.54 71.61 Favored 'General case' 0 N--CA 1.483 1.218 0 C-N-CA 123.859 0.863 . . . . 0.0 110.647 174.292 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 85' ' ' LEU . . . . . 0.408 ' HA ' ' HG2' ' A' ' 90' ' ' ARG . 1.5 tt -60.1 -51.93 67.53 Favored 'General case' 0 N--CA 1.479 1.018 0 C-N-CA 123.467 0.707 . . . . 0.0 109.522 -176.842 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 35.0 m-85 -73.11 -31.89 64.61 Favored 'General case' 0 N--CA 1.48 1.055 0 CA-C-N 115.499 -0.773 . . . . 0.0 110.991 -179.108 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 9.7 tp10 -60.68 -41.61 95.42 Favored 'General case' 0 N--CA 1.477 0.911 0 C-N-CA 124.345 1.058 . . . . 0.0 111.699 -177.114 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 12.2 p -120.32 3.73 10.81 Favored 'General case' 0 N--CA 1.477 0.916 0 C-N-CA 124.152 0.981 . . . . 0.0 111.779 -175.602 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 56.2 mtpt 53.85 70.17 0.63 Allowed 'General case' 0 N--CA 1.48 1.038 0 C-N-CA 124.673 1.189 . . . . 0.0 111.787 178.634 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 90' ' ' ARG . . . . . 0.408 ' HG2' ' HA ' ' A' ' 85' ' ' LEU . 26.3 mmm180 -80.12 14.33 1.93 Allowed 'General case' 0 N--CA 1.493 1.693 0 C-N-CA 124.241 1.016 . . . . 0.0 112.369 -179.722 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 91' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -65.15 163.25 15.4 Favored 'General case' 0 N--CA 1.479 1.012 0 C-N-CA 123.671 0.788 . . . . 0.0 110.839 -177.854 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 23.1 ttmm . . . . . 0 C--O 1.254 1.338 0 CA-C-N 115.256 -0.884 . . . . 0.0 109.287 174.952 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 20' ' ' MET . . . . . . . . . . . . . 25.8 ptt? . . . . . 0 N--CA 1.485 1.29 0 N-CA-C 111.112 0.042 . . . . 0.0 111.112 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -158.33 151.5 22.87 Favored 'General case' 0 N--CA 1.477 0.9 0 C-N-CA 123.849 0.859 . . . . 0.0 109.858 -178.22 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -100.32 137.88 38.15 Favored 'General case' 0 C--O 1.241 0.626 0 N-CA-C 109.513 -0.551 . . . . 0.0 109.513 174.784 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -72.13 88.38 1.11 Allowed 'General case' 0 N--CA 1.473 0.722 0 C-N-CA 123.435 0.694 . . . . 0.0 109.907 179.986 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 6.2 m -117.76 82.06 16.01 Favored Pre-proline 0 N--CA 1.477 0.886 0 C-N-CA 123.751 0.821 . . . . 0.0 109.902 -178.481 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 44.2 Cg_endo -72.25 128.83 14.21 Favored 'Trans proline' 0 C--N 1.37 1.71 0 C-N-CA 122.155 1.903 . . . . 0.0 111.061 179.583 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 51.6 mt-30 -74.84 178.11 5.76 Favored 'General case' 0 C--O 1.244 0.767 0 CA-C-N 115.578 -0.737 . . . . 0.0 109.178 167.309 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . 0.419 ' HD3' ' H ' ' A' ' 27' ' ' ARG . 0.0 OUTLIER -57.96 135.53 56.94 Favored 'General case' 0 CA--C 1.545 0.786 0 CA-C-O 121.128 0.49 . . . . 0.0 111.3 175.45 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -78.97 -34.56 44.13 Favored 'General case' 0 CA--C 1.535 0.39 0 N-CA-C 108.697 -0.853 . . . . 0.0 108.697 173.348 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 29' ' ' TRP . . . . . . . . . . . . . 4.7 m-90 -134.13 149.83 51.1 Favored 'General case' 0 N--CA 1.476 0.835 0 C-N-CA 124.679 1.192 . . . . 0.0 108.344 178.782 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 21.6 p -91.72 178.1 6.01 Favored 'General case' 0 N--CA 1.478 0.929 0 C-N-CA 122.814 0.446 . . . . 0.0 110.916 -178.482 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 7.2 p -54.34 -45.78 68.96 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.608 0 N-CA-C 113.441 0.904 . . . . 0.0 113.441 -169.873 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 1.3 pm0 -71.42 -31.3 67.07 Favored 'General case' 0 N--CA 1.476 0.843 0 C-N-CA 123.133 0.573 . . . . 0.0 111.447 179.305 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 23.4 mm-40 -71.28 -32.98 69.33 Favored 'General case' 0 N--CA 1.476 0.844 0 C-N-CA 123.139 0.576 . . . . 0.0 110.613 175.69 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 70.3 mt -81.34 -27.3 35.0 Favored 'General case' 0 N--CA 1.475 0.797 0 C-N-CA 123.79 0.836 . . . . 0.0 111.827 -176.25 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 3.6 ptm180 -82.68 -25.26 33.2 Favored 'General case' 0 N--CA 1.479 0.983 0 CA-C-O 119.669 -0.205 . . . . 0.0 110.829 169.715 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 37.1 t -59.94 125.33 23.23 Favored 'General case' 0 N--CA 1.486 1.36 0 C-N-CA 124.093 0.957 . . . . 0.0 112.111 -172.974 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 10.9 tp10 -65.46 -17.16 64.34 Favored 'General case' 0 CA--C 1.555 1.161 0 C-N-CA 124.487 1.115 . . . . 0.0 111.558 178.534 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 71.3 mt-30 -62.89 -38.59 91.51 Favored 'General case' 0 N--CA 1.476 0.869 0 C-N-CA 123.852 0.861 . . . . 0.0 110.418 173.377 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.512 HD12 ' HD2' ' A' ' 40' ' ' PRO . 51.4 tp -86.52 128.09 58.22 Favored Pre-proline 0 N--CA 1.482 1.134 0 C-N-CA 123.777 0.831 . . . . 0.0 110.016 177.573 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 40' ' ' PRO . . . . . 0.512 ' HD2' HD12 ' A' ' 39' ' ' LEU . 39.0 Cg_endo -70.14 134.26 26.78 Favored 'Trans proline' 0 C--N 1.379 2.144 0 C-N-CA 122.363 2.042 . . . . 0.0 112.318 173.168 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . 0.517 ' HB3' ' HD3' ' A' ' 75' ' ' LYS . 21.5 pttp -76.95 -20.01 56.65 Favored 'General case' 0 N--CA 1.48 1.051 0 N-CA-C 113.235 0.828 . . . . 0.0 113.235 -173.213 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . 0.567 ' HA ' HD12 ' A' ' 45' ' ' ILE . 60.1 pttt -63.77 -30.76 71.82 Favored 'General case' 0 N--CA 1.478 0.941 0 C-N-CA 122.966 0.507 . . . . 0.0 110.706 171.256 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -73.94 -26.25 60.4 Favored 'General case' 0 N--CA 1.479 0.996 0 C-N-CA 122.967 0.507 . . . . 0.0 111.596 177.692 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 39.3 mt -74.55 -43.99 47.75 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.971 0 N-CA-C 109.438 -0.578 . . . . 0.0 109.438 174.846 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 45' ' ' ILE . . . . . 0.567 HD12 ' HA ' ' A' ' 42' ' ' LYS . 77.9 mt -53.89 -46.85 64.57 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.165 0 C-N-CA 123.358 0.663 . . . . 0.0 109.314 172.119 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 29.0 ttpp -63.79 -39.37 94.1 Favored 'General case' 0 CA--C 1.538 0.519 0 CA-C-N 114.467 -1.242 . . . . 0.0 110.893 -177.948 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 26.5 t80 -64.64 -54.31 33.77 Favored 'General case' 0 N--CA 1.473 0.693 0 O-C-N 123.969 0.793 . . . . 0.0 110.623 177.13 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 95.8 mt -69.03 -29.69 67.91 Favored 'General case' 0 N--CA 1.474 0.726 0 C-N-CA 123.656 0.782 . . . . 0.0 111.846 -173.03 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 3.0 pt20 -79.45 -26.21 41.81 Favored 'General case' 0 N--CA 1.48 1.039 0 C-N-CA 122.222 0.209 . . . . 0.0 110.621 176.646 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 10.7 tp10 -61.23 -37.71 84.03 Favored 'General case' 0 N--CA 1.482 1.159 0 C-N-CA 123.679 0.791 . . . . 0.0 111.269 -179.477 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 31.2 p-80 -124.34 -32.21 3.2 Favored 'General case' 0 N--CA 1.485 1.32 0 N-CA-C 113.253 0.834 . . . . 0.0 113.253 -174.24 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -61.83 139.84 46.78 Favored Glycine 0 C--N 1.348 1.198 0 CA-C-N 118.221 0.464 . . . . 0.0 113.6 178.115 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . 0.472 ' O ' ' HG ' ' A' ' 57' ' ' LEU . 44.1 t -60.14 148.36 36.33 Favored 'General case' 0 N--CA 1.48 1.057 0 C-N-CA 123.582 0.753 . . . . 0.0 111.597 179.556 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 14.2 m-20 -61.52 -32.9 72.96 Favored 'General case' 0 N--CA 1.487 1.419 0 C-N-CA 123.65 0.78 . . . . 0.0 112.489 -174.181 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 21.5 m -67.42 -41.93 84.05 Favored 'General case' 0 CA--C 1.544 0.716 0 O-C-N 123.607 0.567 . . . . 0.0 110.402 177.827 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 56' ' ' PHE . . . . . 0.52 ' HB2' ' HD3' ' A' ' 90' ' ' ARG . 62.4 t80 -60.98 -43.9 98.14 Favored 'General case' 0 N--CA 1.477 0.882 0 C-N-CA 123.849 0.86 . . . . 0.0 109.934 174.027 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . 0.472 ' HG ' ' O ' ' A' ' 53' ' ' SER . 73.1 mt -64.53 -44.49 90.67 Favored 'General case' 0 C--O 1.209 -1.068 0 CA-C-N 115.097 -0.956 . . . . 0.0 110.491 -177.506 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -61.72 -45.28 94.64 Favored 'General case' 0 N--CA 1.482 1.138 0 C-N-CA 123.655 0.782 . . . . 0.0 111.393 -177.39 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 46.7 mt-10 -60.38 -36.58 78.39 Favored 'General case' 0 N--CA 1.482 1.168 0 C-N-CA 123.666 0.787 . . . . 0.0 112.006 177.668 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 53.2 m80 -105.11 6.82 33.51 Favored 'General case' 0 N--CA 1.487 1.393 0 C-N-CA 122.967 0.507 . . . . 0.0 112.132 -177.59 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 68.8 mmtt 59.96 27.22 16.57 Favored 'General case' 0 N--CA 1.488 1.436 0 C-N-CA 125.094 1.358 . . . . 0.0 112.981 175.65 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 70.1 mt -81.92 -21.51 37.3 Favored 'General case' 0 N--CA 1.483 1.198 0 C-N-CA 124.157 0.983 . . . . 0.0 112.669 -174.703 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -78.09 170.04 17.27 Favored 'General case' 0 N--CA 1.485 1.283 0 CA-C-O 120.809 0.337 . . . . 0.0 111.683 179.818 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 90.96 -157.55 25.23 Favored Glycine 0 C--N 1.341 0.848 0 CA-C-N 115.391 -0.822 . . . . 0.0 112.367 177.303 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 65' ' ' ASN . . . . . 0.402 ' O ' HG23 ' A' ' 69' ' ' VAL . 17.8 m120 -69.41 115.93 9.25 Favored 'General case' 0 N--CA 1.47 0.567 0 C-N-CA 123.62 0.768 . . . . 0.0 110.205 -179.437 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 65.7 mt -54.29 -50.35 57.11 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.967 0 C-N-CA 124.515 1.126 . . . . 0.0 112.187 -173.758 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 67' ' ' LYS . . . . . 0.501 ' H ' ' HD2' ' A' ' 67' ' ' LYS . 0.0 OUTLIER -60.92 -41.64 96.59 Favored 'General case' 0 N--CA 1.48 1.049 0 O-C-N 123.774 0.671 . . . . 0.0 109.661 -175.898 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 49.5 t30 -61.35 -47.82 84.11 Favored 'General case' 0 N--CA 1.479 1.008 0 CA-C-N 115.075 -0.966 . . . . 0.0 110.975 176.959 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 69' ' ' VAL . . . . . 0.402 HG23 ' O ' ' A' ' 65' ' ' ASN . 85.8 t -62.28 -32.35 54.57 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.099 0 C-N-CA 123.585 0.754 . . . . 0.0 110.732 178.676 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -70.69 8.02 0.97 Allowed 'General case' 0 CA--C 1.554 1.134 0 C-N-CA 123.738 0.815 . . . . 0.0 112.976 -178.453 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 16.5 ptpt -94.81 -27.4 15.78 Favored 'General case' 0 N--CA 1.484 1.255 0 CA-C-N 119.179 0.9 . . . . 0.0 110.824 169.69 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 10.2 t -109.23 -28.94 8.74 Favored 'General case' 0 N--CA 1.482 1.155 0 C-N-CA 123.732 0.813 . . . . 0.0 111.045 -175.207 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -80.62 86.36 5.89 Favored 'General case' 0 C--O 1.237 0.447 0 C-N-CA 123.511 0.724 . . . . 0.0 109.656 -178.66 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 3.9 p-10 -70.27 160.95 31.26 Favored 'General case' 0 C--O 1.239 0.538 0 CA-C-N 114.489 -1.232 . . . . 0.0 110.389 174.877 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . 0.517 ' HD3' ' HB3' ' A' ' 41' ' ' LYS . 13.3 tptm -61.19 -47.73 84.79 Favored 'General case' 0 N--CA 1.471 0.59 0 CA-C-N 115.712 -0.676 . . . . 0.0 111.3 -166.923 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 4.4 p30 -69.43 -29.94 67.76 Favored 'General case' 0 N--CA 1.485 1.3 0 CA-C-N 115.975 -0.557 . . . . 0.0 111.649 -176.304 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 74.5 t60 -59.83 -41.53 91.53 Favored 'General case' 0 N--CA 1.481 1.099 0 C-N-CA 123.883 0.873 . . . . 0.0 110.128 173.094 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . 0.452 ' CD1' ' HB2' ' A' ' 41' ' ' LYS . 83.5 mt -74.1 -28.95 61.6 Favored 'General case' 0 N--CA 1.47 0.533 0 CA-C-N 115.242 -0.89 . . . . 0.0 112.24 -176.92 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 79' ' ' VAL . . . . . 0.414 HG23 ' O ' ' A' ' 75' ' ' LYS . 21.3 t -73.73 -39.1 52.49 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.914 0 N-CA-C 109.732 -0.47 . . . . 0.0 109.732 173.553 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 29.2 m -67.5 -36.62 81.44 Favored 'General case' 0 N--CA 1.48 1.061 0 C-N-CA 122.895 0.478 . . . . 0.0 111.098 176.094 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -68.34 -39.65 81.84 Favored 'General case' 0 N--CA 1.473 0.688 0 C-N-CA 123.378 0.671 . . . . 0.0 109.955 175.663 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 82' ' ' TYR . . . . . . . . . . . . . 15.2 t80 -53.57 -58.86 5.67 Favored 'General case' 0 CA--C 1.542 0.65 0 CA-C-N 115.084 -0.962 . . . . 0.0 110.217 174.859 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 83' ' ' ASN . . . . . . . . . . . . . 49.4 m-80 -64.72 -31.19 72.3 Favored 'General case' 0 N--CA 1.481 1.112 0 C-N-CA 122.749 0.42 . . . . 0.0 111.501 -175.513 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 6.4 t60 -65.7 -45.66 81.91 Favored 'General case' 0 CA--C 1.549 0.938 0 C-N-CA 123.471 0.708 . . . . 0.0 110.267 178.218 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 85' ' ' LEU . . . . . 0.418 HD12 ' HB2' ' A' ' 90' ' ' ARG . 20.2 tp -57.13 -54.72 43.57 Favored 'General case' 0 N--CA 1.49 1.531 0 C-N-CA 123.701 0.8 . . . . 0.0 112.34 -172.691 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 83.0 m-85 -74.6 -21.73 59.32 Favored 'General case' 0 CA--C 1.543 0.697 0 CA-C-N 113.625 -1.625 . . . . 0.0 111.409 -174.519 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 7.9 tp10 -82.91 -10.84 58.62 Favored 'General case' 0 N--CA 1.478 0.96 0 C-N-CA 123.165 0.586 . . . . 0.0 111.601 178.524 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 31.4 p -125.5 -3.17 7.34 Favored 'General case' 0 N--CA 1.483 1.211 0 C-N-CA 123.617 0.767 . . . . 0.0 110.94 178.691 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 74.4 mmtt 61.04 23.84 13.99 Favored 'General case' 0 N--CA 1.486 1.359 0 C-N-CA 125.033 1.333 . . . . 0.0 113.125 174.052 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 90' ' ' ARG . . . . . 0.52 ' HD3' ' HB2' ' A' ' 56' ' ' PHE . 51.1 mtt180 -65.15 -18.87 65.67 Favored 'General case' 0 N--CA 1.491 1.605 0 N-CA-C 113.812 1.041 . . . . 0.0 113.812 -170.296 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 91' ' ' PHE . . . . . . . . . . . . . 24.6 p90 -59.68 145.65 44.08 Favored 'General case' 0 N--CA 1.476 0.841 0 C-N-CA 122.688 0.395 . . . . 0.0 111.571 177.56 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 14.1 mmmm . . . . . 0 CA--C 1.554 1.107 0 C-N-CA 124.736 1.214 . . . . 0.0 111.561 -167.27 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 20' ' ' MET . . . . . . . . . . . . . 12.5 tpt . . . . . 0 N--CA 1.484 1.243 0 N-CA-C 110.276 -0.268 . . . . 0.0 110.276 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -160.49 117.97 2.48 Favored 'General case' 0 C--O 1.245 0.858 0 C-N-CA 123.723 0.809 . . . . 0.0 109.648 178.502 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -72.14 82.71 0.99 Allowed 'General case' 0 N--CA 1.476 0.863 0 C-N-CA 123.759 0.824 . . . . 0.0 109.51 177.411 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -153.65 123.63 6.88 Favored 'General case' 0 CA--C 1.54 0.566 0 C-N-CA 124.643 1.177 . . . . 0.0 109.297 -173.599 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 35.4 m -102.02 138.97 19.91 Favored Pre-proline 0 N--CA 1.477 0.899 0 C-N-CA 123.211 0.604 . . . . 0.0 110.822 -179.06 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 25' ' ' PRO . . . . . 0.425 ' HD2' ' NH2' ' A' ' 27' ' ' ARG . 56.3 Cg_endo -82.43 160.54 17.2 Favored 'Trans proline' 0 C--N 1.371 1.76 0 C-N-CA 122.909 2.406 . . . . 0.0 111.987 176.886 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 27.1 mt-30 -90.98 61.86 4.74 Favored 'General case' 0 C--O 1.244 0.79 0 N-CA-C 109.484 -0.562 . . . . 0.0 109.484 173.793 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . 0.425 ' NH2' ' HD2' ' A' ' 25' ' ' PRO . 0.7 OUTLIER -64.08 138.76 58.61 Favored 'General case' 0 CA--C 1.547 0.858 0 N-CA-C 108.341 -0.985 . . . . 0.0 108.341 176.639 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -128.9 -17.57 3.94 Favored 'General case' 0 N--CA 1.482 1.169 0 N-CA-C 112.543 0.572 . . . . 0.0 112.543 -167.537 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 29' ' ' TRP . . . . . . . . . . . . . 2.1 m-90 -126.27 138.1 53.57 Favored 'General case' 0 N--CA 1.481 1.101 0 C-N-CA 122.606 0.362 . . . . 0.0 110.143 -167.765 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 8.4 m -81.83 161.95 23.02 Favored 'General case' 0 CA--C 1.549 0.935 0 N-CA-C 108.191 -1.04 . . . . 0.0 108.191 171.353 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . 0.556 ' HA ' HD12 ' A' ' 34' ' ' LEU . 60.1 t -57.48 -33.3 43.95 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.485 0 C-N-CA 123.003 0.521 . . . . 0.0 110.74 -177.483 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 12.0 pt-20 -68.07 -38.56 82.53 Favored 'General case' 0 N--CA 1.478 0.97 0 C-N-CA 124.558 1.143 . . . . 0.0 111.83 176.026 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 43.2 mt-30 -65.49 -37.76 87.76 Favored 'General case' 0 N--CA 1.48 1.044 0 C-N-CA 122.54 0.336 . . . . 0.0 110.467 176.552 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.556 HD12 ' HA ' ' A' ' 31' ' ' VAL . 72.9 mt -65.15 -56.45 12.83 Favored 'General case' 0 C--N 1.347 0.492 0 O-C-N 123.969 0.793 . . . . 0.0 110.233 -178.516 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 40.2 ptt180 -65.01 -24.47 67.51 Favored 'General case' 0 N--CA 1.481 1.1 0 CA-C-N 115.331 -0.85 . . . . 0.0 111.194 -173.517 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 33.6 t -65.39 116.09 6.33 Favored 'General case' 0 C--O 1.24 0.582 0 N-CA-C 108.599 -0.889 . . . . 0.0 108.599 173.408 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 5.2 tp10 -73.76 -7.01 50.48 Favored 'General case' 0 CA--C 1.553 1.065 0 C-N-CA 123.189 0.596 . . . . 0.0 110.844 -174.668 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 70.8 mt-30 -55.28 -39.29 69.66 Favored 'General case' 0 N--CA 1.479 0.986 0 C-N-CA 124.417 1.087 . . . . 0.0 110.049 167.801 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 3.6 tt -78.88 124.8 84.82 Favored Pre-proline 0 CA--C 1.557 1.221 0 N-CA-C 107.926 -1.139 . . . . 0.0 107.926 173.961 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 40.9 Cg_exo -59.49 -178.54 0.16 Allowed 'Trans proline' 0 C--N 1.379 2.167 0 C-N-CA 123.475 2.783 . . . . 0.0 113.98 171.36 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 52.0 mtmt -106.16 -20.15 13.49 Favored 'General case' 0 N--CA 1.473 0.697 0 CA-C-N 115.901 -0.591 . . . . 0.0 110.808 178.686 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 18.9 ptpt -62.08 -47.21 85.66 Favored 'General case' 0 N--CA 1.474 0.769 0 C-N-CA 123.726 0.811 . . . . 0.0 112.089 -174.764 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 43' ' ' ASP . . . . . 0.525 ' HA ' ' HE2' ' A' ' 46' ' ' LYS . 9.4 p-10 -73.86 -27.95 61.34 Favored 'General case' 0 N--CA 1.472 0.625 0 CA-C-N 116.07 -0.514 . . . . 0.0 111.907 -174.256 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 32.6 mt -68.66 -56.08 13.58 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.944 0 N-CA-C 109.735 -0.469 . . . . 0.0 109.735 175.88 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 79.9 mt -54.77 -38.47 43.96 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.544 0 C-N-CA 123.558 0.743 . . . . 0.0 110.654 175.812 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 46' ' ' LYS . . . . . 0.525 ' HE2' ' HA ' ' A' ' 43' ' ' ASP . 38.6 ttpt -62.63 -45.56 92.28 Favored 'General case' 0 N--CA 1.48 1.054 0 C-N-CA 124.092 0.957 . . . . 0.0 111.721 179.602 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 47' ' ' PHE . . . . . 0.465 ' HE2' ' HZ ' ' A' ' 86' ' ' PHE . 24.3 t80 -66.72 -44.51 81.39 Favored 'General case' 0 N--CA 1.476 0.852 0 CA-C-N 115.719 -0.673 . . . . 0.0 111.295 179.808 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 83.6 mt -71.04 -30.3 66.45 Favored 'General case' 0 CA--C 1.539 0.526 0 CA-C-N 115.516 -0.765 . . . . 0.0 111.2 -175.435 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . 0.498 ' HA ' HD21 ' A' ' 57' ' ' LEU . 2.9 pt20 -81.44 -26.76 35.05 Favored 'General case' 0 N--CA 1.479 1.014 0 O-C-N 123.245 0.34 . . . . 0.0 110.764 175.638 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 10.8 tp10 -62.29 -43.4 98.92 Favored 'General case' 0 N--CA 1.477 0.878 0 C-N-CA 123.611 0.764 . . . . 0.0 110.95 179.196 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 0.7 OUTLIER -107.66 -36.17 6.51 Favored 'General case' 0 N--CA 1.476 0.836 0 CA-C-N 115.94 -0.573 . . . . 0.0 111.682 -171.167 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . 0.557 ' HA2' ' HA ' ' A' ' 91' ' ' PHE . . . -61.85 143.62 48.71 Favored Glycine 0 C--N 1.353 1.508 0 N-CA-C 114.431 0.532 . . . . 0.0 114.431 -177.757 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . 0.403 ' O ' ' HG ' ' A' ' 57' ' ' LEU . 92.4 p -78.74 174.7 11.17 Favored 'General case' 0 N--CA 1.485 1.321 0 C-N-CA 123.908 0.883 . . . . 0.0 111.217 -179.081 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 6.8 m-20 -57.24 -44.44 83.85 Favored 'General case' 0 N--CA 1.491 1.585 0 C-N-CA 123.494 0.718 . . . . 0.0 110.95 179.815 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 39.5 t -63.48 -32.68 74.19 Favored 'General case' 0 CA--C 1.548 0.896 0 CA-C-N 115.13 -0.941 . . . . 0.0 111.579 -179.119 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 56' ' ' PHE . . . . . 0.401 ' HB2' ' HB3' ' A' ' 90' ' ' ARG . 54.7 t80 -74.27 -48.88 25.78 Favored 'General case' 0 N--CA 1.477 0.887 0 CA-C-O 120.864 0.364 . . . . 0.0 110.53 175.741 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . 0.498 HD21 ' HA ' ' A' ' 49' ' ' GLN . 37.2 mt -70.11 -36.64 74.99 Favored 'General case' 0 N--CA 1.478 0.941 0 CA-C-N 115.427 -0.806 . . . . 0.0 112.398 -169.296 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -71.03 -49.83 40.71 Favored 'General case' 0 N--CA 1.474 0.729 0 C-N-CA 122.919 0.488 . . . . 0.0 111.106 -179.717 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 39.2 mm-40 -69.25 -20.69 63.94 Favored 'General case' 0 N--CA 1.478 0.97 0 N-CA-C 112.745 0.646 . . . . 0.0 112.745 -179.164 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 62.8 m80 -108.77 -3.2 17.95 Favored 'General case' 0 N--CA 1.483 1.213 0 C-N-CA 123.1 0.56 . . . . 0.0 111.459 176.791 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 50.5 mtmt 59.46 28.36 17.72 Favored 'General case' 0 N--CA 1.495 1.79 0 C-N-CA 124.369 1.068 . . . . 0.0 112.732 174.5 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 0.508 HD11 ' HB1' ' A' ' 81' ' ' ALA . 87.3 mt -88.98 -7.46 55.96 Favored 'General case' 0 N--CA 1.486 1.364 0 C-N-CA 123.776 0.831 . . . . 0.0 112.373 -174.232 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 2.2 pp -78.3 176.72 9.04 Favored 'General case' 0 N--CA 1.479 0.985 0 C-N-CA 123.029 0.532 . . . . 0.0 110.952 177.135 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 78.32 -162.13 49.29 Favored Glycine 0 CA--C 1.526 0.724 0 CA-C-N 115.685 -0.689 . . . . 0.0 113.505 176.816 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 65' ' ' ASN . . . . . 0.414 HD22 ' N ' ' A' ' 65' ' ' ASN . 0.8 OUTLIER -64.6 113.38 3.68 Favored 'General case' 0 N--CA 1.477 0.921 0 C-N-CA 123.524 0.73 . . . . 0.0 109.185 -179.621 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 82.4 mt -54.6 -47.45 72.28 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.947 0 O-C-N 124.123 0.89 . . . . 0.0 111.775 -173.77 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -65.68 -30.29 70.96 Favored 'General case' 0 N--CA 1.483 1.186 0 N-CA-C 111.999 0.37 . . . . 0.0 111.999 -177.494 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 68' ' ' ASN . . . . . 0.493 ' O ' ' HG2' ' A' ' 71' ' ' LYS . 60.0 t30 -73.57 -34.58 65.19 Favored 'General case' 0 N--CA 1.483 1.188 0 C-N-CA 123.356 0.662 . . . . 0.0 110.268 178.141 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 67.1 t -72.94 -34.13 45.3 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.875 0 CA-C-N 115.536 -0.756 . . . . 0.0 110.082 172.247 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -75.75 1.86 13.67 Favored 'General case' 0 N--CA 1.484 1.242 0 C-N-CA 124.112 0.965 . . . . 0.0 112.953 -175.481 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . 0.493 ' HG2' ' O ' ' A' ' 68' ' ' ASN . 18.0 ptpt -94.7 -17.92 21.78 Favored 'General case' 0 N--CA 1.482 1.166 0 CA-C-N 118.186 0.448 . . . . 0.0 110.666 172.891 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 14.1 t -129.09 -12.98 4.58 Favored 'General case' 0 CA--C 1.547 0.84 0 C-N-CA 123.356 0.662 . . . . 0.0 111.861 -169.707 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -99.87 98.29 9.09 Favored 'General case' 0 N--CA 1.472 0.645 0 N-CA-C 107.999 -1.111 . . . . 0.0 107.999 174.863 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 26.6 p-10 -71.33 169.69 14.72 Favored 'General case' 0 N--CA 1.48 1.039 0 O-C-N 123.331 0.395 . . . . 0.0 110.388 -178.546 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . 0.48 ' O ' HG23 ' A' ' 79' ' ' VAL . 3.4 tppp? -61.46 -40.47 94.62 Favored 'General case' 0 CA--C 1.545 0.755 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.911 -175.81 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 23.2 m-20 -58.13 -41.11 82.97 Favored 'General case' 0 N--CA 1.486 1.374 0 C-N-CA 123.485 0.714 . . . . 0.0 111.473 -179.977 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 75.3 t60 -61.44 -40.45 94.52 Favored 'General case' 0 N--CA 1.479 0.993 0 C-N-CA 124.047 0.939 . . . . 0.0 110.827 175.72 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 58.3 mt -75.77 -28.44 58.44 Favored 'General case' 0 N--CA 1.48 1.034 0 C-N-CA 123.234 0.614 . . . . 0.0 112.54 -176.037 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 79' ' ' VAL . . . . . 0.48 HG23 ' O ' ' A' ' 75' ' ' LYS . 61.5 t -67.54 -48.27 77.47 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.704 0 N-CA-C 108.703 -0.851 . . . . 0.0 108.703 172.76 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 53.7 m -60.56 -39.96 89.9 Favored 'General case' 0 CA--C 1.542 0.659 0 CA-C-N 114.828 -1.078 . . . . 0.0 111.124 177.453 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 81' ' ' ALA . . . . . 0.508 ' HB1' HD11 ' A' ' 62' ' ' LEU . . . -70.12 -42.72 72.26 Favored 'General case' 0 CA--C 1.542 0.637 0 C-N-CA 123.049 0.54 . . . . 0.0 111.588 -178.9 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 82' ' ' TYR . . . . . 0.554 ' CD2' HD11 ' A' ' 34' ' ' LEU . 90.2 t80 -62.89 -55.89 22.1 Favored 'General case' 0 N--CA 1.479 0.995 0 C-N-CA 123.982 0.913 . . . . 0.0 110.797 -179.067 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 83' ' ' ASN . . . . . . . . . . . . . 60.8 m-80 -65.1 -46.98 78.83 Favored 'General case' 0 N--CA 1.48 1.041 0 C-N-CA 122.714 0.406 . . . . 0.0 111.589 -175.846 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 26.3 m-70 -67.04 -23.99 65.95 Favored 'General case' 0 N--CA 1.482 1.16 0 C-N-CA 123.511 0.724 . . . . 0.0 112.086 -179.121 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 21.1 tp -59.11 -54.44 47.02 Favored 'General case' 0 N--CA 1.483 1.182 0 CA-C-O 121.205 0.526 . . . . 0.0 110.553 177.5 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 86' ' ' PHE . . . . . 0.465 ' HZ ' ' HE2' ' A' ' 47' ' ' PHE . 6.3 m-85 -75.36 -29.75 60.01 Favored 'General case' 0 N--CA 1.471 0.586 0 CA-C-N 114.242 -1.344 . . . . 0.0 110.874 -176.1 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 22.8 tt0 -54.78 -40.31 69.3 Favored 'General case' 0 N--CA 1.481 1.12 0 C-N-CA 124.732 1.213 . . . . 0.0 111.105 176.378 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 40.7 p -111.62 -7.3 14.28 Favored 'General case' 0 CA--C 1.544 0.719 0 C-N-CA 124.279 1.031 . . . . 0.0 111.381 -176.634 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 8.5 mtpm? 52.84 43.26 31.74 Favored 'General case' 0 N--CA 1.481 1.11 0 C-N-CA 124.778 1.231 . . . . 0.0 111.91 -177.812 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 90' ' ' ARG . . . . . 0.401 ' HB3' ' HB2' ' A' ' 56' ' ' PHE . 94.1 mtt180 -69.59 -9.01 52.29 Favored 'General case' 0 N--CA 1.49 1.528 0 C-N-CA 123.746 0.818 . . . . 0.0 113.004 179.845 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 91' ' ' PHE . . . . . 0.557 ' HA ' ' HA2' ' A' ' 52' ' ' GLY . 21.1 p90 -65.95 133.94 51.91 Favored 'General case' 0 CA--C 1.546 0.79 0 CA-C-O 120.973 0.416 . . . . 0.0 111.492 174.084 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 61.3 tttp . . . . . 0 C--O 1.252 1.216 0 CA-C-N 115.322 -0.853 . . . . 0.0 108.854 173.599 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 20' ' ' MET . . . . . . . . . . . . . 55.2 tpp . . . . . 0 N--CA 1.478 0.937 0 N-CA-C 109.459 -0.571 . . . . 0.0 109.459 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -80.77 93.91 6.31 Favored 'General case' 0 C--O 1.236 0.39 0 N-CA-C 107.772 -1.195 . . . . 0.0 107.772 170.817 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -92.35 15.35 14.07 Favored 'General case' 0 N--CA 1.476 0.875 0 C-N-CA 124.197 0.999 . . . . 0.0 112.066 -174.695 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -83.32 59.19 4.89 Favored 'General case' 0 N--CA 1.48 1.057 0 CA-C-O 121.703 0.763 . . . . 0.0 109.776 176.533 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 35.5 m -82.16 131.83 55.18 Favored Pre-proline 0 CA--C 1.546 0.803 0 CA-C-N 115.039 -0.982 . . . . 0.0 109.799 -176.289 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 25' ' ' PRO . . . . . 0.414 ' HB2' ' HE1' ' A' ' 86' ' ' PHE . 73.5 Cg_endo -74.64 97.28 1.04 Allowed 'Trans proline' 0 C--N 1.37 1.7 0 C-N-CA 122.408 2.072 . . . . 0.0 112.32 -179.772 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 89.4 mt-30 -75.6 88.66 2.73 Favored 'General case' 0 C--O 1.238 0.451 0 N-CA-C 106.415 -1.698 . . . . 0.0 106.415 169.913 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . 0.508 ' HB2' ' OH ' ' A' ' 82' ' ' TYR . 0.0 OUTLIER -55.76 126.34 25.13 Favored 'General case' 0 C--N 1.353 0.758 0 O-C-N 124.115 0.885 . . . . 0.0 110.918 -172.261 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -91.39 -34.96 14.66 Favored 'General case' 0 N--CA 1.469 0.525 0 CA-C-N 115.099 -0.955 . . . . 0.0 111.436 -169.222 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 29' ' ' TRP . . . . . . . . . . . . . 4.4 m-90 -115.17 149.86 36.98 Favored 'General case' 0 N--CA 1.469 0.48 0 CA-C-N 115.51 -0.768 . . . . 0.0 111.433 -169.443 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 80.8 p -90.74 168.98 11.35 Favored 'General case' 0 CA--C 1.54 0.574 0 CA-C-N 115.275 -0.875 . . . . 0.0 109.223 172.512 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . 0.585 ' HA ' HD12 ' A' ' 34' ' ' LEU . 2.6 p -52.17 -41.66 33.8 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.416 0 C-N-CA 123.737 0.815 . . . . 0.0 112.633 -177.214 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 12.7 pt-20 -73.77 -36.44 65.09 Favored 'General case' 0 N--CA 1.478 0.961 0 C-N-CA 124.135 0.974 . . . . 0.0 112.111 -178.398 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 52.7 mt-30 -61.1 -38.58 86.82 Favored 'General case' 0 N--CA 1.49 1.538 0 C-N-CA 122.705 0.402 . . . . 0.0 110.101 175.267 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.585 HD12 ' HA ' ' A' ' 31' ' ' VAL . 36.1 mt -63.03 -41.32 99.5 Favored 'General case' 0 N--CA 1.473 0.699 0 CA-C-N 115.466 -0.788 . . . . 0.0 110.626 178.266 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 32.5 mtp180 -70.44 -30.31 67.13 Favored 'General case' 0 N--CA 1.478 0.939 0 C-N-CA 123.352 0.661 . . . . 0.0 111.518 -179.636 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 34.0 t -66.13 114.07 4.98 Favored 'General case' 0 N--CA 1.473 0.715 0 C-N-CA 123.308 0.643 . . . . 0.0 110.41 -179.949 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 41.0 mt-10 -73.32 -10.98 60.32 Favored 'General case' 0 CA--C 1.55 0.951 0 C-N-CA 123.454 0.702 . . . . 0.0 112.297 -176.642 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 79.1 mm-40 -55.57 -37.81 68.51 Favored 'General case' 0 N--CA 1.488 1.428 0 C-N-CA 123.695 0.798 . . . . 0.0 109.703 166.257 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 4.8 tt -78.44 128.87 76.42 Favored Pre-proline 0 CA--C 1.553 1.065 0 N-CA-C 107.329 -1.36 . . . . 0.0 107.329 170.746 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 47.5 Cg_exo -60.2 172.55 2.41 Favored 'Trans proline' 0 C--N 1.373 1.844 0 C-N-CA 123.259 2.639 . . . . 0.0 114.63 176.464 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 55.9 mtmt -93.36 -32.17 14.37 Favored 'General case' 0 N--CA 1.475 0.786 0 C-N-CA 123.662 0.785 . . . . 0.0 110.706 173.213 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 21.3 ptmt -63.83 -41.39 97.85 Favored 'General case' 0 CA--C 1.545 0.761 0 C-N-CA 123.911 0.884 . . . . 0.0 112.475 -172.801 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 30.4 p-10 -71.2 -32.37 68.76 Favored 'General case' 0 N--CA 1.481 1.103 0 C-N-CA 123.142 0.577 . . . . 0.0 111.912 -175.753 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 33.5 mt -68.85 -48.87 68.39 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.198 0 N-CA-C 109.982 -0.377 . . . . 0.0 109.982 176.079 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 79.6 mt -60.71 -39.97 83.34 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.364 0 C-N-CA 123.102 0.561 . . . . 0.0 110.938 178.005 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 84.7 tttt -62.76 -44.21 96.79 Favored 'General case' 0 CA--C 1.544 0.735 0 CA-C-N 115.436 -0.802 . . . . 0.0 110.784 177.788 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 1.0 OUTLIER -57.94 -52.08 66.99 Favored 'General case' 0 N--CA 1.484 1.256 0 O-C-N 124.248 0.967 . . . . 0.0 109.324 177.518 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . 0.492 HD21 ' HA ' ' A' ' 82' ' ' TYR . 96.3 mt -67.4 -31.6 71.92 Favored 'General case' 0 N--CA 1.471 0.612 0 CA-C-N 114.906 -1.043 . . . . 0.0 113.052 -174.732 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . 0.551 ' HA ' HD21 ' A' ' 57' ' ' LEU . 3.4 pt20 -84.18 -27.4 28.08 Favored 'General case' 0 N--CA 1.482 1.162 0 CA-C-N 117.886 0.312 . . . . 0.0 111.359 178.483 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 40.3 tt0 -75.19 -36.83 61.4 Favored 'General case' 0 N--CA 1.474 0.754 0 C-N-CA 123.387 0.675 . . . . 0.0 111.346 179.611 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 69.1 m80 -107.87 -35.46 6.64 Favored 'General case' 0 N--CA 1.476 0.855 0 CA-C-N 115.562 -0.745 . . . . 0.0 112.06 -173.163 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -66.67 172.89 27.4 Favored Glycine 0 CA--C 1.528 0.883 0 CA-C-N 117.691 0.223 . . . . 0.0 113.346 176.314 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . 0.458 ' O ' ' HG ' ' A' ' 57' ' ' LEU . 64.0 p -94.32 161.42 14.25 Favored 'General case' 0 N--CA 1.48 1.033 0 C-N-CA 123.154 0.582 . . . . 0.0 109.825 176.514 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 5.1 p-10 -63.26 -34.27 77.31 Favored 'General case' 0 N--CA 1.485 1.283 0 C-N-CA 122.897 0.479 . . . . 0.0 111.757 -176.384 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 23.1 t -67.86 -39.6 83.75 Favored 'General case' 0 N--CA 1.481 1.076 0 C-N-CA 123.619 0.768 . . . . 0.0 110.44 177.821 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 47.7 t80 -59.78 -37.66 79.68 Favored 'General case' 0 N--CA 1.483 1.208 0 C-N-CA 124.191 0.996 . . . . 0.0 110.161 172.972 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . 0.551 HD21 ' HA ' ' A' ' 49' ' ' GLN . 49.0 mt -74.9 -39.01 61.71 Favored 'General case' 0 C--O 1.216 -0.684 0 CA-C-N 115.836 -0.62 . . . . 0.0 112.012 -177.911 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -66.89 -46.74 73.97 Favored 'General case' 0 N--CA 1.481 1.086 0 CA-C-O 121.344 0.592 . . . . 0.0 110.435 -178.444 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 43.4 mt-10 -66.2 -26.11 67.24 Favored 'General case' 0 CA--C 1.55 0.954 0 CA-C-N 114.939 -1.028 . . . . 0.0 112.264 178.942 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 33.1 m80 -116.7 9.18 13.96 Favored 'General case' 0 N--CA 1.493 1.691 0 N-CA-C 112.888 0.699 . . . . 0.0 112.888 -178.862 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 34.1 mmtp 57.81 26.57 13.34 Favored 'General case' 0 N--CA 1.498 1.934 0 C-N-CA 124.224 1.01 . . . . 0.0 113.34 173.11 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 0.425 HD11 ' HB1' ' A' ' 81' ' ' ALA . 73.1 mt -87.36 -9.67 54.19 Favored 'General case' 0 N--CA 1.485 1.303 0 C-N-CA 123.72 0.808 . . . . 0.0 112.187 -176.379 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 1.8 pp -80.13 165.85 22.06 Favored 'General case' 0 N--CA 1.479 0.99 0 C-N-CA 122.725 0.41 . . . . 0.0 111.002 175.923 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 92.9 -162.32 26.25 Favored Glycine 0 C--N 1.339 0.729 0 CA-C-N 115.307 -0.861 . . . . 0.0 111.891 -178.877 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 65' ' ' ASN . . . . . 0.446 ' O ' HG23 ' A' ' 69' ' ' VAL . 28.6 t-20 -69.77 122.25 18.83 Favored 'General case' 0 N--CA 1.467 0.401 0 N-CA-C 109.564 -0.532 . . . . 0.0 109.564 -178.921 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 62.6 mt -60.57 -44.6 97.07 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.376 0 C-N-CA 124.19 0.996 . . . . 0.0 111.305 -169.904 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 41.1 mtpt -57.31 -43.07 82.95 Favored 'General case' 0 CA--C 1.548 0.899 0 C-N-CA 124.495 1.118 . . . . 0.0 111.118 177.201 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 68' ' ' ASN . . . . . 0.452 ' O ' ' HG2' ' A' ' 71' ' ' LYS . 5.9 t30 -72.87 -29.86 63.52 Favored 'General case' 0 CA--C 1.55 0.964 0 CA-C-N 115.31 -0.859 . . . . 0.0 111.09 -178.857 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 69' ' ' VAL . . . . . 0.446 HG23 ' O ' ' A' ' 65' ' ' ASN . 57.7 t -72.11 -39.1 64.98 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.058 0 N-CA-C 109.798 -0.445 . . . . 0.0 109.798 173.527 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -71.18 -8.38 53.14 Favored 'General case' 0 N--CA 1.479 1.011 0 C-N-CA 124.145 0.978 . . . . 0.0 112.903 -175.272 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . 0.452 ' HG2' ' O ' ' A' ' 68' ' ' ASN . 53.1 pttt -88.38 -19.93 25.97 Favored 'General case' 0 N--CA 1.481 1.089 0 CA-C-N 117.872 0.305 . . . . 0.0 110.51 177.781 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 10.3 t -128.85 -13.76 4.6 Favored 'General case' 0 N--CA 1.478 0.932 0 C-N-CA 123.587 0.755 . . . . 0.0 111.862 -167.716 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -103.81 100.99 10.8 Favored 'General case' 0 N--CA 1.469 0.508 0 N-CA-C 107.514 -1.291 . . . . 0.0 107.514 175.336 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 25.6 p-10 -71.04 174.2 6.56 Favored 'General case' 0 N--CA 1.478 0.965 0 C-N-CA 122.884 0.474 . . . . 0.0 111.113 -173.249 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . 0.477 ' O ' HG23 ' A' ' 79' ' ' VAL . 9.2 tptm -64.57 -38.09 89.8 Favored 'General case' 0 CA--C 1.545 0.778 0 C-N-CA 122.598 0.359 . . . . 0.0 110.846 -173.274 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 28.5 m-20 -64.32 -35.8 82.05 Favored 'General case' 0 N--CA 1.48 1.039 0 C-N-CA 123.508 0.723 . . . . 0.0 111.237 178.849 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 77' ' ' HIS . . . . . 0.4 ' HD2' HD23 ' A' ' 78' ' ' LEU . 18.8 t60 -60.62 -42.32 96.63 Favored 'General case' 0 N--CA 1.482 1.15 0 C-N-CA 124.159 0.984 . . . . 0.0 110.503 176.538 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . 0.4 HD23 ' HD2' ' A' ' 77' ' ' HIS . 42.2 mt -68.34 -37.31 80.39 Favored 'General case' 0 N--CA 1.473 0.716 0 CA-C-N 115.159 -0.928 . . . . 0.0 111.528 -175.528 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 79' ' ' VAL . . . . . 0.553 ' HA ' HD13 ' A' ' 34' ' ' LEU . 47.2 t -62.89 -49.12 84.9 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.751 0 C-N-CA 124.025 0.93 . . . . 0.0 110.008 175.495 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 70.7 m -60.81 -46.27 91.17 Favored 'General case' 0 CA--C 1.545 0.761 0 CA-C-N 114.293 -1.321 . . . . 0.0 111.681 -179.045 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 81' ' ' ALA . . . . . 0.425 ' HB1' HD11 ' A' ' 62' ' ' LEU . . . -68.84 -43.32 75.73 Favored 'General case' 0 N--CA 1.478 0.975 0 C-N-CA 123.516 0.727 . . . . 0.0 111.443 -177.639 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 82' ' ' TYR . . . . . 0.578 ' CD2' HD11 ' A' ' 34' ' ' LEU . 86.5 t80 -58.64 -55.31 36.77 Favored 'General case' 0 N--CA 1.476 0.853 0 C-N-CA 124.276 1.03 . . . . 0.0 110.408 -179.334 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 83' ' ' ASN . . . . . . . . . . . . . 93.0 m-20 -64.9 -34.7 79.02 Favored 'General case' 0 N--CA 1.477 0.879 0 C-N-CA 123.43 0.692 . . . . 0.0 111.545 -175.992 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 24.5 m170 -72.29 -26.81 62.12 Favored 'General case' 0 N--CA 1.487 1.419 0 C-N-CA 123.225 0.61 . . . . 0.0 112.354 176.965 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 85' ' ' LEU . . . . . 0.5 ' HG ' ' HD2' ' A' ' 91' ' ' PHE . 43.5 tp -57.1 -53.09 61.99 Favored 'General case' 0 N--CA 1.485 1.31 0 CA-C-O 121.935 0.874 . . . . 0.0 110.768 178.223 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 86' ' ' PHE . . . . . 0.425 ' HA ' ' HE2' ' A' ' 91' ' ' PHE . 31.7 m-85 -74.2 -32.23 62.95 Favored 'General case' 0 CA--C 1.54 0.587 0 CA-C-N 113.532 -1.667 . . . . 0.0 110.974 -177.916 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 34.2 tt0 -61.26 -44.86 96.55 Favored 'General case' 0 N--CA 1.48 1.055 0 C-N-CA 123.928 0.891 . . . . 0.0 111.847 -176.2 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 37.4 p -109.59 6.67 24.12 Favored 'General case' 0 CA--C 1.544 0.743 0 C-N-CA 123.644 0.778 . . . . 0.0 111.418 -176.004 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 13.4 mmmm 57.14 35.09 25.82 Favored 'General case' 0 N--CA 1.492 1.629 0 C-N-CA 124.471 1.108 . . . . 0.0 111.504 173.644 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 47.2 mtt-85 -65.74 -24.02 66.86 Favored 'General case' 0 N--CA 1.491 1.624 0 N-CA-C 113.518 0.933 . . . . 0.0 113.518 -172.146 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 91' ' ' PHE . . . . . 0.5 ' HD2' ' HG ' ' A' ' 85' ' ' LEU . 5.5 p90 -57.51 161.56 3.44 Favored 'General case' 0 CA--C 1.551 0.996 0 N-CA-C 114.351 1.241 . . . . 0.0 114.351 -172.946 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 16.3 ptmt . . . . . 0 CA--C 1.562 1.413 0 C-N-CA 126.101 1.76 . . . . 0.0 113.573 -171.198 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 20' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.481 1.123 0 CA-C-O 120.988 0.423 . . . . 0.0 110.5 . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -151.34 91.04 1.63 Allowed 'General case' 0 C--O 1.235 0.341 0 N-CA-C 108.121 -1.066 . . . . 0.0 108.121 174.543 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -71.63 83.07 0.85 Allowed 'General case' 0 N--CA 1.474 0.743 0 C-N-CA 123.341 0.656 . . . . 0.0 110.819 -176.406 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -88.29 83.42 6.91 Favored 'General case' 0 C--O 1.238 0.46 0 C-N-CA 124.063 0.945 . . . . 0.0 108.836 178.689 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . 0.419 ' HB ' ' CD2' ' A' ' 91' ' ' PHE . 23.7 m -68.28 134.52 91.23 Favored Pre-proline 0 CA--C 1.548 0.898 0 CA-C-N 115.695 -0.684 . . . . 0.0 110.071 -176.582 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 46.0 Cg_exo -58.74 102.11 0.14 Allowed 'Trans proline' 0 C--N 1.383 2.361 0 C-N-CA 122.739 2.292 . . . . 0.0 112.179 178.372 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 30.0 pt20 -64.68 167.86 6.81 Favored 'General case' 0 C--O 1.24 0.582 0 CA-C-N 114.725 -1.125 . . . . 0.0 110.167 178.03 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -53.53 125.34 17.72 Favored 'General case' 0 CA--C 1.547 0.847 0 CA-C-O 121.391 0.615 . . . . 0.0 111.135 175.865 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -82.0 -29.72 31.94 Favored 'General case' 0 N--CA 1.473 0.695 0 CA-C-N 115.193 -0.912 . . . . 0.0 108.787 176.439 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 29' ' ' TRP . . . . . . . . . . . . . 4.8 m-90 -134.63 146.51 49.63 Favored 'General case' 0 N--CA 1.464 0.274 0 CA-C-N 114.065 -1.425 . . . . 0.0 108.95 -177.28 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 22.7 p -86.59 175.35 8.36 Favored 'General case' 0 N--CA 1.472 0.641 0 N-CA-C 108.967 -0.753 . . . . 0.0 108.967 170.375 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . 0.482 ' HA ' HD12 ' A' ' 34' ' ' LEU . 14.8 p -62.21 -31.92 53.07 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.214 0 C-N-CA 122.693 0.397 . . . . 0.0 111.319 -176.157 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 12.5 pt-20 -70.99 -38.78 72.71 Favored 'General case' 0 N--CA 1.48 1.063 0 C-N-CA 124.003 0.921 . . . . 0.0 111.79 176.681 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 53.1 mt-30 -69.11 -38.15 78.76 Favored 'General case' 0 N--CA 1.477 0.92 0 C-N-CA 122.921 0.488 . . . . 0.0 110.554 176.171 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.482 HD12 ' HA ' ' A' ' 31' ' ' VAL . 87.3 mt -63.48 -50.93 67.75 Favored 'General case' 0 N--CA 1.48 1.062 0 C-N-CA 123.482 0.713 . . . . 0.0 111.171 -178.719 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . 0.445 HH21 HG22 ' A' ' 31' ' ' VAL . 18.6 ptp180 -69.89 -12.93 61.99 Favored 'General case' 0 CA--C 1.553 1.067 0 O-C-N 124.18 0.925 . . . . 0.0 111.474 -175.97 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 35.7 t -63.23 118.27 7.73 Favored 'General case' 0 N--CA 1.472 0.635 0 C-N-CA 123.387 0.675 . . . . 0.0 109.219 173.721 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 14.1 pt-20 -64.4 -30.21 71.25 Favored 'General case' 0 CA--C 1.548 0.879 0 C-N-CA 123.376 0.67 . . . . 0.0 111.725 -176.893 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 77.6 mt-30 -66.91 -19.06 65.66 Favored 'General case' 0 N--CA 1.484 1.252 0 C-N-CA 123.652 0.781 . . . . 0.0 111.584 179.942 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 1.8 tt -79.12 116.4 59.91 Favored Pre-proline 0 CA--C 1.551 1.008 0 N-CA-C 106.429 -1.693 . . . . 0.0 106.429 170.795 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 19.2 Cg_endo -58.57 119.97 7.55 Favored 'Trans proline' 0 C--N 1.378 2.085 0 C-N-CA 122.722 2.281 . . . . 0.0 111.62 177.011 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . 0.412 ' HE3' ' HB1' ' A' ' 70' ' ' ALA . 58.2 pttt -56.65 -30.48 63.4 Favored 'General case' 0 N--CA 1.48 1.068 0 C-N-CA 125.039 1.335 . . . . 0.0 112.67 -177.987 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . 0.433 ' HA ' HD12 ' A' ' 45' ' ' ILE . 22.5 pttp -71.41 -31.96 67.84 Favored 'General case' 0 CA--C 1.545 0.755 0 C-N-CA 123.408 0.683 . . . . 0.0 110.796 -179.486 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -73.28 -25.94 60.88 Favored 'General case' 0 N--CA 1.478 0.926 0 C-N-CA 123.028 0.531 . . . . 0.0 110.814 177.624 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 59.9 mt -67.68 -51.18 53.66 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.93 0 N-CA-C 109.294 -0.632 . . . . 0.0 109.294 171.649 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 45' ' ' ILE . . . . . 0.433 HD12 ' HA ' ' A' ' 42' ' ' LYS . 62.8 mt -54.25 -41.84 53.97 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.694 0 C-N-CA 123.827 0.851 . . . . 0.0 110.41 175.911 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 37.1 ttpt -63.45 -41.65 98.65 Favored 'General case' 0 CA--C 1.543 0.68 0 C-N-CA 124.625 1.17 . . . . 0.0 111.419 -178.089 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 27.4 t80 -66.02 -47.63 73.8 Favored 'General case' 0 N--CA 1.479 0.999 0 CA-C-N 115.794 -0.639 . . . . 0.0 111.015 178.116 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 84.9 mt -70.41 -29.83 66.55 Favored 'General case' 0 N--CA 1.471 0.61 0 C-N-CA 123.883 0.873 . . . . 0.0 111.947 -174.287 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 2.9 pt20 -79.57 -26.61 41.31 Favored 'General case' 0 N--CA 1.484 1.248 0 O-C-N 123.13 0.269 . . . . 0.0 110.482 175.163 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 43.5 tt0 -66.14 -26.98 67.69 Favored 'General case' 0 N--CA 1.482 1.153 0 C-N-CA 123.697 0.799 . . . . 0.0 112.003 -177.332 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 51' ' ' HIS . . . . . 0.471 ' NE2' HD13 ' A' ' 85' ' ' LEU . 47.7 p-80 -126.62 -17.01 5.14 Favored 'General case' 0 N--CA 1.486 1.334 0 N-CA-C 112.952 0.723 . . . . 0.0 112.952 -179.645 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -73.19 142.99 32.45 Favored Glycine 0 N--CA 1.472 1.052 0 CA-C-N 118.132 0.424 . . . . 0.0 112.593 176.247 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . 0.441 ' O ' ' HG ' ' A' ' 57' ' ' LEU . 32.7 t -76.1 155.18 34.96 Favored 'General case' 0 N--CA 1.48 1.039 0 C-N-CA 123.142 0.577 . . . . 0.0 110.26 177.052 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 22.1 m-20 -63.73 -31.83 73.12 Favored 'General case' 0 N--CA 1.492 1.634 0 C-N-CA 123.204 0.602 . . . . 0.0 112.493 -170.473 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 28.9 t -70.05 -28.26 65.31 Favored 'General case' 0 N--CA 1.474 0.76 0 C-N-CA 123.179 0.592 . . . . 0.0 110.869 179.575 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 82.1 t80 -74.92 -48.97 21.86 Favored 'General case' 0 CA--C 1.545 0.759 0 N-CA-C 109.589 -0.523 . . . . 0.0 109.589 170.102 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . 0.441 ' HG ' ' O ' ' A' ' 53' ' ' SER . 79.0 mt -60.07 -46.62 88.96 Favored 'General case' 0 C--O 1.213 -0.839 0 CA-C-N 115.144 -0.934 . . . . 0.0 111.867 -169.965 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -64.63 -44.8 89.35 Favored 'General case' 0 N--CA 1.481 1.105 0 C-N-CA 123.729 0.811 . . . . 0.0 111.704 -177.361 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 19.1 mm-40 -62.03 -21.66 65.08 Favored 'General case' 0 N--CA 1.483 1.204 0 C-N-CA 123.186 0.595 . . . . 0.0 112.192 177.39 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 21.3 m80 -113.95 1.15 14.62 Favored 'General case' 0 N--CA 1.488 1.448 0 C-N-CA 123.611 0.764 . . . . 0.0 111.098 179.083 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 38.4 mtmm 56.99 25.68 10.96 Favored 'General case' 0 N--CA 1.483 1.202 0 C-N-CA 125.47 1.508 . . . . 0.0 113.706 -179.91 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 0.45 HD11 ' HB1' ' A' ' 81' ' ' ALA . 90.0 mt -76.09 -14.77 60.18 Favored 'General case' 0 N--CA 1.477 0.886 0 C-N-CA 123.006 0.523 . . . . 0.0 112.344 -178.597 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 2.0 pp -86.08 174.99 8.8 Favored 'General case' 0 N--CA 1.479 1.013 0 CA-C-O 121.018 0.437 . . . . 0.0 110.946 176.109 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 84.53 -163.35 38.76 Favored Glycine 0 C--N 1.344 0.994 0 CA-C-N 115.481 -0.781 . . . . 0.0 112.384 179.473 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 30.4 m-80 -61.92 110.2 1.48 Allowed 'General case' 0 C--N 1.354 0.767 0 N-CA-C 109.139 -0.689 . . . . 0.0 109.139 176.491 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 66' ' ' ILE . . . . . 0.417 HG22 ' HB2' ' A' ' 42' ' ' LYS . 75.0 mt -61.02 -38.91 80.56 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.702 0 O-C-N 124.119 0.887 . . . . 0.0 110.769 -176.42 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 61.9 pttt -59.31 -36.89 76.44 Favored 'General case' 0 CA--C 1.553 1.084 0 C-N-CA 123.503 0.721 . . . . 0.0 111.271 176.483 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 68' ' ' ASN . . . . . 0.411 ' O ' ' HG2' ' A' ' 71' ' ' LYS . 48.3 t-20 -72.22 -44.5 62.83 Favored 'General case' 0 N--CA 1.478 0.97 0 C-N-CA 123.459 0.704 . . . . 0.0 109.726 179.594 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 69' ' ' VAL . . . . . 0.423 HG12 ' HB2' ' A' ' 73' ' ' ALA . 98.0 t -60.58 -39.03 80.09 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.733 0 CA-C-N 115.707 -0.679 . . . . 0.0 110.49 178.457 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 70' ' ' ALA . . . . . 0.435 ' HA ' ' HB3' ' A' ' 73' ' ' ALA . . . -63.29 -17.25 62.32 Favored 'General case' 0 N--CA 1.478 0.967 0 C-N-CA 124.416 1.086 . . . . 0.0 113.282 -175.215 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . 0.411 ' HG2' ' O ' ' A' ' 68' ' ' ASN . 16.1 ptpt -75.61 -22.27 57.02 Favored 'General case' 0 N--CA 1.489 1.521 0 CA-C-N 118.49 0.586 . . . . 0.0 110.91 -178.754 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 13.5 t -122.12 -12.31 8.33 Favored 'General case' 0 CA--C 1.543 0.703 0 C-N-CA 124.169 0.987 . . . . 0.0 110.607 -179.135 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . 0.526 ' HB1' HD21 ' A' ' 78' ' ' LEU . . . -77.49 86.19 3.85 Favored 'General case' 0 C--N 1.349 0.552 0 CA-C-O 121.461 0.648 . . . . 0.0 109.67 179.673 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 74' ' ' ASN . . . . . 0.431 ' ND2' ' HB3' ' A' ' 76' ' ' ASP . 7.9 p-10 -73.12 150.36 42.29 Favored 'General case' 0 C--O 1.24 0.58 0 CA-C-N 114.507 -1.224 . . . . 0.0 108.548 174.838 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 2.1 ttmp? -68.96 -26.66 65.16 Favored 'General case' 0 CA--C 1.544 0.72 0 C-N-CA 123.4 0.68 . . . . 0.0 111.482 -167.125 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 76' ' ' ASP . . . . . 0.431 ' HB3' ' ND2' ' A' ' 74' ' ' ASN . 28.4 t70 -62.95 -43.24 99.33 Favored 'General case' 0 N--CA 1.478 0.959 0 C-N-CA 123.555 0.742 . . . . 0.0 110.604 173.868 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 61.0 t60 -61.95 -42.39 99.05 Favored 'General case' 0 N--CA 1.482 1.165 0 C-N-CA 124.404 1.082 . . . . 0.0 110.664 175.857 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . 0.526 HD21 ' HB1' ' A' ' 73' ' ' ALA . 96.3 mt -65.1 -38.64 91.37 Favored 'General case' 0 N--CA 1.481 1.083 0 C-N-CA 123.571 0.748 . . . . 0.0 112.196 -175.392 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 98.2 t -69.24 -40.33 80.21 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.942 0 CA-C-N 115.606 -0.724 . . . . 0.0 110.503 176.085 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 57.2 m -62.21 -41.47 98.41 Favored 'General case' 0 N--CA 1.48 1.048 0 C-N-CA 123.273 0.629 . . . . 0.0 111.118 177.31 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 81' ' ' ALA . . . . . 0.45 ' HB1' HD11 ' A' ' 62' ' ' LEU . . . -68.74 -42.19 77.92 Favored 'General case' 0 CA--C 1.543 0.699 0 C-N-CA 123.436 0.694 . . . . 0.0 110.659 178.492 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 82' ' ' TYR . . . . . . . . . . . . . 7.5 t80 -52.08 -55.55 20.02 Favored 'General case' 0 N--CA 1.475 0.802 0 C-N-CA 124.434 1.094 . . . . 0.0 110.542 175.61 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 83' ' ' ASN . . . . . . . . . . . . . 28.9 m-80 -64.37 -45.71 86.54 Favored 'General case' 0 N--CA 1.482 1.153 0 C-N-CA 123.31 0.644 . . . . 0.0 111.594 -175.855 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 23.9 m-70 -62.01 -25.37 67.6 Favored 'General case' 0 N--CA 1.481 1.084 0 C-N-CA 123.484 0.714 . . . . 0.0 111.827 -179.541 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 85' ' ' LEU . . . . . 0.471 HD13 ' NE2' ' A' ' 51' ' ' HIS . 2.9 mt -60.85 -52.36 65.38 Favored 'General case' 0 N--CA 1.476 0.857 0 CA-C-O 120.766 0.317 . . . . 0.0 111.126 173.139 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 60.8 m-85 -72.97 -30.68 64.02 Favored 'General case' 0 CA--C 1.553 1.083 0 CA-C-N 115.475 -0.784 . . . . 0.0 111.092 -176.837 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 37.4 tt0 -48.36 -48.55 36.43 Favored 'General case' 0 N--CA 1.491 1.597 0 C-N-CA 126.055 1.742 . . . . 0.0 113.83 -173.532 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 27.3 p -120.62 -4.04 9.79 Favored 'General case' 0 CA--C 1.538 0.492 0 C-N-CA 124.342 1.057 . . . . 0.0 109.99 -178.71 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 32.1 mtmm 62.23 69.88 0.6 Allowed 'General case' 0 C--N 1.357 0.922 0 C-N-CA 124.402 1.081 . . . . 0.0 109.783 -173.843 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 44.6 mtt85 -86.01 15.02 5.36 Favored 'General case' 0 N--CA 1.489 1.524 0 C-N-CA 125.244 1.417 . . . . 0.0 111.837 175.816 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 91' ' ' PHE . . . . . 0.419 ' CD2' ' HB ' ' A' ' 24' ' ' VAL . 1.8 m-30 -56.67 160.11 3.51 Favored 'General case' 0 N--CA 1.477 0.901 0 C-N-CA 124.646 1.178 . . . . 0.0 111.331 171.356 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 92' ' ' LYS . . . . . 0.437 ' HE3' ' HA ' ' A' ' 53' ' ' SER . 40.7 ttmt . . . . . 0 C--O 1.249 1.058 0 N-CA-C 108.106 -1.072 . . . . 0.0 108.106 -179.617 . . . . . . . . 1 1 . 1 stop_ save_