data_2m7g_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 2m7g _Structure_validation_residue.Date_analyzed 2016-10-08 loop_ _Residue_analysis_software.Software_ID _Residue_analysis_software.Software_label _Residue_analysis_software.Method_ID _Residue_analysis_software.Method_label _Residue_analysis_software.Entry_ID _Residue_analysis_software.Structure_validation_oneline_list_ID 1 MolProbity . . ? 1 2 CYRANGE . . ? 1 stop_ loop_ _Residue_analysis.ID _Residue_analysis.PDB_model_num _Residue_analysis.Hydrogen_positions _Residue_analysis.MolProbity_flips _Residue_analysis.Cyrange_core_flag _Residue_analysis.Two_letter_chain_ID _Residue_analysis.PDB_strand_ID _Residue_analysis.PDB_residue_no _Residue_analysis.PDB_ins_code _Residue_analysis.PDB_residue_name _Residue_analysis.Assembly_ID _Residue_analysis.Entity_assembly_ID _Residue_analysis.Entity_ID _Residue_analysis.Comp_ID _Residue_analysis.Comp_index_ID _Residue_analysis.Clash_value _Residue_analysis.Clash_source_PDB_atom_name _Residue_analysis.Clash_destination_PDB_atom_name _Residue_analysis.Clash_destination_PDB_strand_ID _Residue_analysis.Clash_destination_PDB_residue_no _Residue_analysis.Clash_destination_PDB_ins_code _Residue_analysis.Clash_destination_PDB_residue_name _Residue_analysis.Cbeta_deviation_value _Residue_analysis.Rotamer_score _Residue_analysis.Rotamer_name _Residue_analysis.Ramachandran_phi _Residue_analysis.Ramachandran_psi _Residue_analysis.Ramachandran_score _Residue_analysis.Ramachandran_evaluation _Residue_analysis.Ramachandran_type _Residue_analysis.Bond_outlier_count _Residue_analysis.Worst_bond _Residue_analysis.Worst_bond_value _Residue_analysis.Worst_bond_sigma _Residue_analysis.Angle_outlier_count _Residue_analysis.Worst_angle _Residue_analysis.Worst_angle_value _Residue_analysis.Worst_angle_sigma _Residue_analysis.RNA_phosphate_perpendicular_outlier _Residue_analysis.RNA_suitness_score _Residue_analysis.RNA_suite_conformer _Residue_analysis.RNA_suite_triage _Residue_analysis.Max_b_factor _Residue_analysis.Tau_angle _Residue_analysis.Omega_dihedral _Residue_analysis.Disulfide_chi1 _Residue_analysis.Disulfide_chi2 _Residue_analysis.Disulfide_chi3 _Residue_analysis.Disulfide_ss_angle _Residue_analysis.Disulfide_ss _Residue_analysis.Disulfide_ss_angle_prime _Residue_analysis.Disulfide_chi2prime _Residue_analysis.Disulfide_chi1prime _Residue_analysis.Outlier_count_separate_geometry _Residue_analysis.Outlier_count _Residue_analysis.Entry_ID _Residue_analysis.Structure_validation_residue_list_ID . 001 nuclear orig core ' A' A ' 2' ' ' THR . . . . . 0.524 HG21 ' H ' ' A' ' 5' ' ' GLU . 7.2 t . . . . . 0 N--CA 1.492 1.659 0 CA-C-O 121.179 0.514 . . . . 73.51 111.834 . . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 3' ' ' LEU . . . . . 0.564 HD13 HD11 ' A' ' 6' ' ' LEU . 4.3 mm? -61.23 -22.72 65.06 Favored 'General case' 0 N--CA 1.482 1.139 0 CA-C-N 115.743 -0.662 . . . . 73.42 111.147 174.802 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 1.5 mp -62.14 -45.73 98.08 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.427 0 C-N-CA 123.596 0.758 . . . . 54.54 110.474 177.338 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 5' ' ' GLU . . . . . 0.524 ' H ' HG21 ' A' ' 2' ' ' THR . 14.4 mm-40 -56.23 -47.32 78.7 Favored 'General case' 0 N--CA 1.484 1.244 0 C-N-CA 123.021 0.528 . . . . 74.14 111.422 174.856 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 6' ' ' LEU . . . . . 0.564 HD11 HD13 ' A' ' 3' ' ' LEU . 85.5 mt -64.08 -41.66 97.24 Favored 'General case' 0 N--CA 1.478 0.953 0 C-N-CA 123.436 0.694 . . . . 75.43 111.956 -179.759 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 90.9 mt -61.75 -45.43 93.94 Favored 'General case' 0 N--CA 1.48 1.067 0 C-N-CA 123.174 0.589 . . . . 73.21 111.82 177.672 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 87.1 mt -63.77 -47.94 88.73 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.801 0 C-N-CA 123.324 0.65 . . . . 63.43 112.235 176.998 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 50.3 t -62.01 -44.57 99.13 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.834 0 C-N-CA 123.38 0.672 . . . . 71.25 111.379 -178.953 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 40.2 t -67.82 -31.64 53.07 Favored 'Isoleucine or valine' 0 CA--C 1.555 1.173 0 C-N-CA 123.041 0.536 . . . . 54.12 111.355 176.427 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -68.5 -58.91 3.6 Favored 'General case' 0 N--CA 1.481 1.086 0 C-N-CA 122.44 0.296 . . . . 62.53 111.274 177.855 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 12' ' ' ILE . . . . . 0.529 ' O ' ' HG ' ' A' ' 16' ' ' LEU . 20.9 pt -60.58 -49.21 85.32 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.955 0 C-N-CA 123.464 0.706 . . . . 50.35 111.83 -176.387 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 71.3 mt -68.47 -30.41 47.4 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.934 0 C-N-CA 123.613 0.765 . . . . 73.21 110.665 178.994 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -61.04 -36.39 92.24 Favored Glycine 0 C--N 1.351 1.369 0 CA-C-N 115.938 -0.574 . . . . 42.54 112.968 175.256 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 17.4 mt -75.79 -45.92 36.9 Favored 'Isoleucine or valine' 0 C--N 1.354 0.795 0 C-N-CA 123.289 0.636 . . . . 62.52 110.11 176.194 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . 0.529 ' HG ' ' O ' ' A' ' 12' ' ' ILE . 36.5 mt -55.17 -43.25 74.13 Favored 'General case' 0 N--CA 1.485 1.294 0 O-C-N 124.055 0.847 . . . . 70.41 111.501 -178.81 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -75.1 -49.81 18.42 Favored 'General case' 0 N--CA 1.476 0.861 0 C-N-CA 123.071 0.548 . . . . 61.11 111.33 -177.857 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -55.28 -30.18 59.64 Favored 'General case' 0 N--CA 1.482 1.148 0 C-N-CA 123.665 0.786 . . . . 74.11 112.921 -178.037 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 2.8 pp -89.1 -37.52 10.11 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.974 0 N-CA-C 112.155 0.428 . . . . 71.23 112.155 173.624 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -65.96 -53.04 44.12 Favored 'General case' 0 N--CA 1.487 1.388 0 N-CA-C 113.052 0.76 . . . . 72.33 113.052 -171.093 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 2.4 mp -54.64 -56.3 28.65 Favored Pre-proline 0 CA--C 1.566 1.562 0 CA-C-O 118.629 -0.7 . . . . 72.3 112.494 -174.759 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 37.2 Cg_endo -65.31 -41.05 17.05 Favored 'Trans proline' 0 C--N 1.38 2.224 0 C-N-CA 121.576 1.517 . . . . 70.24 113.493 177.624 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 28.2 tt0 -63.87 -36.47 84.04 Favored 'General case' 0 N--CA 1.488 1.464 0 C-N-CA 123.369 0.668 . . . . 71.04 111.098 -176.13 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 24' ' ' PHE . . . . . . . . . . . . . 37.5 t80 -88.33 -36.24 16.74 Favored 'General case' 0 N--CA 1.485 1.31 0 CA-C-N 114.837 -1.074 . . . . 64.4 111.023 -174.84 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 31.3 t -60.3 -51.18 70.65 Favored 'General case' 0 N--CA 1.478 0.943 0 C-N-CA 122.991 0.517 . . . . 75.43 110.411 173.612 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -69.99 -21.29 63.24 Favored 'General case' 0 CA--C 1.551 0.998 0 CA-C-N 115.486 -0.779 . . . . 74.15 112.644 176.789 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 79.7 t80 -71.19 -48.47 51.41 Favored 'General case' 0 N--CA 1.488 1.427 0 C-N-CA 122.686 0.395 . . . . 70.21 110.995 175.361 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 73.5 mtp180 -67.62 -27.14 66.64 Favored 'General case' 0 N--CA 1.477 0.886 0 C-N-CA 123.015 0.526 . . . . 72.03 111.106 177.62 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 24.0 t -71.17 -49.03 51.37 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.892 0 CA-C-N 115.694 -0.685 . . . . 45.05 110.69 174.214 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 18.9 ptmt -70.73 -22.39 62.43 Favored 'General case' 0 N--CA 1.476 0.861 0 CA-C-O 119.427 -0.32 . . . . 71.11 111.024 -179.099 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -78.19 -36.57 47.21 Favored 'General case' 0 N--CA 1.48 1.052 0 CA-C-O 120.909 0.385 . . . . 72.41 110.132 176.501 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 88.6 t80 -63.76 -43.87 95.13 Favored 'General case' 0 C--O 1.218 -0.559 0 CA-C-N 115.059 -0.973 . . . . 75.4 109.935 174.652 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 82.5 m-20 -80.0 -31.82 39.72 Favored 'General case' 0 N--CA 1.484 1.247 0 C-N-CA 124.075 0.95 . . . . 70.41 112.608 -176.667 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 39.7 t -66.01 -51.56 57.19 Favored 'General case' 0 N--CA 1.492 1.662 0 C-N-CA 122.521 0.329 . . . . 71.15 110.235 173.907 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -65.91 -38.52 88.93 Favored 'General case' 0 CA--C 1.541 0.596 0 CA-C-N 115.596 -0.729 . . . . 61.21 111.706 177.505 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -61.95 -53.56 53.97 Favored 'General case' 0 N--CA 1.497 1.921 0 N-CA-C 112.3 0.481 . . . . 73.5 112.3 177.169 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 44.1 t -61.15 -49.48 77.07 Favored 'General case' 0 N--CA 1.483 1.186 0 C-N-CA 122.855 0.462 . . . . 52.53 111.282 179.466 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 64.4 m -66.4 -27.67 68.03 Favored 'General case' 0 N--CA 1.483 1.189 0 C-N-CA 123.312 0.645 . . . . 72.2 112.681 -178.621 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 32.1 t70 -63.17 -47.2 83.68 Favored 'General case' 0 N--CA 1.483 1.221 0 CA-C-O 121.336 0.589 . . . . 74.24 110.815 170.027 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 90.9 mt -74.28 -22.48 59.27 Favored 'General case' 0 N--CA 1.481 1.106 0 CA-C-N 115.274 -0.875 . . . . 74.23 112.188 -178.042 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 61.6 mtp180 -83.99 -60.8 1.99 Allowed 'General case' 0 N--CA 1.479 1.006 0 C-N-CA 123.457 0.703 . . . . 74.3 111.488 177.194 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 7.3 t30 -61.16 -38.46 86.54 Favored 'General case' 0 N--CA 1.483 1.223 0 C-N-CA 123.916 0.886 . . . . 75.3 112.988 -171.038 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 83.9 mt -78.22 -31.95 49.63 Favored 'General case' 0 N--CA 1.486 1.336 0 N-CA-C 111.654 0.242 . . . . 74.24 111.654 -178.99 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 40.6 ttmt -76.05 -44.96 36.68 Favored 'General case' 0 N--CA 1.474 0.76 0 C-N-CA 122.844 0.457 . . . . 45.43 110.519 -177.286 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 5.8 t -66.77 -32.84 74.4 Favored 'General case' 0 N--CA 1.478 0.951 0 CA-C-N 115.305 -0.861 . . . . 73.32 110.853 -179.736 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -67.2 -40.19 86.45 Favored 'General case' 0 N--CA 1.475 0.819 0 CA-C-N 114.98 -1.009 . . . . 74.03 111.557 172.964 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 8.0 tt -64.58 -47.01 80.27 Favored 'General case' 0 N--CA 1.482 1.14 0 C-N-CA 123.724 0.81 . . . . 75.02 110.465 176.218 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 40.3 mt-10 -65.55 -30.58 71.35 Favored 'General case' 0 N--CA 1.479 1.02 0 C-N-CA 123.54 0.736 . . . . 73.42 111.523 -179.444 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 23.5 t -81.01 -39.15 26.33 Favored 'General case' 0 N--CA 1.479 0.975 0 C-N-CA 123.012 0.525 . . . . 73.42 111.591 179.122 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -74.44 -36.72 63.39 Favored 'General case' 0 N--CA 1.486 1.344 0 C-N-CA 123.33 0.652 . . . . 71.02 111.724 -175.272 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 51' ' ' PHE . . . . . . . . . . . . . 88.4 m-85 . . . . . 0 N--CA 1.479 1.015 0 C-N-CA 124.044 0.938 . . . . 72.45 110.671 177.983 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 2.7 t . . . . . 0 N--CA 1.48 1.068 0 N-CA-C 110.207 -0.294 . . . . 74.02 110.207 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 83.1 mt -55.57 -25.24 37.05 Favored 'General case' 0 N--CA 1.482 1.173 0 C-N-CA 124.11 0.964 . . . . 73.34 112.168 -179.173 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 49.0 mm -64.72 -58.42 7.22 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.767 0 O-C-N 124.007 0.817 . . . . 75.02 110.798 178.733 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 18.3 mm-40 -67.95 -37.9 82.15 Favored 'General case' 0 N--CA 1.478 0.951 0 N-CA-C 111.912 0.338 . . . . 60.11 111.912 -176.359 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 70.6 mt -62.42 -41.6 98.81 Favored 'General case' 0 N--CA 1.485 1.296 0 C-N-CA 123.152 0.581 . . . . 73.52 111.973 176.249 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 37.6 tp -66.35 -39.45 89.2 Favored 'General case' 0 CA--C 1.549 0.939 0 C-N-CA 123.252 0.621 . . . . 62.11 111.82 178.165 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 83.4 mt -67.85 -44.03 85.66 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.873 0 C-N-CA 122.843 0.457 . . . . 75.01 111.789 176.957 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 53.6 t -60.44 -47.84 90.9 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.974 0 C-N-CA 123.157 0.583 . . . . 55.41 111.76 177.028 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 4.0 p -66.9 -29.24 45.64 Favored 'Isoleucine or valine' 0 CA--C 1.561 1.383 0 N-CA-C 111.636 0.235 . . . . 63.11 111.636 178.021 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -71.93 -51.8 20.34 Favored 'General case' 0 N--CA 1.483 1.177 0 C-N-CA 123.074 0.55 . . . . 65.34 111.899 178.515 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 12' ' ' ILE . . . . . 0.556 ' HA ' HD11 ' A' ' 15' ' ' ILE . 27.3 pt -64.69 -46.26 92.81 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.921 0 C-N-CA 123.141 0.577 . . . . 71.43 111.273 -175.805 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 81.9 mt -64.67 -29.31 47.0 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.093 0 C-N-CA 123.72 0.808 . . . . 75.2 110.642 176.405 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -61.26 -39.68 97.54 Favored Glycine 0 C--N 1.354 1.553 0 CA-C-N 116.0 -0.546 . . . . 44.32 112.843 172.515 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 15' ' ' ILE . . . . . 0.556 HD11 ' HA ' ' A' ' 12' ' ' ILE . 16.3 mt -73.38 -44.94 53.8 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.914 0 C-N-CA 123.618 0.767 . . . . 72.24 110.807 176.644 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . 0.505 ' HG ' ' O ' ' A' ' 12' ' ' ILE . 24.9 mt -59.06 -36.81 75.69 Favored 'General case' 0 N--CA 1.485 1.309 0 C-N-CA 123.4 0.68 . . . . 75.03 111.249 -177.315 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -70.53 -54.3 12.72 Favored 'General case' 0 CA--C 1.548 0.883 0 C-N-CA 123.131 0.572 . . . . 74.23 110.253 174.518 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -57.92 -21.35 43.26 Favored 'General case' 0 N--CA 1.48 1.035 0 N-CA-C 114.066 1.136 . . . . 51.34 114.066 -177.46 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 2.7 pp -97.54 -36.23 5.88 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.06 0 N-CA-C 112.283 0.475 . . . . 73.0 112.283 174.202 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -69.65 -45.87 67.44 Favored 'General case' 0 N--CA 1.49 1.538 0 N-CA-C 112.639 0.607 . . . . 74.01 112.639 -172.519 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 2.3 mp -57.93 -55.02 49.49 Favored Pre-proline 0 CA--C 1.571 1.759 0 CA-C-O 118.619 -0.705 . . . . 72.22 112.298 -179.177 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 55.6 Cg_endo -68.51 -34.98 18.68 Favored 'Trans proline' 0 C--N 1.383 2.382 0 C-N-CA 122.277 1.984 . . . . 74.1 114.025 177.538 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 26.5 tt0 -64.75 -36.93 85.89 Favored 'General case' 0 N--CA 1.49 1.568 0 CA-C-O 121.455 0.645 . . . . 71.15 110.274 -179.143 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 24' ' ' PHE . . . . . . . . . . . . . 58.4 t80 -86.55 -35.22 19.65 Favored 'General case' 0 N--CA 1.484 1.245 0 CA-C-N 114.636 -1.165 . . . . 75.13 110.763 -175.477 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 25' ' ' SER . . . . . 0.429 ' O ' HG22 ' A' ' 29' ' ' VAL . 44.5 t -56.89 -55.28 36.52 Favored 'General case' 0 N--CA 1.478 0.93 0 C-N-CA 123.225 0.61 . . . . 74.42 110.319 169.985 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -61.65 -30.46 70.73 Favored 'General case' 0 N--CA 1.484 1.249 0 C-N-CA 124.26 1.024 . . . . 64.42 112.483 177.252 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 69.0 t80 -64.15 -51.69 62.66 Favored 'General case' 0 N--CA 1.478 0.926 0 C-N-CA 122.816 0.446 . . . . 73.44 110.154 175.342 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . 0.402 ' O ' ' HB2' ' A' ' 32' ' ' TYR . 80.7 mtp180 -67.49 -25.25 65.77 Favored 'General case' 0 N--CA 1.476 0.861 0 CA-C-N 115.429 -0.805 . . . . 74.53 111.796 179.709 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . 0.429 HG22 ' O ' ' A' ' 25' ' ' SER . 41.9 t -68.19 -54.49 21.71 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.393 0 O-C-N 123.43 0.456 . . . . 72.05 110.459 176.55 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . 0.554 ' HB2' ' HZ1' ' A' ' 30' ' ' LYS . 0.0 OUTLIER -69.17 -24.38 64.06 Favored 'General case' 0 N--CA 1.478 0.926 0 CA-C-N 115.725 -0.671 . . . . 74.41 111.097 179.099 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -80.8 -31.39 35.68 Favored 'General case' 0 N--CA 1.484 1.24 0 C-N-CA 122.925 0.49 . . . . 70.24 110.783 -179.884 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 32' ' ' TYR . . . . . 0.402 ' HB2' ' O ' ' A' ' 28' ' ' ARG . 4.9 t80 -74.27 -19.19 60.58 Favored 'General case' 0 N--CA 1.484 1.268 0 C-N-CA 123.181 0.592 . . . . 71.44 110.372 177.897 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 17.9 m120 -91.94 -52.76 4.57 Favored 'General case' 0 N--CA 1.473 0.707 0 C-N-CA 123.721 0.808 . . . . 63.23 110.86 175.063 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 44.0 t -65.43 -59.37 4.08 Favored 'General case' 0 N--CA 1.484 1.259 0 C-N-CA 123.313 0.645 . . . . 65.34 111.683 -174.096 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -61.58 -40.54 95.14 Favored 'General case' 0 N--CA 1.479 0.977 0 N-CA-C 112.135 0.42 . . . . 74.42 112.135 -179.09 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -64.18 -46.42 84.06 Favored 'General case' 0 N--CA 1.485 1.294 0 C-N-CA 122.427 0.291 . . . . 62.24 111.015 -178.201 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 73.0 m -65.14 -44.01 90.01 Favored 'General case' 0 N--CA 1.476 0.839 0 CA-C-N 116.184 -0.462 . . . . 73.44 111.663 175.659 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 64.1 m -72.23 -35.36 68.84 Favored 'General case' 0 N--CA 1.484 1.256 0 N-CA-C 113.06 0.763 . . . . 72.24 113.06 -171.535 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 17.4 m-20 -64.1 -51.42 64.1 Favored 'General case' 0 N--CA 1.476 0.86 0 O-C-N 123.474 0.484 . . . . 63.45 110.339 170.53 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -64.24 -32.47 74.07 Favored 'General case' 0 N--CA 1.483 1.21 0 C-N-CA 123.021 0.529 . . . . 72.33 111.95 -176.115 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 88.6 mtm180 -79.78 -38.12 33.82 Favored 'General case' 0 N--CA 1.486 1.366 0 C-N-CA 122.787 0.435 . . . . 72.31 110.787 178.712 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 62.4 t30 -64.55 -35.91 82.51 Favored 'General case' 0 N--CA 1.49 1.536 0 C-N-CA 122.967 0.507 . . . . 72.52 111.192 175.425 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 96.2 mt -78.02 -35.99 49.22 Favored 'General case' 0 N--CA 1.48 1.043 0 C-N-CA 123.402 0.681 . . . . 74.45 110.985 179.058 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 6.2 tmmm? -72.02 -43.77 64.47 Favored 'General case' 0 N--CA 1.478 0.962 0 C-N-CA 122.74 0.416 . . . . 74.11 110.177 -177.955 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 2.0 t -67.22 -30.92 70.97 Favored 'General case' 0 N--CA 1.479 0.984 0 C-N-CA 123.781 0.832 . . . . 73.45 111.569 -179.892 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -63.59 -53.18 55.68 Favored 'General case' 0 N--CA 1.478 0.969 0 CA-C-N 115.37 -0.832 . . . . 64.43 111.038 173.817 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 10.8 mp -68.61 -27.02 65.66 Favored 'General case' 0 N--CA 1.487 1.418 0 C-N-CA 123.432 0.693 . . . . 74.23 112.111 177.297 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 9.5 tp10 -69.89 -51.44 33.13 Favored 'General case' 0 C--N 1.35 0.624 0 C-N-CA 124.348 1.059 . . . . 75.12 110.365 179.142 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 47.1 t -62.83 -36.58 83.67 Favored 'General case' 0 N--CA 1.481 1.092 0 C-N-CA 124.091 0.956 . . . . 65.35 111.756 177.207 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -61.97 -50.56 71.61 Favored 'General case' 0 N--CA 1.479 1.006 0 C-N-CA 123.638 0.775 . . . . 64.12 111.798 177.919 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 51' ' ' PHE . . . . . . . . . . . . . 32.5 t80 . . . . . 0 CA--C 1.56 1.331 0 C-N-CA 122.819 0.447 . . . . 73.41 111.348 178.552 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 2' ' ' THR . . . . . 0.501 HG23 ' H ' ' A' ' 5' ' ' GLU . 6.7 t . . . . . 0 N--CA 1.482 1.16 0 CA-C-O 121.236 0.541 . . . . 70.23 110.696 . . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 3' ' ' LEU . . . . . 0.444 ' HA ' HD11 ' A' ' 6' ' ' LEU . 9.2 mp -65.84 -17.43 64.64 Favored 'General case' 0 N--CA 1.478 0.958 0 CA-C-N 115.331 -0.849 . . . . 65.33 111.247 176.858 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 45.8 mm -67.86 -43.86 85.76 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.141 0 C-N-CA 123.136 0.574 . . . . 64.42 110.894 175.398 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 5' ' ' GLU . . . . . 0.501 ' H ' HG23 ' A' ' 2' ' ' THR . 25.6 mm-40 -58.86 -41.26 86.62 Favored 'General case' 0 N--CA 1.49 1.545 0 C-N-CA 123.089 0.555 . . . . 62.33 111.372 174.308 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 6' ' ' LEU . . . . . 0.444 HD11 ' HA ' ' A' ' 3' ' ' LEU . 71.5 mt -61.2 -47.48 85.95 Favored 'General case' 0 N--CA 1.482 1.134 0 C-N-CA 123.368 0.667 . . . . 72.52 111.223 175.13 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 60.4 tp -54.93 -42.94 72.88 Favored 'General case' 0 CA--C 1.554 1.104 0 C-N-CA 124.59 1.156 . . . . 74.24 112.238 176.305 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 94.8 mt -70.69 -40.54 77.07 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.091 0 C-N-CA 124.308 1.043 . . . . 73.31 111.993 178.88 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 46.1 t -62.52 -45.7 98.16 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.959 0 C-N-CA 123.325 0.65 . . . . 72.41 111.095 175.718 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 69.1 t -62.07 -36.79 76.16 Favored 'Isoleucine or valine' 0 CA--C 1.561 1.387 0 C-N-CA 123.281 0.633 . . . . 74.15 111.379 174.664 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -65.95 -51.6 57.12 Favored 'General case' 0 CA--C 1.553 1.081 0 C-N-CA 123.099 0.559 . . . . 73.33 112.276 178.688 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 12' ' ' ILE . . . . . 0.606 ' HA ' HD11 ' A' ' 15' ' ' ILE . 23.5 pt -68.41 -42.42 84.04 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.089 0 C-N-CA 123.159 0.584 . . . . 71.43 111.978 -175.199 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 79.3 mt -65.14 -32.68 59.34 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.028 0 C-N-CA 123.307 0.643 . . . . 75.03 110.51 174.807 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -60.82 -38.25 94.99 Favored Glycine 0 C--N 1.354 1.573 0 CA-C-N 115.831 -0.622 . . . . 71.44 112.833 174.992 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 15' ' ' ILE . . . . . 0.606 HD11 ' HA ' ' A' ' 12' ' ' ILE . 24.7 mt -69.87 -43.05 79.96 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.975 0 C-N-CA 123.877 0.871 . . . . 64.0 111.173 175.569 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . 0.483 ' HG ' ' O ' ' A' ' 12' ' ' ILE . 20.7 mt -63.95 -35.73 81.65 Favored 'General case' 0 N--CA 1.486 1.37 0 C-N-CA 122.969 0.508 . . . . 74.25 111.366 -178.766 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -73.24 -44.58 59.22 Favored 'General case' 0 N--CA 1.479 1.014 0 C-N-CA 123.216 0.606 . . . . 75.21 110.673 175.564 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -60.38 -28.56 68.31 Favored 'General case' 0 N--CA 1.483 1.209 0 C-N-CA 124.166 0.986 . . . . 55.3 113.267 -179.843 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 2.8 pp -89.75 -38.38 11.03 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.327 0 CA-C-N 118.101 0.41 . . . . 63.45 111.607 173.656 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -67.8 -54.42 19.22 Favored 'General case' 0 N--CA 1.487 1.386 0 N-CA-C 112.724 0.639 . . . . 63.43 112.724 -172.779 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 21.7 mt -53.07 -54.19 47.06 Favored Pre-proline 0 CA--C 1.566 1.576 0 N-CA-C 113.902 1.075 . . . . 73.15 113.902 -176.587 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 38.2 Cg_endo -65.66 -38.83 22.97 Favored 'Trans proline' 0 C--N 1.381 2.24 0 CA-C-N 121.636 1.62 . . . . 73.12 113.166 175.118 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 20.1 tt0 -62.98 -38.16 90.03 Favored 'General case' 0 N--CA 1.489 1.525 0 C-N-CA 123.462 0.705 . . . . 75.31 110.95 -177.102 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 24' ' ' PHE . . . . . . . . . . . . . 32.8 m-85 -91.9 -36.99 13.15 Favored 'General case' 0 N--CA 1.486 1.348 0 CA-C-N 115.046 -0.979 . . . . 72.41 111.746 -174.663 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 47.3 t -63.59 -46.75 84.41 Favored 'General case' 0 N--CA 1.492 1.639 0 CA-C-N 117.774 0.261 . . . . 70.14 111.189 173.777 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -67.14 -26.44 66.67 Favored 'General case' 0 N--CA 1.483 1.207 0 C-N-CA 122.909 0.484 . . . . 62.33 111.834 174.796 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 68.8 t80 -66.42 -55.15 17.14 Favored 'General case' 0 N--CA 1.485 1.284 0 C-N-CA 122.995 0.518 . . . . 74.44 111.131 178.897 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 35.6 ptt180 -65.45 -28.93 69.57 Favored 'General case' 0 N--CA 1.475 0.817 0 C-N-CA 123.473 0.709 . . . . 74.33 111.488 -175.841 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 78.6 t -77.35 -48.32 24.79 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.843 0 CA-C-N 115.976 -0.556 . . . . 74.01 110.422 179.085 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 15.1 pttp -67.79 -27.52 66.81 Favored 'General case' 0 N--CA 1.476 0.848 0 CA-C-N 116.171 -0.468 . . . . 72.4 110.557 178.709 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -81.28 -30.01 34.13 Favored 'General case' 0 C--N 1.366 1.292 0 N-CA-C 110.086 -0.339 . . . . 74.44 110.086 -179.798 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 62.2 t80 -62.75 -54.29 41.41 Favored 'General case' 0 C--N 1.352 0.7 0 CA-C-N 115.957 -0.565 . . . . 74.34 109.724 174.72 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 52.1 m-80 -69.35 -37.7 77.78 Favored 'General case' 0 N--CA 1.479 0.993 0 C-N-CA 123.637 0.775 . . . . 75.31 113.064 179.512 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 33.7 t -63.42 -55.89 20.65 Favored 'General case' 0 N--CA 1.498 1.953 0 CA-C-O 120.964 0.411 . . . . 37.68 111.502 178.734 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -68.12 -38.01 81.78 Favored 'General case' 0 CA--C 1.542 0.637 0 CA-C-N 115.435 -0.802 . . . . 74.13 112.027 -179.205 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -66.35 -52.79 43.42 Favored 'General case' 0 N--CA 1.499 1.983 0 N-CA-C 112.242 0.46 . . . . 62.44 112.242 179.735 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 50.7 m -58.16 -43.45 87.4 Favored 'General case' 0 N--CA 1.488 1.431 0 C-N-CA 123.1 0.56 . . . . 75.54 111.465 179.689 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 41.7 t -74.37 -32.08 62.62 Favored 'General case' 0 N--CA 1.481 1.121 0 CA-C-N 116.022 -0.535 . . . . 73.23 112.038 -179.275 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 24.1 t70 -59.09 -54.92 41.59 Favored 'General case' 0 N--CA 1.48 1.062 0 C-N-CA 122.926 0.49 . . . . 73.31 111.21 175.44 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 4.0 pp -75.4 -26.46 58.43 Favored 'General case' 0 N--CA 1.49 1.567 0 CA-C-N 116.125 -0.488 . . . . 74.13 111.455 -172.119 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 59.1 ttp180 -75.76 -40.99 54.41 Favored 'General case' 0 CA--C 1.545 0.785 0 C-N-CA 123.554 0.742 . . . . 75.03 110.87 175.788 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 64.1 t30 -67.62 -36.93 81.73 Favored 'General case' 0 N--CA 1.487 1.409 0 C-N-CA 123.301 0.641 . . . . 60.15 111.11 178.945 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 81.0 mt -73.3 -27.97 61.84 Favored 'General case' 0 N--CA 1.482 1.168 0 C-N-CA 122.891 0.476 . . . . 75.2 111.33 178.443 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . 0.451 ' HE3' ' HA ' ' A' ' 44' ' ' LYS . 0.1 OUTLIER -79.34 -44.72 21.01 Favored 'General case' 0 N--CA 1.469 0.506 0 C-N-CA 122.723 0.409 . . . . 61.34 110.215 -179.887 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 4.9 t -69.53 -34.43 74.24 Favored 'General case' 0 N--CA 1.48 1.033 0 O-C-N 123.715 0.634 . . . . 72.41 111.17 -177.637 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -69.1 -41.79 76.98 Favored 'General case' 0 N--CA 1.477 0.887 0 C-N-CA 123.718 0.807 . . . . 62.44 111.304 174.06 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 42.9 tp -66.32 -43.98 84.67 Favored 'General case' 0 N--CA 1.477 0.899 0 C-N-CA 123.481 0.712 . . . . 74.2 112.165 -179.78 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 12.9 pt-20 -74.05 -34.05 63.93 Favored 'General case' 0 N--CA 1.484 1.254 0 C-N-CA 122.798 0.439 . . . . 73.34 111.624 -177.199 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 79.4 p -72.32 -33.95 67.74 Favored 'General case' 0 N--CA 1.489 1.484 0 C-N-CA 122.725 0.41 . . . . 71.22 110.896 175.561 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -70.38 -41.91 72.44 Favored 'General case' 0 N--CA 1.479 0.986 0 CA-C-N 115.646 -0.706 . . . . 72.32 111.074 177.696 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 51' ' ' PHE . . . . . . . . . . . . . 69.7 t80 . . . . . 0 CA--C 1.553 1.059 0 C-N-CA 123.256 0.622 . . . . 74.44 110.67 179.998 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 55.1 m . . . . . 0 N--CA 1.476 0.845 0 N-CA-C 109.023 -0.732 . . . . 64.2 109.023 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 3' ' ' LEU . . . . . 0.489 HD13 HD11 ' A' ' 6' ' ' LEU . 3.3 mm? -62.27 -23.04 66.47 Favored 'General case' 0 N--CA 1.487 1.391 0 C-N-CA 123.192 0.597 . . . . 75.42 111.755 -177.594 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 47.8 mm -69.75 -49.37 58.42 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.118 0 C-N-CA 123.165 0.586 . . . . 72.32 110.475 171.397 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 40.8 mm-40 -59.35 -38.32 80.08 Favored 'General case' 0 N--CA 1.491 1.614 0 C-N-CA 123.337 0.655 . . . . 74.45 112.166 176.062 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 6' ' ' LEU . . . . . 0.489 HD11 HD13 ' A' ' 3' ' ' LEU . 78.6 mt -69.95 -39.75 75.84 Favored 'General case' 0 N--CA 1.48 1.033 0 C-N-CA 123.001 0.521 . . . . 72.45 111.31 176.883 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 2.1 tm? -60.01 -48.46 81.62 Favored 'General case' 0 CA--C 1.552 1.028 0 C-N-CA 123.632 0.773 . . . . 75.53 110.432 176.958 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 77.6 mt -68.84 -48.29 71.57 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.732 0 C-N-CA 123.997 0.919 . . . . 75.52 112.227 -177.568 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 7.1 p -60.57 -40.62 85.07 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.158 0 CA-C-N 118.22 0.463 . . . . 64.31 111.823 -178.29 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 54.0 t -67.16 -41.52 87.02 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.027 0 C-N-CA 123.328 0.651 . . . . 74.35 110.903 173.572 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -64.03 -52.43 59.5 Favored 'General case' 0 N--CA 1.484 1.242 0 C-N-CA 122.946 0.498 . . . . 63.35 111.987 -178.581 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 12' ' ' ILE . . . . . 0.497 ' O ' ' HG ' ' A' ' 16' ' ' LEU . 28.6 pt -64.09 -47.21 91.23 Favored 'Isoleucine or valine' 0 C--N 1.355 0.815 0 C-N-CA 123.362 0.665 . . . . 70.03 111.474 -175.817 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 79.0 mt -64.21 -31.04 51.8 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.054 0 C-N-CA 123.322 0.649 . . . . 63.04 110.443 177.929 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -65.26 -40.52 96.69 Favored Glycine 0 C--N 1.352 1.445 0 CA-C-N 115.714 -0.675 . . . . 74.14 112.9 174.084 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 22.4 mt -69.05 -44.77 80.91 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.052 0 C-N-CA 123.63 0.772 . . . . 61.03 110.833 175.382 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . 0.497 ' HG ' ' O ' ' A' ' 12' ' ' ILE . 16.3 mt -60.99 -37.14 81.44 Favored 'General case' 0 N--CA 1.48 1.047 0 C-N-CA 123.345 0.658 . . . . 72.34 111.043 -178.314 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -74.24 -49.33 23.73 Favored 'General case' 0 CA--C 1.551 1.002 0 C-N-CA 122.959 0.504 . . . . 74.33 110.944 176.352 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -55.82 -29.94 60.6 Favored 'General case' 0 N--CA 1.491 1.594 0 C-N-CA 124.017 0.927 . . . . 74.31 113.248 -178.787 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 2.8 pp -86.97 -37.66 11.44 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.833 0 CA-C-O 119.601 -0.237 . . . . 74.5 111.472 172.432 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -61.95 -53.98 48.06 Favored 'General case' 0 N--CA 1.487 1.411 0 C-N-CA 124.009 0.924 . . . . 75.12 113.274 -172.098 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 3.0 mp -56.46 -54.62 51.35 Favored Pre-proline 0 CA--C 1.572 1.817 0 CA-C-O 118.444 -0.789 . . . . 71.4 112.614 -175.094 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 36.7 Cg_endo -64.85 -39.33 26.0 Favored 'Trans proline' 0 C--N 1.381 2.268 0 C-N-CA 122.166 1.911 . . . . 75.22 113.305 176.385 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 5.1 tt0 -60.05 -43.55 95.3 Favored 'General case' 0 N--CA 1.489 1.512 0 C-N-CA 123.944 0.898 . . . . 65.51 110.523 -179.075 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 24' ' ' PHE . . . . . . . . . . . . . 16.0 m-85 -87.67 -28.28 21.92 Favored 'General case' 0 N--CA 1.485 1.324 0 CA-C-N 114.819 -1.082 . . . . 74.32 111.319 -172.281 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 74.3 m -59.62 -59.41 5.48 Favored 'General case' 0 N--CA 1.481 1.122 0 N-CA-C 109.549 -0.537 . . . . 74.22 109.549 167.264 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -62.0 -26.95 68.52 Favored 'General case' 0 N--CA 1.485 1.289 0 C-N-CA 124.02 0.928 . . . . 51.31 112.715 -179.714 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 27' ' ' TYR . . . . . 0.416 ' O ' ' HG2' ' A' ' 30' ' ' LYS . 57.3 t80 -70.03 -52.92 20.2 Favored 'General case' 0 N--CA 1.484 1.252 0 C-N-CA 123.476 0.71 . . . . 65.41 110.885 176.21 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 82.4 mtp180 -71.84 -20.68 61.79 Favored 'General case' 0 N--CA 1.475 0.81 0 CA-C-N 115.812 -0.631 . . . . 73.1 111.524 179.505 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 38.9 t -76.82 -44.51 32.68 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.445 0 C-N-CA 122.744 0.418 . . . . 64.53 110.397 174.996 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . 0.416 ' HG2' ' O ' ' A' ' 27' ' ' TYR . 17.1 ptmt -71.15 -26.79 63.14 Favored 'General case' 0 N--CA 1.479 1.001 0 O-C-N 123.391 0.432 . . . . 73.51 110.34 178.57 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -81.81 -32.88 31.07 Favored 'General case' 0 C--N 1.362 1.111 0 C-N-CA 123.059 0.544 . . . . 54.25 110.453 178.176 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 41.5 t80 -65.39 -46.23 80.89 Favored 'General case' 0 C--O 1.21 -0.996 0 N-CA-C 108.888 -0.782 . . . . 75.42 108.888 174.772 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 8.2 t30 -66.64 -45.07 80.22 Favored 'General case' 0 CA--C 1.547 0.832 0 C-N-CA 125.034 1.334 . . . . 74.4 111.982 177.294 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 42.4 t -63.99 -56.7 13.17 Favored 'General case' 0 N--CA 1.491 1.618 0 C-N-CA 123.27 0.628 . . . . 63.32 111.877 -179.094 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -65.91 -36.42 83.34 Favored 'General case' 0 N--CA 1.475 0.779 0 C-N-CA 123.139 0.576 . . . . 51.24 111.992 -179.248 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -69.47 -40.75 76.91 Favored 'General case' 0 N--CA 1.496 1.83 0 CA-C-N 117.764 0.256 . . . . 71.11 111.639 177.954 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 47.2 t -62.59 -44.58 95.96 Favored 'General case' 0 N--CA 1.484 1.242 0 C-N-CA 123.155 0.582 . . . . 72.22 110.816 175.375 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 70.9 m -71.04 -26.4 63.07 Favored 'General case' 0 N--CA 1.483 1.207 0 C-N-CA 122.942 0.497 . . . . 72.2 111.853 178.303 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 28.2 t70 -66.31 -51.17 60.05 Favored 'General case' 0 CA--C 1.551 0.993 0 C-N-CA 123.252 0.621 . . . . 73.14 110.416 172.929 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 4.0 pp -78.25 -18.34 55.48 Favored 'General case' 0 N--CA 1.49 1.569 0 N-CA-C 112.082 0.401 . . . . 63.44 112.082 -174.853 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 41' ' ' ARG . . . . . 0.401 ' HA ' ' HD3' ' A' ' 41' ' ' ARG . 26.9 mmt180 -84.13 -59.49 2.39 Favored 'General case' 0 N--CA 1.48 1.06 0 CA-C-O 118.93 -0.557 . . . . 74.53 112.113 172.695 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 49.5 t-20 -60.56 -42.6 96.95 Favored 'General case' 0 N--CA 1.497 1.887 0 C-N-CA 123.034 0.534 . . . . 62.35 111.824 -174.432 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . 0.435 ' O ' HD22 ' A' ' 47' ' ' LEU . 96.7 mt -75.08 -28.25 60.24 Favored 'General case' 0 N--CA 1.486 1.335 0 C-N-CA 122.43 0.292 . . . . 73.51 111.471 -175.312 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 29.4 ttpp -79.42 -48.1 14.56 Favored 'General case' 0 N--CA 1.474 0.765 0 N-CA-C 109.664 -0.495 . . . . 74.34 109.664 178.613 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 3.9 t -70.22 -27.21 64.29 Favored 'General case' 0 N--CA 1.487 1.424 0 C-N-CA 124.174 0.99 . . . . 71.11 112.071 -174.455 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -60.92 -50.77 72.08 Favored 'General case' 0 N--CA 1.478 0.97 0 O-C-N 123.74 0.65 . . . . 72.24 110.914 173.146 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 47' ' ' LEU . . . . . 0.435 HD22 ' O ' ' A' ' 43' ' ' LEU . 4.2 mm? -65.68 -36.16 82.84 Favored 'General case' 0 N--CA 1.487 1.41 0 C-N-CA 123.609 0.763 . . . . 73.51 111.569 175.98 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 48.7 mt-10 -68.04 -33.75 75.16 Favored 'General case' 0 N--CA 1.483 1.211 0 C-N-CA 122.968 0.507 . . . . 74.11 111.499 176.579 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 44.1 t -83.08 -23.16 33.22 Favored 'General case' 0 N--CA 1.485 1.302 0 C-N-CA 123.313 0.645 . . . . 43.33 111.84 177.736 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -79.0 -30.13 44.09 Favored 'General case' 0 N--CA 1.486 1.331 0 C-N-CA 123.6 0.76 . . . . 51.51 112.551 -175.268 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 51' ' ' PHE . . . . . . . . . . . . . 78.1 t80 . . . . . 0 N--CA 1.477 0.898 0 C-N-CA 123.434 0.694 . . . . 70.05 110.135 -177.966 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 31.4 p . . . . . 0 N--CA 1.483 1.201 0 CA-C-O 121.032 0.444 . . . . 74.13 111.822 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 3.3 mm? -64.63 -19.29 65.6 Favored 'General case' 0 N--CA 1.484 1.255 0 CA-C-N 115.574 -0.739 . . . . 62.4 111.05 171.931 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 49.6 mm -73.64 -48.57 39.93 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.026 0 C-N-CA 123.163 0.585 . . . . 64.41 110.668 178.878 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 47.1 mt-10 -56.64 -44.35 81.18 Favored 'General case' 0 N--CA 1.489 1.49 0 C-N-CA 123.396 0.679 . . . . 74.31 111.267 175.971 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 82.3 mt -59.18 -47.0 86.94 Favored 'General case' 0 N--CA 1.481 1.106 0 C-N-CA 123.439 0.696 . . . . 72.4 111.579 174.213 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 37.1 tp -56.7 -40.37 75.49 Favored 'General case' 0 CA--C 1.549 0.926 0 C-N-CA 123.454 0.701 . . . . 73.14 112.138 178.706 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 82.4 mt -66.52 -50.43 66.9 Favored 'Isoleucine or valine' 0 C--N 1.355 0.825 0 C-N-CA 123.972 0.909 . . . . 72.52 111.275 178.458 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 86.8 t -58.25 -44.11 87.31 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.974 0 C-N-CA 123.583 0.753 . . . . 75.03 111.343 179.18 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 70.0 t -67.07 -36.15 76.28 Favored 'Isoleucine or valine' 0 CA--C 1.554 1.121 0 C-N-CA 122.896 0.478 . . . . 75.24 111.695 176.429 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -67.18 -53.55 29.35 Favored 'General case' 0 N--CA 1.483 1.188 0 C-N-CA 122.607 0.363 . . . . 75.52 111.325 179.991 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 12' ' ' ILE . . . . . 0.585 HG13 HD13 ' A' ' 13' ' ' ILE . 33.4 pt -64.1 -48.4 86.0 Favored 'Isoleucine or valine' 0 CA--C 1.554 1.107 0 C-N-CA 123.439 0.696 . . . . 63.45 111.651 -175.829 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 13' ' ' ILE . . . . . 0.585 HD13 HG13 ' A' ' 12' ' ' ILE . 1.8 mp -64.84 -32.97 60.41 Favored 'Isoleucine or valine' 0 C--N 1.372 1.566 0 C-N-CA 123.066 0.546 . . . . 75.11 109.986 175.479 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -59.53 -37.63 92.44 Favored Glycine 0 C--N 1.352 1.424 0 O-C-N 123.578 0.549 . . . . 63.43 113.328 177.641 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 18.5 mt -72.12 -44.65 64.93 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.989 0 C-N-CA 123.372 0.669 . . . . 65.31 110.784 176.043 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . 0.507 ' HG ' ' O ' ' A' ' 12' ' ' ILE . 22.7 mt -59.63 -37.89 79.87 Favored 'General case' 0 N--CA 1.488 1.442 0 C-N-CA 123.428 0.691 . . . . 72.33 111.136 179.41 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -74.1 -48.7 27.9 Favored 'General case' 0 N--CA 1.474 0.754 0 C-N-CA 123.603 0.761 . . . . 54.42 110.918 178.498 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -56.41 -27.76 57.45 Favored 'General case' 0 N--CA 1.486 1.33 0 C-N-CA 123.91 0.884 . . . . 71.2 112.803 -178.176 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 2.8 pp -91.39 -37.92 9.82 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.175 0 N-CA-C 112.035 0.383 . . . . 64.23 112.035 172.89 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -66.93 -50.1 63.45 Favored 'General case' 0 N--CA 1.489 1.498 0 N-CA-C 113.141 0.793 . . . . 75.31 113.141 -171.089 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 2.5 mp -59.35 -54.24 58.11 Favored Pre-proline 0 CA--C 1.567 1.623 0 CA-C-O 118.534 -0.746 . . . . 74.24 112.509 -175.392 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 30.2 Cg_endo -63.44 -39.74 35.05 Favored 'Trans proline' 0 C--N 1.384 2.43 0 C-N-CA 121.921 1.747 . . . . 64.44 113.43 176.514 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 8.9 tt0 -64.88 -37.29 87.13 Favored 'General case' 0 N--CA 1.483 1.199 0 CA-C-N 115.366 -0.834 . . . . 75.3 110.566 -177.04 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 24' ' ' PHE . . . . . . . . . . . . . 71.6 t80 -83.05 -36.86 24.6 Favored 'General case' 0 N--CA 1.484 1.234 0 CA-C-N 114.701 -1.136 . . . . 74.23 110.898 -176.243 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 40.6 t -57.39 -44.69 84.71 Favored 'General case' 0 N--CA 1.48 1.053 0 C-N-CA 123.139 0.575 . . . . 61.11 110.941 172.108 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -72.57 -32.8 66.3 Favored 'General case' 0 N--CA 1.477 0.907 0 CA-C-N 115.878 -0.601 . . . . 64.34 111.873 176.077 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 76.5 t80 -68.48 -47.44 67.06 Favored 'General case' 0 N--CA 1.493 1.684 0 C-N-CA 124.135 0.974 . . . . 75.54 112.223 -176.437 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 10.4 ptm180 -75.2 -24.72 57.82 Favored 'General case' 0 N--CA 1.475 0.802 0 CA-C-N 115.303 -0.862 . . . . 72.23 110.914 -175.274 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 86.2 t -84.01 -34.14 9.84 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.555 0 CA-C-O 121.143 0.497 . . . . 51.45 109.966 175.851 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 30.0 tttt -61.77 -35.28 77.67 Favored 'General case' 0 CA--C 1.546 0.823 0 C-N-CA 123.703 0.801 . . . . 74.12 110.172 167.301 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -68.72 -39.45 80.4 Favored 'General case' 0 N--CA 1.48 1.07 0 C-N-CA 123.239 0.616 . . . . 64.11 110.724 178.111 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 76.0 t80 -59.16 -59.7 5.04 Favored 'General case' 0 C--O 1.212 -0.871 0 CA-C-N 115.714 -0.675 . . . . 75.53 110.084 173.908 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 3.9 m-20 -56.8 -44.15 81.66 Favored 'General case' 0 N--CA 1.486 1.325 0 C-N-CA 124.06 0.944 . . . . 73.44 113.128 -179.512 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 46.9 t -68.04 -57.16 6.59 Favored 'General case' 0 N--CA 1.487 1.401 0 C-N-CA 123.289 0.635 . . . . 64.4 110.842 -177.151 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -65.9 -36.14 82.57 Favored 'General case' 0 N--CA 1.48 1.037 0 N-CA-C 112.3 0.482 . . . . 74.0 112.3 -178.758 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -69.08 -47.83 64.26 Favored 'General case' 0 N--CA 1.495 1.803 0 N-CA-C 111.921 0.341 . . . . 51.32 111.921 179.175 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 67.3 m -69.23 -33.26 73.0 Favored 'General case' 0 N--CA 1.486 1.372 0 C-N-CA 122.62 0.368 . . . . 63.13 111.762 179.179 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 32.2 t -78.96 -26.14 43.51 Favored 'General case' 0 N--CA 1.486 1.342 0 C-N-CA 123.071 0.549 . . . . 43.34 111.339 178.284 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 27.1 t70 -67.63 -48.27 67.21 Favored 'General case' 0 N--CA 1.476 0.865 0 C-N-CA 123.146 0.578 . . . . 74.01 110.123 169.165 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 92.2 mt -67.13 -30.97 71.11 Favored 'General case' 0 N--CA 1.483 1.193 0 C-N-CA 123.144 0.578 . . . . 64.33 110.974 -179.497 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 50.1 ttm-85 -71.78 -45.79 60.45 Favored 'General case' 0 CA--C 1.541 0.626 0 C-N-CA 123.269 0.628 . . . . 74.41 110.266 175.178 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 63.3 t30 -64.28 -39.76 94.58 Favored 'General case' 0 N--CA 1.482 1.139 0 C-N-CA 123.605 0.762 . . . . 75.44 111.863 -179.047 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 93.9 mt -75.91 -30.93 58.93 Favored 'General case' 0 N--CA 1.479 1.009 0 C-N-CA 123.247 0.619 . . . . 74.31 111.292 179.889 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 23.8 ttmm -73.55 -47.52 40.13 Favored 'General case' 0 N--CA 1.477 0.918 0 C-N-CA 123.039 0.536 . . . . 75.02 110.21 -178.483 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 3.6 t -68.69 -32.83 72.92 Favored 'General case' 0 N--CA 1.475 0.811 0 CA-C-N 114.592 -1.185 . . . . 75.41 111.362 -178.436 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -70.68 -43.6 68.74 Favored 'General case' 0 N--CA 1.474 0.727 0 CA-C-N 115.356 -0.838 . . . . 74.11 111.236 173.791 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 14.4 tp -70.52 -37.23 74.1 Favored 'General case' 0 N--CA 1.487 1.377 0 C-N-CA 123.108 0.563 . . . . 54.04 111.611 -175.77 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 12.2 pt-20 -74.16 -30.85 62.46 Favored 'General case' 0 N--CA 1.482 1.137 0 CA-C-N 116.187 -0.461 . . . . 75.2 111.071 178.217 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 24.9 t -82.28 -14.9 54.7 Favored 'General case' 0 N--CA 1.487 1.414 0 C-N-CA 123.027 0.531 . . . . 74.31 112.103 174.296 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -83.2 -49.37 9.52 Favored 'General case' 0 N--CA 1.485 1.305 0 C-N-CA 123.568 0.747 . . . . 74.25 111.159 -179.12 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 51' ' ' PHE . . . . . . . . . . . . . 25.6 m-85 . . . . . 0 N--CA 1.47 0.539 0 CA-C-N 115.845 -0.616 . . . . 71.44 110.498 179.713 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 2' ' ' THR . . . . . 0.472 HG23 ' H ' ' A' ' 5' ' ' GLU . 6.7 t . . . . . 0 N--CA 1.487 1.417 0 N-CA-C 111.745 0.276 . . . . 73.23 111.745 . . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 3' ' ' LEU . . . . . 0.478 HD13 HD11 ' A' ' 6' ' ' LEU . 3.4 mm? -63.22 -24.2 67.77 Favored 'General case' 0 N--CA 1.483 1.212 0 CA-C-N 115.538 -0.756 . . . . 61.1 110.63 174.317 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 41.3 mm -59.24 -49.69 82.54 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.297 0 C-N-CA 123.725 0.81 . . . . 54.22 111.22 179.301 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 5' ' ' GLU . . . . . 0.472 ' H ' HG23 ' A' ' 2' ' ' THR . 43.8 mm-40 -65.5 -35.55 81.2 Favored 'General case' 0 N--CA 1.479 1.02 0 CA-C-N 116.079 -0.509 . . . . 71.41 111.854 177.639 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 6' ' ' LEU . . . . . 0.478 HD11 HD13 ' A' ' 3' ' ' LEU . 82.4 mt -64.31 -38.63 91.72 Favored 'General case' 0 N--CA 1.483 1.206 0 C-N-CA 122.617 0.367 . . . . 63.04 111.571 176.258 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 7' ' ' LEU . . . . . 0.419 ' HG ' ' O ' ' A' ' 3' ' ' LEU . 91.8 mt -60.77 -44.24 97.02 Favored 'General case' 0 N--CA 1.485 1.28 0 C-N-CA 123.327 0.651 . . . . 74.05 111.213 174.321 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 96.7 mt -68.66 -53.22 28.67 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.78 0 C-N-CA 124.087 0.955 . . . . 63.23 112.565 -179.163 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 71.0 t -57.63 -43.45 83.5 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.027 0 C-N-CA 123.705 0.802 . . . . 74.44 112.005 -177.209 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 72.9 t -68.42 -33.77 62.06 Favored 'Isoleucine or valine' 0 CA--C 1.559 1.32 0 C-N-CA 122.627 0.371 . . . . 74.43 111.952 176.919 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -73.46 -49.72 25.38 Favored 'General case' 0 N--CA 1.485 1.283 0 CA-C-N 118.091 0.405 . . . . 74.11 111.841 -179.52 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 12' ' ' ILE . . . . . 0.424 ' O ' ' HG ' ' A' ' 16' ' ' LEU . 25.8 pt -64.93 -43.11 96.28 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.151 0 C-N-CA 123.744 0.818 . . . . 75.15 112.064 -175.488 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 78.8 mt -73.38 -30.1 29.47 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.882 0 C-N-CA 123.881 0.873 . . . . 54.23 109.893 176.305 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -62.01 -36.24 92.59 Favored Glycine 0 C--N 1.355 1.624 0 CA-C-N 115.604 -0.725 . . . . 71.41 113.046 174.858 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 15' ' ' ILE . . . . . 0.418 HD11 ' HA ' ' A' ' 12' ' ' ILE . 21.5 mt -69.51 -47.21 73.37 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.892 0 C-N-CA 123.407 0.683 . . . . 70.03 110.549 173.544 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . 0.424 ' HG ' ' O ' ' A' ' 12' ' ' ILE . 14.6 mt -59.94 -35.73 75.54 Favored 'General case' 0 N--CA 1.484 1.241 0 O-C-N 123.562 0.539 . . . . 72.32 112.172 -176.073 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -72.2 -52.16 17.79 Favored 'General case' 0 N--CA 1.478 0.939 0 CA-C-O 121.289 0.566 . . . . 63.24 110.662 174.87 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -64.51 -19.55 65.66 Favored 'General case' 0 N--CA 1.479 1.005 0 N-CA-C 114.175 1.176 . . . . 72.32 114.175 -176.837 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 2.7 pp -94.57 -43.33 13.09 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.178 0 CA-C-N 118.458 0.572 . . . . 65.21 111.441 173.441 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -72.39 -46.9 53.17 Favored 'General case' 0 N--CA 1.491 1.577 0 N-CA-C 112.542 0.571 . . . . 64.54 112.542 -170.483 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 23.4 mt -59.35 -54.41 56.43 Favored Pre-proline 0 CA--C 1.561 1.379 0 CA-C-O 118.091 -0.957 . . . . 74.43 113.063 -177.988 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 39.2 Cg_endo -65.43 -37.87 28.39 Favored 'Trans proline' 0 C--N 1.38 2.221 0 C-N-CA 121.821 1.681 . . . . 74.34 112.773 176.554 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 27.4 tt0 -66.07 -35.63 81.03 Favored 'General case' 0 N--CA 1.485 1.284 0 C-N-CA 123.349 0.66 . . . . 74.31 110.291 -178.124 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 24' ' ' PHE . . . . . . . . . . . . . 66.8 t80 -87.37 -38.03 16.55 Favored 'General case' 0 N--CA 1.489 1.49 0 CA-C-N 115.563 -0.744 . . . . 74.31 111.082 -176.959 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 74.7 m -56.15 -49.21 74.61 Favored 'General case' 0 N--CA 1.488 1.453 0 C-N-CA 122.358 0.263 . . . . 74.21 110.721 171.008 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -67.3 -30.76 70.7 Favored 'General case' 0 N--CA 1.483 1.216 0 C-N-CA 123.264 0.626 . . . . 54.42 112.19 175.932 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 61.2 t80 -68.38 -53.36 24.41 Favored 'General case' 0 N--CA 1.479 1.007 0 C-N-CA 123.16 0.584 . . . . 71.4 110.906 -179.044 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 1.8 ptm180 -69.59 -18.24 63.6 Favored 'General case' 0 N--CA 1.475 0.815 0 C-N-CA 123.317 0.647 . . . . 73.42 111.443 -175.415 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 52.9 t -76.5 -51.43 19.51 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.183 0 CA-C-O 120.906 0.384 . . . . 75.03 110.45 171.436 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 21.2 ptmt -73.41 -18.7 61.12 Favored 'General case' 0 N--CA 1.482 1.154 0 CA-C-N 115.819 -0.628 . . . . 64.44 111.882 -178.572 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -87.15 -33.2 19.49 Favored 'General case' 0 N--CA 1.486 1.375 0 C-N-CA 123.459 0.704 . . . . 72.44 109.822 179.09 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 69.8 t80 -69.77 -22.32 63.36 Favored 'General case' 0 N--CA 1.483 1.211 0 CA-C-N 115.566 -0.743 . . . . 71.12 109.967 171.58 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 7.6 t30 -84.33 -51.23 7.14 Favored 'General case' 0 N--CA 1.475 0.785 0 C-N-CA 124.221 1.008 . . . . 61.42 111.218 173.106 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 46.5 t -67.67 -54.95 15.4 Favored 'General case' 0 N--CA 1.492 1.631 0 C-N-CA 123.247 0.619 . . . . 64.4 112.181 -172.427 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -61.41 -39.25 90.06 Favored 'General case' 0 N--CA 1.474 0.762 0 CA-C-N 115.981 -0.554 . . . . 72.12 111.296 178.572 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -70.36 -43.3 70.46 Favored 'General case' 0 N--CA 1.483 1.176 0 O-C-N 123.359 0.412 . . . . 75.44 111.808 -178.424 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 40.2 t -59.11 -43.91 91.94 Favored 'General case' 0 N--CA 1.491 1.6 0 C-N-CA 123.53 0.732 . . . . 74.35 111.514 178.249 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 44.6 t -79.08 -27.54 43.03 Favored 'General case' 0 N--CA 1.475 0.823 0 CA-C-N 115.411 -0.813 . . . . 72.25 112.059 -179.211 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 26.6 t70 -66.6 -47.17 73.55 Favored 'General case' 0 N--CA 1.481 1.083 0 C-N-CA 122.82 0.448 . . . . 75.45 110.809 172.414 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 97.2 mt -71.82 -31.73 66.85 Favored 'General case' 0 N--CA 1.481 1.091 0 C-N-CA 123.423 0.689 . . . . 74.53 110.829 -177.288 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 50.4 ttp180 -74.08 -31.99 63.07 Favored 'General case' 0 CA--C 1.548 0.882 0 CA-C-N 115.842 -0.617 . . . . 73.42 110.3 173.347 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 42' ' ' ASN . . . . . 0.426 ' HA ' HG22 ' A' ' 45' ' ' THR . 18.0 t-20 -68.63 -31.38 70.48 Favored 'General case' 0 N--CA 1.485 1.285 0 C-N-CA 122.802 0.441 . . . . 70.33 111.14 173.916 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 96.3 mt -66.67 -37.33 84.54 Favored 'General case' 0 N--CA 1.486 1.358 0 C-N-CA 123.022 0.529 . . . . 75.25 110.391 172.719 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 17.8 tppt? -72.61 -47.66 46.06 Favored 'General case' 0 N--CA 1.473 0.677 0 C-N-CA 123.682 0.793 . . . . 61.01 110.258 -176.761 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 45' ' ' THR . . . . . 0.426 HG22 ' HA ' ' A' ' 42' ' ' ASN . 2.9 t -68.3 -31.16 70.39 Favored 'General case' 0 N--CA 1.485 1.285 0 C-N-CA 123.872 0.869 . . . . 74.45 111.489 -177.52 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -65.51 -52.43 52.76 Favored 'General case' 0 N--CA 1.473 0.687 0 CA-C-N 115.18 -0.918 . . . . 74.31 110.569 173.929 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 91.7 mt -66.36 -27.75 68.12 Favored 'General case' 0 N--CA 1.485 1.301 0 C-N-CA 123.643 0.777 . . . . 70.2 112.494 176.535 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 13.1 tp10 -71.78 -53.36 13.63 Favored 'General case' 0 C--N 1.349 0.571 0 C-N-CA 124.304 1.042 . . . . 72.32 111.108 -179.577 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 46.8 t -67.46 -34.76 77.83 Favored 'General case' 0 N--CA 1.48 1.075 0 CA-C-N 115.542 -0.754 . . . . 74.15 111.569 178.897 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -65.94 -52.14 52.39 Favored 'General case' 0 N--CA 1.482 1.126 0 C-N-CA 123.347 0.659 . . . . 63.2 111.555 177.263 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 51' ' ' PHE . . . . . . . . . . . . . 73.9 t80 . . . . . 0 N--CA 1.492 1.635 0 C-N-CA 123.334 0.654 . . . . 72.21 111.231 -178.923 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 2' ' ' THR . . . . . 0.651 ' HB ' ' HG2' ' A' ' 5' ' ' GLU . 25.8 m . . . . . 0 N--CA 1.479 0.979 0 N-CA-C 109.908 -0.404 . . . . 71.3 109.908 . . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 7.7 tt -57.15 -33.31 67.27 Favored 'General case' 0 N--CA 1.488 1.473 0 C-N-CA 123.53 0.732 . . . . 64.23 110.745 176.594 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 4' ' ' ILE . . . . . 0.528 ' H ' HG22 ' A' ' 2' ' ' THR . 48.7 mm -65.95 -37.34 79.61 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.251 0 C-N-CA 123.093 0.557 . . . . 73.33 111.461 -178.223 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 5' ' ' GLU . . . . . 0.651 ' HG2' ' HB ' ' A' ' 2' ' ' THR . 11.2 mm-40 -56.68 -45.55 81.67 Favored 'General case' 0 N--CA 1.491 1.577 0 C-N-CA 123.296 0.639 . . . . 70.51 110.726 173.586 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 53.8 mt -65.43 -42.6 92.27 Favored 'General case' 0 N--CA 1.479 1.004 0 C-N-CA 123.625 0.77 . . . . 64.03 111.385 177.887 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -56.73 -48.91 76.7 Favored 'General case' 0 CA--C 1.552 1.041 0 C-N-CA 124.364 1.066 . . . . 73.31 110.294 178.089 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 95.2 mt -65.88 -43.77 92.92 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.791 0 C-N-CA 124.254 1.022 . . . . 63.32 112.143 -179.249 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 49.6 t -62.91 -45.45 98.84 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.061 0 C-N-CA 122.868 0.467 . . . . 73.04 111.396 178.383 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 71.6 t -66.58 -32.8 59.66 Favored 'Isoleucine or valine' 0 CA--C 1.562 1.431 0 C-N-CA 122.7 0.4 . . . . 73.1 111.016 175.36 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -67.23 -55.63 13.22 Favored 'General case' 0 CA--C 1.552 1.031 0 C-N-CA 123.065 0.546 . . . . 53.34 111.584 179.219 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 12' ' ' ILE . . . . . 0.464 ' O ' ' HG ' ' A' ' 16' ' ' LEU . 23.7 pt -61.28 -46.03 97.43 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.125 0 C-N-CA 123.461 0.705 . . . . 72.44 111.45 -176.869 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 77.1 mt -65.76 -32.16 56.95 Favored 'Isoleucine or valine' 0 CA--C 1.551 1.002 0 C-N-CA 124.138 0.975 . . . . 74.11 110.598 176.853 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -60.35 -39.69 96.49 Favored Glycine 0 C--N 1.349 1.293 0 CA-C-N 115.685 -0.689 . . . . 72.32 112.882 172.911 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 1.8 mp -72.99 -40.32 58.98 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.06 0 N-CA-C 109.757 -0.46 . . . . 73.54 109.757 176.869 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . 0.464 ' HG ' ' O ' ' A' ' 12' ' ' ILE . 28.2 mt -58.83 -40.28 83.72 Favored 'General case' 0 N--CA 1.491 1.59 0 C-N-CA 123.113 0.565 . . . . 74.42 111.681 179.973 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -74.32 -45.77 45.19 Favored 'General case' 0 N--CA 1.479 1.009 0 C-N-CA 123.287 0.635 . . . . 72.23 110.864 176.833 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -59.18 -32.39 69.87 Favored 'General case' 0 N--CA 1.482 1.171 0 C-N-CA 123.99 0.916 . . . . 72.25 113.275 -178.871 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 2.8 pp -86.01 -37.71 12.02 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.153 0 C-N-CA 122.327 0.251 . . . . 75.4 111.324 175.628 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -63.44 -55.18 26.31 Favored 'General case' 0 N--CA 1.486 1.342 0 C-N-CA 123.792 0.837 . . . . 72.14 112.954 -174.799 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 21.5 mt -54.09 -54.51 46.6 Favored Pre-proline 0 CA--C 1.563 1.444 0 N-CA-C 113.66 0.985 . . . . 64.34 113.66 -174.956 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 37.7 Cg_endo -66.08 -40.42 15.87 Favored 'Trans proline' 0 C--N 1.378 2.103 0 CA-C-N 121.619 1.614 . . . . 72.5 112.894 176.107 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 5.7 tt0 -59.58 -41.75 90.94 Favored 'General case' 0 N--CA 1.485 1.314 0 C-N-CA 123.565 0.746 . . . . 65.33 110.829 -177.566 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 24' ' ' PHE . . . . . . . . . . . . . 19.1 m-85 -92.59 -33.9 14.24 Favored 'General case' 0 N--CA 1.484 1.234 0 CA-C-N 114.65 -1.159 . . . . 64.24 112.005 -172.068 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 25' ' ' SER . . . . . 0.41 ' O ' HG22 ' A' ' 29' ' ' VAL . 43.3 t -61.82 -53.34 57.26 Favored 'General case' 0 N--CA 1.49 1.545 0 N-CA-C 110.284 -0.265 . . . . 62.42 110.284 170.764 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -63.58 -27.38 69.21 Favored 'General case' 0 N--CA 1.48 1.037 0 C-N-CA 123.384 0.673 . . . . 73.44 112.333 176.308 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 66.6 t80 -66.22 -48.48 70.44 Favored 'General case' 0 N--CA 1.482 1.171 0 C-N-CA 122.975 0.51 . . . . 70.34 111.386 176.904 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 13.7 mmt180 -67.65 -29.72 69.1 Favored 'General case' 0 N--CA 1.476 0.853 0 O-C-N 124.067 0.854 . . . . 73.33 111.548 -179.212 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . 0.41 HG22 ' O ' ' A' ' 25' ' ' SER . 87.8 t -72.7 -48.69 44.95 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.382 0 N-CA-C 109.359 -0.608 . . . . 60.35 109.359 176.486 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 8.1 tttp -55.14 -40.41 70.53 Favored 'General case' 0 CA--C 1.549 0.931 0 C-N-CA 124.722 1.209 . . . . 74.51 111.213 172.986 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -73.83 -45.22 52.59 Favored 'General case' 0 N--CA 1.476 0.845 0 C-N-CA 122.918 0.487 . . . . 72.04 110.78 -174.045 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 53.7 t80 -64.18 -37.44 87.48 Favored 'General case' 0 CA--C 1.544 0.737 0 O-C-N 123.829 0.706 . . . . 72.11 110.676 179.636 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 93.1 m-20 -72.99 -41.68 64.06 Favored 'General case' 0 N--CA 1.485 1.287 0 C-N-CA 123.774 0.83 . . . . 71.32 112.192 178.905 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 64.7 m -68.85 -49.81 55.18 Favored 'General case' 0 N--CA 1.496 1.843 0 C-N-CA 123.184 0.594 . . . . 75.12 110.935 -179.28 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -62.61 -40.11 95.92 Favored 'General case' 0 N--CA 1.476 0.842 0 CA-C-N 115.564 -0.744 . . . . 74.13 111.333 176.345 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -61.89 -46.33 89.87 Favored 'General case' 0 N--CA 1.496 1.832 0 O-C-N 123.465 0.478 . . . . 71.52 112.219 174.793 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 67.8 m -60.34 -43.44 96.45 Favored 'General case' 0 N--CA 1.494 1.727 0 C-N-CA 123.563 0.745 . . . . 73.24 111.329 179.206 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 37.6 m -73.36 -33.72 65.23 Favored 'General case' 0 N--CA 1.476 0.834 0 CA-C-N 115.362 -0.835 . . . . 73.43 111.607 179.248 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 29.5 t70 -60.49 -52.93 63.09 Favored 'General case' 0 N--CA 1.48 1.029 0 C-N-CA 123.52 0.728 . . . . 72.02 111.338 175.872 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 4.2 pp -71.22 -31.51 67.67 Favored 'General case' 0 N--CA 1.486 1.347 0 CA-C-N 116.194 -0.457 . . . . 65.44 111.143 -172.063 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 36.2 ttm180 -80.67 -40.74 24.94 Favored 'General case' 0 CA--C 1.548 0.891 0 C-N-CA 123.131 0.572 . . . . 64.42 110.92 -179.275 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 42' ' ' ASN . . . . . 0.427 ' HA ' HG21 ' A' ' 45' ' ' THR . 19.9 t-20 -68.04 -38.07 82.09 Favored 'General case' 0 N--CA 1.489 1.501 0 N-CA-C 112.183 0.438 . . . . 71.01 112.183 -178.738 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 86.9 mt -69.99 -29.07 66.07 Favored 'General case' 0 N--CA 1.484 1.23 0 C-N-CA 122.48 0.312 . . . . 54.22 111.369 179.005 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . 0.425 ' O ' ' HG2' ' A' ' 48' ' ' GLU . 86.4 tttt -78.15 -45.08 24.2 Favored 'General case' 0 CA--C 1.542 0.655 0 CA-C-N 115.906 -0.588 . . . . 72.32 110.423 176.394 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 45' ' ' THR . . . . . 0.427 HG21 ' HA ' ' A' ' 42' ' ' ASN . 1.5 t -68.23 -30.11 69.1 Favored 'General case' 0 N--CA 1.487 1.399 0 C-N-CA 123.374 0.669 . . . . 62.02 110.832 -176.65 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -58.27 -43.91 88.15 Favored 'General case' 0 N--CA 1.474 0.762 0 CA-C-N 115.02 -0.991 . . . . 63.14 110.582 169.5 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -68.09 -39.67 82.81 Favored 'General case' 0 CA--C 1.567 1.606 0 C-N-CA 123.608 0.763 . . . . 71.41 110.832 175.016 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 48' ' ' GLU . . . . . 0.425 ' HG2' ' O ' ' A' ' 44' ' ' LYS . 25.0 mm-40 -65.49 -33.74 76.64 Favored 'General case' 0 N--CA 1.487 1.404 0 C-N-CA 123.498 0.719 . . . . 74.51 111.662 -178.309 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 43.3 t -84.15 -55.81 4.0 Favored 'General case' 0 N--CA 1.478 0.94 0 C-N-CA 122.803 0.441 . . . . 71.43 111.952 176.408 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -60.5 -53.21 60.26 Favored 'General case' 0 N--CA 1.479 1.017 0 C-N-CA 123.414 0.686 . . . . 36.86 112.408 -175.457 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 51' ' ' PHE . . . . . . . . . . . . . 80.1 t80 . . . . . 0 N--CA 1.481 1.09 0 CA-C-O 120.665 0.269 . . . . 72.23 111.607 -173.72 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 2' ' ' THR . . . . . 0.643 HG21 ' H ' ' A' ' 4' ' ' ILE . 19.7 m . . . . . 0 N--CA 1.484 1.275 0 CA-C-O 120.6 0.238 . . . . 73.33 111.455 . . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 3' ' ' LEU . . . . . 0.406 ' O ' ' HG ' ' A' ' 7' ' ' LEU . 2.5 pt? -57.41 -27.87 62.76 Favored 'General case' 0 N--CA 1.484 1.225 0 C-N-CA 123.603 0.761 . . . . 70.4 112.449 175.218 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 4' ' ' ILE . . . . . 0.643 ' H ' HG21 ' A' ' 2' ' ' THR . 51.8 mm -84.42 -44.94 17.97 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.109 0 C-N-CA 123.37 0.668 . . . . 75.43 110.996 -176.708 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 5' ' ' GLU . . . . . 0.424 ' O ' HG23 ' A' ' 9' ' ' VAL . 22.4 mm-40 -58.69 -39.66 81.38 Favored 'General case' 0 N--CA 1.481 1.093 0 O-C-N 123.432 0.457 . . . . 72.2 111.357 176.126 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 2.4 pp -69.34 -31.61 70.16 Favored 'General case' 0 N--CA 1.484 1.226 0 C-N-CA 122.351 0.26 . . . . 73.54 111.33 178.923 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 7' ' ' LEU . . . . . 0.406 ' HG ' ' O ' ' A' ' 3' ' ' LEU . 90.5 mt -64.15 -37.34 87.12 Favored 'General case' 0 N--CA 1.484 1.241 0 C-N-CA 122.464 0.305 . . . . 64.21 111.579 172.035 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 84.0 mt -68.7 -43.48 83.04 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.078 0 C-N-CA 123.252 0.621 . . . . 73.45 111.645 175.446 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . 0.424 HG23 ' O ' ' A' ' 5' ' ' GLU . 95.9 t -59.53 -48.34 87.64 Favored 'Isoleucine or valine' 0 CA--C 1.556 1.196 0 C-N-CA 123.657 0.783 . . . . 74.02 111.928 175.323 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 5.5 p -69.77 -25.13 27.71 Favored 'Isoleucine or valine' 0 CA--C 1.557 1.215 0 C-N-CA 122.77 0.428 . . . . 75.03 111.374 179.281 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -68.66 -55.61 10.88 Favored 'General case' 0 C--N 1.36 1.038 0 C-N-CA 122.766 0.426 . . . . 63.2 111.366 175.196 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 12' ' ' ILE . . . . . 0.558 ' HA ' HD11 ' A' ' 15' ' ' ILE . 23.1 pt -65.15 -45.46 93.97 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.966 0 C-N-CA 123.3 0.64 . . . . 72.22 111.819 -177.703 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 72.5 mt -68.15 -28.84 42.43 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.918 0 C-N-CA 123.562 0.745 . . . . 51.04 110.479 174.712 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -61.71 -38.75 96.42 Favored Glycine 0 C--N 1.346 1.109 0 CA-C-N 116.046 -0.525 . . . . 62.55 112.822 173.057 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 15' ' ' ILE . . . . . 0.558 HD11 ' HA ' ' A' ' 12' ' ' ILE . 14.4 mt -70.71 -44.32 76.55 Favored 'Isoleucine or valine' 0 C--N 1.352 0.682 0 C-N-CA 123.064 0.545 . . . . 75.05 109.929 175.387 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . 0.479 ' HG ' ' O ' ' A' ' 12' ' ' ILE . 22.0 mt -58.57 -40.42 83.05 Favored 'General case' 0 N--CA 1.482 1.165 0 O-C-N 123.791 0.682 . . . . 65.32 111.501 179.669 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -72.01 -51.92 19.5 Favored 'General case' 0 N--CA 1.476 0.843 0 C-N-CA 123.053 0.541 . . . . 71.21 110.754 179.171 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -55.09 -30.79 60.43 Favored 'General case' 0 N--CA 1.482 1.152 0 C-N-CA 123.981 0.913 . . . . 72.23 112.879 -179.132 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 2.7 pp -88.26 -34.51 7.19 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.256 0 N-CA-C 112.551 0.575 . . . . 71.13 112.551 174.529 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -65.79 -52.32 51.78 Favored 'General case' 0 N--CA 1.484 1.251 0 C-N-CA 123.074 0.55 . . . . 41.44 112.264 -173.268 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 2.1 mp -54.61 -54.12 52.52 Favored Pre-proline 0 CA--C 1.574 1.894 0 N-CA-C 112.851 0.686 . . . . 63.12 112.851 -174.733 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 36.7 Cg_endo -65.13 -42.25 14.35 Favored 'Trans proline' 0 C--N 1.38 2.221 0 CA-C-N 121.065 1.416 . . . . 74.24 113.115 175.113 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 28.8 tt0 -62.76 -34.41 77.16 Favored 'General case' 0 N--CA 1.486 1.357 0 C-N-CA 123.358 0.663 . . . . 74.14 111.001 -177.859 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 24' ' ' PHE . . . . . . . . . . . . . 84.3 t80 -84.42 -42.06 16.04 Favored 'General case' 0 N--CA 1.484 1.229 0 C-N-CA 123.912 0.885 . . . . 71.24 110.49 -174.137 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 26.4 t -67.16 -28.34 68.04 Favored 'General case' 0 N--CA 1.479 1.004 0 CA-C-N 116.402 -0.363 . . . . 71.35 110.582 175.253 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -79.94 -29.81 39.79 Favored 'General case' 0 C--O 1.214 -0.808 0 C-N-CA 123.109 0.564 . . . . 55.54 111.717 172.737 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 78.7 t80 -71.97 -45.8 59.72 Favored 'General case' 0 N--CA 1.487 1.408 0 C-N-CA 123.89 0.876 . . . . 72.34 111.722 -175.539 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 39.3 ptt180 -68.23 -29.32 68.12 Favored 'General case' 0 N--CA 1.477 0.92 0 CA-C-N 115.181 -0.918 . . . . 52.22 111.309 179.74 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 79.3 t -83.3 -34.89 11.38 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.375 0 CA-C-N 115.699 -0.682 . . . . 73.11 110.136 178.896 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 10.8 tttp -61.25 -42.87 99.37 Favored 'General case' 0 C--O 1.214 -0.769 0 C-N-CA 124.061 0.944 . . . . 54.22 109.783 168.69 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -71.04 -42.46 69.46 Favored 'General case' 0 N--CA 1.476 0.842 0 N-CA-C 109.935 -0.395 . . . . 74.35 109.935 -176.686 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 74.9 t80 -62.53 -62.48 1.71 Allowed 'General case' 0 C--O 1.215 -0.715 0 CA-C-N 115.57 -0.741 . . . . 74.14 110.977 178.828 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 85.4 m-20 -66.95 -44.46 80.51 Favored 'General case' 0 N--CA 1.485 1.275 0 N-CA-C 113.664 0.987 . . . . 73.24 113.664 -174.535 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 47.0 t -68.01 -52.85 30.9 Favored 'General case' 0 N--CA 1.497 1.918 0 CA-C-N 117.636 0.198 . . . . 75.33 111.09 -176.321 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -62.8 -41.36 99.25 Favored 'General case' 0 C--O 1.212 -0.882 0 O-C-N 123.446 0.466 . . . . 41.0 111.27 177.765 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -59.82 -50.44 73.78 Favored 'General case' 0 N--CA 1.498 1.937 0 N-CA-C 112.24 0.459 . . . . 72.12 112.24 178.379 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 66.8 m -63.81 -37.55 87.8 Favored 'General case' 0 N--CA 1.486 1.356 0 C-N-CA 123.331 0.652 . . . . 73.12 111.891 -179.277 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 79.9 p -80.97 -25.52 37.26 Favored 'General case' 0 N--CA 1.482 1.135 0 C-N-CA 122.844 0.458 . . . . 72.14 111.997 -178.626 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 39' ' ' ASP . . . . . 0.427 ' O ' ' HG ' ' A' ' 43' ' ' LEU . 94.6 m-20 -65.69 -52.65 49.75 Favored 'General case' 0 C--O 1.211 -0.958 0 N-CA-C 109.336 -0.616 . . . . 72.34 109.336 167.254 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 98.5 mt -64.37 -29.83 70.89 Favored 'General case' 0 N--CA 1.481 1.11 0 C-N-CA 123.483 0.713 . . . . 75.32 111.63 -176.516 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 47.4 ttp180 -75.29 -43.21 52.34 Favored 'General case' 0 CA--C 1.546 0.809 0 C-N-CA 123.536 0.734 . . . . 73.4 110.663 175.213 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 62.4 t30 -69.68 -34.49 74.03 Favored 'General case' 0 N--CA 1.488 1.471 0 C-N-CA 123.467 0.707 . . . . 54.53 112.221 -179.78 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . 0.427 ' HG ' ' O ' ' A' ' 39' ' ' ASP . 89.8 mt -77.21 -32.01 55.61 Favored 'General case' 0 N--CA 1.478 0.949 0 C-N-CA 123.007 0.523 . . . . 75.22 110.12 179.37 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . 0.413 ' O ' ' HG2' ' A' ' 48' ' ' GLU . 38.8 ttpt -77.55 -36.87 51.82 Favored 'General case' 0 N--CA 1.477 0.885 0 C-N-CA 122.913 0.485 . . . . 53.2 110.602 179.091 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 1.7 t -70.57 -30.93 67.77 Favored 'General case' 0 N--CA 1.485 1.298 0 CA-C-O 121.369 0.604 . . . . 74.31 110.753 179.438 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -66.42 -43.86 84.55 Favored 'General case' 0 N--CA 1.479 1.003 0 CA-C-N 114.86 -1.064 . . . . 64.54 111.101 168.915 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 36.5 tp -63.71 -34.52 78.07 Favored 'General case' 0 CA--C 1.554 1.13 0 C-N-CA 123.648 0.779 . . . . 72.13 111.308 177.132 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 48' ' ' GLU . . . . . 0.413 ' HG2' ' O ' ' A' ' 44' ' ' LYS . 80.9 mm-40 -67.32 -47.84 69.34 Favored 'General case' 0 N--CA 1.474 0.762 0 C-N-CA 123.582 0.753 . . . . 71.05 110.115 173.356 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 40.5 t -57.63 -44.13 85.33 Favored 'General case' 0 N--CA 1.483 1.215 0 C-N-CA 123.681 0.792 . . . . 60.45 112.852 -176.435 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -72.41 -52.28 16.66 Favored 'General case' 0 N--CA 1.481 1.091 0 C-N-CA 123.407 0.683 . . . . 50.03 112.66 178.863 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 51' ' ' PHE . . . . . . . . . . . . . 41.5 t80 . . . . . 0 N--CA 1.486 1.357 0 CA-C-N 115.635 -0.712 . . . . 71.33 111.45 -170.344 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 4.7 t . . . . . 0 N--CA 1.481 1.078 0 CA-C-O 120.557 0.218 . . . . 70.52 110.605 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 9.3 mp -59.95 -18.97 49.4 Favored 'General case' 0 N--CA 1.481 1.1 0 C-N-CA 123.272 0.629 . . . . 73.22 111.01 176.244 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 50.3 mm -64.07 -49.79 79.91 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.102 0 C-N-CA 123.505 0.722 . . . . 73.54 110.822 174.962 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 40.8 mm-40 -57.95 -47.71 82.1 Favored 'General case' 0 N--CA 1.49 1.544 0 C-N-CA 123.376 0.67 . . . . 45.51 111.512 -179.753 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 46.9 mt -68.88 -32.7 72.55 Favored 'General case' 0 CA--C 1.547 0.853 0 CA-C-N 115.576 -0.738 . . . . 71.12 111.382 -178.108 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 42.3 tp -66.77 -37.15 84.02 Favored 'General case' 0 CA--C 1.549 0.906 0 C-N-CA 123.976 0.911 . . . . 73.2 111.659 173.855 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 96.2 mt -68.95 -50.11 56.97 Favored 'Isoleucine or valine' 0 C--N 1.35 0.606 0 C-N-CA 123.636 0.775 . . . . 71.44 111.245 176.946 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 88.3 t -60.07 -43.03 91.85 Favored 'Isoleucine or valine' 0 CA--C 1.554 1.107 0 C-N-CA 123.119 0.568 . . . . 71.21 111.482 179.345 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 2.7 p -69.24 -31.45 49.87 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.093 0 O-C-N 122.328 -0.233 . . . . 73.32 111.595 177.482 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -68.24 -57.52 5.85 Favored 'General case' 0 C--N 1.363 1.162 0 C-N-CA 123.141 0.576 . . . . 53.32 111.193 179.308 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 12' ' ' ILE . . . . . 0.496 ' O ' ' HG ' ' A' ' 16' ' ' LEU . 21.9 pt -60.33 -46.99 94.18 Favored 'Isoleucine or valine' 0 CA--C 1.554 1.101 0 C-N-CA 123.776 0.83 . . . . 73.12 112.055 -177.943 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 1.7 mp -62.03 -35.48 68.72 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.558 0 C-N-CA 123.721 0.808 . . . . 75.43 110.345 174.887 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -62.07 -39.64 97.88 Favored Glycine 0 C--N 1.352 1.418 0 CA-C-N 115.554 -0.748 . . . . 71.31 113.067 176.241 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 15' ' ' ILE . . . . . 0.47 HD11 ' HA ' ' A' ' 12' ' ' ILE . 21.7 mt -69.59 -40.49 79.59 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.917 0 C-N-CA 123.507 0.723 . . . . 62.34 111.088 176.686 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . 0.496 ' HG ' ' O ' ' A' ' 12' ' ' ILE . 21.8 mt -57.75 -40.06 78.84 Favored 'General case' 0 N--CA 1.489 1.491 0 C-N-CA 123.207 0.603 . . . . 74.14 111.192 178.647 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -76.84 -49.18 16.38 Favored 'General case' 0 N--CA 1.48 1.026 0 C-N-CA 123.391 0.676 . . . . 65.01 111.478 179.067 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -59.43 -26.18 64.96 Favored 'General case' 0 N--CA 1.483 1.2 0 C-N-CA 124.182 0.993 . . . . 71.14 113.263 -176.485 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 2.8 pp -87.22 -38.51 12.2 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.382 0 CA-C-N 117.915 0.325 . . . . 74.11 111.741 170.556 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -65.19 -56.85 10.47 Favored 'General case' 0 N--CA 1.478 0.934 0 C-N-CA 123.568 0.747 . . . . 72.2 112.807 -170.276 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 2.6 mp -58.9 -50.99 85.0 Favored Pre-proline 0 CA--C 1.571 1.777 0 N-CA-C 113.228 0.825 . . . . 71.15 113.228 -173.503 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 37.7 Cg_endo -65.99 -36.51 30.04 Favored 'Trans proline' 0 C--N 1.382 2.338 0 C-N-CA 121.72 1.613 . . . . 63.05 113.354 176.395 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 22.0 tt0 -65.31 -36.88 85.42 Favored 'General case' 0 N--CA 1.489 1.504 0 CA-C-O 121.489 0.661 . . . . 74.02 109.788 178.851 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 24' ' ' PHE . . . . . . . . . . . . . 64.3 t80 -76.04 -39.92 54.56 Favored 'General case' 0 N--CA 1.484 1.261 0 CA-C-N 113.994 -1.457 . . . . 74.32 110.689 -177.951 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 44.4 t -58.3 -52.25 66.38 Favored 'General case' 0 N--CA 1.478 0.947 0 C-N-CA 123.769 0.828 . . . . 75.05 110.582 173.9 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -64.11 -28.56 69.85 Favored 'General case' 0 N--CA 1.484 1.232 0 C-N-CA 123.683 0.793 . . . . 72.23 112.269 176.636 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 47.8 t80 -75.69 -46.01 33.67 Favored 'General case' 0 N--CA 1.484 1.271 0 C-N-CA 123.085 0.554 . . . . 74.13 111.442 -176.503 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 14.3 ptm180 -73.78 -23.69 59.74 Favored 'General case' 0 N--CA 1.474 0.749 0 CA-C-N 115.42 -0.809 . . . . 62.3 111.082 -179.499 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 28.3 t -69.32 -58.79 4.64 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.781 0 N-CA-C 109.389 -0.597 . . . . 54.54 109.389 171.328 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . 0.421 ' O ' ' HB3' ' A' ' 34' ' ' SER . 21.1 ptmt -65.98 -17.24 64.55 Favored 'General case' 0 N--CA 1.486 1.366 0 N-CA-C 112.253 0.464 . . . . 63.52 112.253 -179.223 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -72.95 -46.17 53.96 Favored 'General case' 0 N--CA 1.479 0.99 0 CA-C-O 121.334 0.588 . . . . 73.22 109.696 172.633 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 12.5 t80 -89.36 -9.99 48.31 Favored 'General case' 0 N--CA 1.488 1.447 0 CA-C-N 115.244 -0.889 . . . . 75.02 112.195 -173.59 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 29.6 m-80 -101.5 -58.8 1.81 Allowed 'General case' 0 N--CA 1.47 0.574 0 CA-C-N 115.552 -0.749 . . . . 71.35 110.479 172.93 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 34' ' ' SER . . . . . 0.421 ' HB3' ' O ' ' A' ' 30' ' ' LYS . 47.2 t -83.54 -52.03 6.82 Favored 'General case' 0 N--CA 1.496 1.849 0 CA-C-N 116.745 -0.207 . . . . 71.24 111.552 -168.405 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -69.15 -32.28 71.53 Favored 'General case' 0 N--CA 1.486 1.348 0 C-N-CA 122.165 0.186 . . . . 60.31 111.148 179.546 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -72.12 -38.52 69.26 Favored 'General case' 0 N--CA 1.478 0.97 0 C-N-CA 122.745 0.418 . . . . 62.2 111.25 176.028 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 36.4 t -66.11 -32.39 73.82 Favored 'General case' 0 N--CA 1.494 1.773 0 C-N-CA 122.526 0.331 . . . . 53.24 111.443 174.355 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 38' ' ' SER . . . . . 0.499 ' HA ' ' HB3' ' A' ' 41' ' ' ARG . 52.7 m -80.37 -23.52 40.44 Favored 'General case' 0 N--CA 1.48 1.062 0 C-N-CA 123.489 0.716 . . . . 74.2 111.323 177.798 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 39' ' ' ASP . . . . . 0.427 ' O ' ' HG ' ' A' ' 43' ' ' LEU . 24.0 t70 -68.79 -46.94 67.39 Favored 'General case' 0 CA--C 1.553 1.072 0 C-N-CA 122.985 0.514 . . . . 74.45 110.597 168.718 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 11.1 mp -69.68 -27.76 65.29 Favored 'General case' 0 N--CA 1.482 1.152 0 C-N-CA 123.378 0.671 . . . . 71.43 111.481 176.634 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 41' ' ' ARG . . . . . 0.499 ' HB3' ' HA ' ' A' ' 38' ' ' SER . 51.5 ttt180 -69.78 -41.02 75.68 Favored 'General case' 0 N--CA 1.478 0.975 0 C-N-CA 123.701 0.8 . . . . 75.35 110.033 171.738 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 52.9 t30 -60.15 -36.04 76.67 Favored 'General case' 0 CA--C 1.554 1.108 0 C-N-CA 123.793 0.837 . . . . 65.24 111.2 175.33 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . 0.427 ' HG ' ' O ' ' A' ' 39' ' ' ASP . 77.4 mt -79.76 -35.76 38.25 Favored 'General case' 0 N--CA 1.478 0.974 0 C-N-CA 123.272 0.629 . . . . 64.21 111.38 178.171 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 22.5 tptm -70.24 -45.31 66.73 Favored 'General case' 0 N--CA 1.481 1.087 0 N-CA-C 109.912 -0.403 . . . . 73.22 109.912 -177.343 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 45' ' ' THR . . . . . 0.485 ' HA ' ' HG2' ' A' ' 48' ' ' GLU . 3.2 t -67.44 -33.63 75.55 Favored 'General case' 0 N--CA 1.473 0.71 0 CA-C-N 114.864 -1.062 . . . . 72.03 111.158 179.622 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -63.39 -52.24 62.48 Favored 'General case' 0 N--CA 1.477 0.882 0 C-N-CA 123.461 0.705 . . . . 73.4 111.356 176.388 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 10.8 mp -67.08 -46.33 74.59 Favored 'General case' 0 N--CA 1.478 0.964 0 C-N-CA 123.01 0.524 . . . . 73.03 112.156 -179.887 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 48' ' ' GLU . . . . . 0.485 ' HG2' ' HA ' ' A' ' 45' ' ' THR . 11.1 pt-20 -67.51 -33.55 75.32 Favored 'General case' 0 N--CA 1.487 1.398 0 CA-C-N 117.935 0.334 . . . . 72.23 111.22 -176.407 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 48.2 t -74.86 -32.97 62.03 Favored 'General case' 0 N--CA 1.478 0.961 0 C-N-CA 123.242 0.617 . . . . 73.44 111.031 175.951 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -70.63 -44.36 67.33 Favored 'General case' 0 N--CA 1.489 1.512 0 CA-C-O 121.207 0.527 . . . . 72.23 110.722 -178.674 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 51' ' ' PHE . . . . . . . . . . . . . 58.1 m-85 . . . . . 0 CA--C 1.549 0.93 0 CA-C-N 115.238 -0.892 . . . . 73.41 111.614 175.703 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 57.5 p . . . . . 0 N--CA 1.487 1.377 0 CA-C-O 120.7 0.286 . . . . 51.24 111.206 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 9.3 tt -61.07 -23.45 65.48 Favored 'General case' 0 N--CA 1.486 1.369 0 C-N-CA 123.347 0.659 . . . . 73.13 110.32 171.603 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 51.4 mm -83.0 -43.42 18.47 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.692 0 CA-C-N 115.586 -0.734 . . . . 72.31 110.001 -178.542 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 70.7 mm-40 -56.76 -42.83 80.03 Favored 'General case' 0 N--CA 1.483 1.203 0 C-N-CA 123.55 0.74 . . . . 65.12 111.658 173.943 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 2.4 pp -71.19 -37.91 72.13 Favored 'General case' 0 N--CA 1.476 0.869 0 O-C-N 123.31 0.382 . . . . 74.31 110.924 178.651 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -61.48 -46.66 89.1 Favored 'General case' 0 CA--C 1.551 1.011 0 C-N-CA 122.941 0.496 . . . . 74.54 110.765 177.978 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 95.2 mt -67.65 -49.88 66.08 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.721 0 C-N-CA 123.857 0.863 . . . . 70.43 112.341 -177.938 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 7.2 p -60.38 -41.13 86.21 Favored 'Isoleucine or valine' 0 CA--C 1.555 1.137 0 CA-C-N 118.194 0.452 . . . . 52.1 111.852 -177.05 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 74.1 t -68.81 -39.83 80.57 Favored 'Isoleucine or valine' 0 CA--C 1.555 1.16 0 C-N-CA 122.909 0.484 . . . . 72.33 111.307 174.858 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -64.27 -51.57 62.91 Favored 'General case' 0 N--CA 1.487 1.379 0 C-N-CA 122.835 0.454 . . . . 64.23 111.855 -178.733 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 12' ' ' ILE . . . . . 0.536 ' O ' ' HG ' ' A' ' 16' ' ' LEU . 22.9 pt -62.28 -48.14 89.76 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.776 0 C-N-CA 123.533 0.733 . . . . 74.42 111.471 -176.464 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 86.2 mt -63.69 -31.72 54.13 Favored 'Isoleucine or valine' 0 C--N 1.361 1.097 0 C-N-CA 123.306 0.642 . . . . 63.12 110.925 177.99 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -60.92 -40.66 98.68 Favored Glycine 0 C--N 1.35 1.341 0 CA-C-N 115.562 -0.745 . . . . 74.04 112.961 174.134 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 15' ' ' ILE . . . . . 0.535 HD12 ' HA ' ' A' ' 12' ' ' ILE . 14.5 mt -71.35 -43.78 73.09 Favored 'Isoleucine or valine' 0 C--N 1.355 0.811 0 C-N-CA 123.282 0.633 . . . . 73.11 110.465 177.061 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . 0.536 ' HG ' ' O ' ' A' ' 12' ' ' ILE . 34.5 mt -58.23 -39.62 79.59 Favored 'General case' 0 N--CA 1.486 1.356 0 C-N-CA 123.54 0.736 . . . . 73.22 111.283 -177.578 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -73.49 -48.68 31.49 Favored 'General case' 0 N--CA 1.478 0.97 0 C-N-CA 123.016 0.526 . . . . 74.52 110.913 177.559 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -63.96 -23.9 67.52 Favored 'General case' 0 N--CA 1.482 1.149 0 N-CA-C 113.53 0.937 . . . . 62.14 113.53 -176.756 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 2.8 pp -89.76 -38.26 10.86 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.28 0 CA-C-N 118.213 0.461 . . . . 70.31 111.359 172.362 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -63.6 -47.63 80.67 Favored 'General case' 0 N--CA 1.486 1.373 0 C-N-CA 123.429 0.692 . . . . 65.22 112.789 -175.177 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 27.5 mt -57.43 -54.62 53.03 Favored Pre-proline 0 CA--C 1.563 1.462 0 CA-C-O 118.097 -0.954 . . . . 74.44 113.281 -176.692 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 39.4 Cg_endo -66.13 -37.42 25.41 Favored 'Trans proline' 0 C--N 1.378 2.09 0 CA-C-N 121.504 1.573 . . . . 64.42 113.093 174.149 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 23.8 tt0 -63.34 -37.1 85.95 Favored 'General case' 0 N--CA 1.49 1.573 0 C-N-CA 123.519 0.728 . . . . 71.52 110.802 -177.671 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 24' ' ' PHE . . . . . . . . . . . . . 70.1 t80 -93.8 -36.46 12.25 Favored 'General case' 0 N--CA 1.487 1.407 0 CA-C-N 114.685 -1.143 . . . . 71.54 111.315 -173.055 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 25' ' ' SER . . . . . 0.487 ' O ' HG22 ' A' ' 29' ' ' VAL . 39.5 t -59.55 -53.26 60.1 Favored 'General case' 0 N--CA 1.486 1.334 0 N-CA-C 110.05 -0.352 . . . . 72.03 110.05 170.983 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -65.13 -28.15 69.23 Favored 'General case' 0 N--CA 1.488 1.474 0 C-N-CA 123.668 0.787 . . . . 63.12 112.518 176.866 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 84.6 t80 -63.25 -51.07 67.68 Favored 'General case' 0 N--CA 1.487 1.38 0 CA-C-O 120.835 0.35 . . . . 75.41 110.209 172.697 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 57.0 mtp180 -65.82 -24.63 66.95 Favored 'General case' 0 N--CA 1.47 0.571 0 CA-C-N 115.465 -0.789 . . . . 74.23 111.721 179.475 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . 0.487 HG22 ' O ' ' A' ' 25' ' ' SER . 79.6 t -68.98 -56.29 12.52 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.09 0 N-CA-C 109.871 -0.418 . . . . 74.45 109.871 174.341 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 48.4 pttt -67.6 -24.68 65.51 Favored 'General case' 0 CA--C 1.546 0.814 0 CA-C-N 115.491 -0.777 . . . . 73.44 111.545 -176.85 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -81.65 -37.64 27.17 Favored 'General case' 0 N--CA 1.485 1.305 0 CA-C-O 121.313 0.578 . . . . 71.41 110.002 -178.522 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 21.4 t80 -76.94 -16.03 59.49 Favored 'General case' 0 N--CA 1.483 1.178 0 CA-C-N 115.048 -0.978 . . . . 74.4 111.079 -179.85 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 85.6 m-20 -94.89 -50.76 4.98 Favored 'General case' 0 N--CA 1.478 0.95 0 C-N-CA 123.798 0.839 . . . . 71.42 111.857 173.957 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 46.9 t -70.54 -52.8 19.23 Favored 'General case' 0 N--CA 1.501 2.085 0 N-CA-C 111.864 0.32 . . . . 70.33 111.864 -172.16 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -66.44 -29.78 70.0 Favored 'General case' 0 N--CA 1.479 0.99 0 C-N-CA 122.998 0.519 . . . . 54.44 111.706 179.089 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -65.99 -59.02 4.23 Favored 'General case' 0 N--CA 1.482 1.161 0 C-N-CA 122.848 0.459 . . . . 61.35 111.136 174.144 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 66.2 m -53.65 -40.55 65.96 Favored 'General case' 0 N--CA 1.482 1.143 0 C-N-CA 123.846 0.858 . . . . 74.12 111.984 179.174 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 47.7 t -76.0 -38.31 57.5 Favored 'General case' 0 N--CA 1.48 1.072 0 C-N-CA 123.105 0.562 . . . . 74.32 112.446 -176.945 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 38.5 t70 -63.72 -47.02 82.77 Favored 'General case' 0 N--CA 1.483 1.183 0 CA-C-O 121.266 0.555 . . . . 72.44 111.435 176.981 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 70.0 mt -78.66 -32.63 47.26 Favored 'General case' 0 N--CA 1.476 0.849 0 CA-C-N 115.113 -0.948 . . . . 73.33 110.78 -172.658 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 17.3 ttp180 -71.68 -35.28 70.25 Favored 'General case' 0 N--CA 1.479 1.002 0 C-N-CA 122.602 0.361 . . . . 71.13 110.244 174.643 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 28.6 t-20 -61.23 -39.76 91.49 Favored 'General case' 0 N--CA 1.485 1.316 0 C-N-CA 123.232 0.613 . . . . 71.11 111.258 171.903 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 87.2 mt -69.58 -34.12 73.69 Favored 'General case' 0 N--CA 1.48 1.026 0 C-N-CA 122.757 0.423 . . . . 52.0 111.072 177.849 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 55.8 tptt -80.58 -35.41 34.27 Favored 'General case' 0 CA--C 1.548 0.866 0 C-N-CA 123.574 0.749 . . . . 74.43 111.214 -176.636 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 3.2 t -74.35 -38.57 63.2 Favored 'General case' 0 N--CA 1.482 1.129 0 CA-C-O 121.226 0.536 . . . . 64.21 110.389 -178.022 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -71.69 -35.66 70.33 Favored 'General case' 0 N--CA 1.478 0.961 0 CA-C-N 115.193 -0.912 . . . . 61.42 111.21 174.012 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 69.8 tp -57.77 -62.65 1.65 Allowed 'General case' 0 C--N 1.359 1.021 0 O-C-N 123.89 0.744 . . . . 73.52 110.705 175.118 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 33.4 mm-40 -59.89 -32.92 71.18 Favored 'General case' 0 N--CA 1.489 1.502 0 C-N-CA 123.661 0.784 . . . . 71.34 112.583 -173.435 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 25.3 t -61.63 -52.23 65.22 Favored 'General case' 0 CA--C 1.551 1.004 0 CA-C-N 115.439 -0.8 . . . . 70.14 111.18 178.267 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -78.38 -34.1 48.42 Favored 'General case' 0 N--CA 1.486 1.36 0 C-N-CA 123.43 0.692 . . . . 72.21 112.33 -179.018 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 51' ' ' PHE . . . . . . . . . . . . . 75.1 t80 . . . . . 0 N--CA 1.488 1.456 0 C-N-CA 125.25 1.42 . . . . 72.44 110.572 -176.146 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 72.4 p . . . . . 0 N--CA 1.491 1.598 0 CA-C-O 120.488 0.185 . . . . 74.51 110.851 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 2.4 pt? -60.72 -21.33 62.83 Favored 'General case' 0 N--CA 1.489 1.494 0 C-N-CA 123.567 0.747 . . . . 75.3 111.348 171.179 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 49.2 mm -69.33 -47.57 72.56 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.087 0 C-N-CA 123.821 0.848 . . . . 73.31 110.316 176.353 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 22.9 mm-40 -59.94 -42.22 93.55 Favored 'General case' 0 N--CA 1.484 1.229 0 C-N-CA 123.441 0.696 . . . . 74.14 111.355 175.41 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 83.4 mt -63.75 -37.34 86.98 Favored 'General case' 0 N--CA 1.487 1.408 0 C-N-CA 123.19 0.596 . . . . 72.44 111.835 176.508 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 6.7 tt -64.51 -43.09 95.16 Favored 'General case' 0 CA--C 1.548 0.883 0 C-N-CA 124.026 0.931 . . . . 72.44 110.108 176.416 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 96.0 mt -67.95 -42.1 85.26 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.943 0 C-N-CA 123.546 0.738 . . . . 74.54 111.762 179.193 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 79.1 t -63.48 -45.72 97.1 Favored 'Isoleucine or valine' 0 CA--C 1.556 1.177 0 C-N-CA 123.325 0.65 . . . . 73.33 111.601 176.764 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 3.1 p -69.36 -26.48 31.58 Favored 'Isoleucine or valine' 0 CA--C 1.56 1.338 0 C-N-CA 122.368 0.267 . . . . 74.22 111.603 177.864 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -73.89 -55.35 6.29 Favored 'General case' 0 N--CA 1.48 1.046 0 C-N-CA 123.242 0.617 . . . . 73.23 111.272 178.673 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 12' ' ' ILE . . . . . 0.517 ' O ' ' HG ' ' A' ' 16' ' ' LEU . 16.3 pt -57.3 -53.28 45.81 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.039 0 C-N-CA 122.943 0.497 . . . . 72.3 111.435 -179.853 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 80.1 mt -66.6 -32.81 59.71 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.967 0 C-N-CA 123.777 0.831 . . . . 71.52 110.869 -179.56 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -60.81 -42.37 99.49 Favored Glycine 0 C--N 1.353 1.481 0 O-C-N 123.628 0.58 . . . . 74.44 113.651 176.796 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 1.8 mp -75.74 -34.93 29.57 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.255 0 C-N-CA 122.856 0.462 . . . . 72.44 110.408 177.249 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . 0.517 ' HG ' ' O ' ' A' ' 12' ' ' ILE . 19.3 mt -62.31 -39.06 91.79 Favored 'General case' 0 N--CA 1.489 1.523 0 C-N-CA 122.377 0.271 . . . . 73.55 111.089 176.409 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -74.28 -39.9 62.66 Favored 'General case' 0 N--CA 1.477 0.888 0 C-N-CA 123.529 0.732 . . . . 72.34 110.944 177.501 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -62.48 -24.06 67.25 Favored 'General case' 0 N--CA 1.483 1.176 0 C-N-CA 123.894 0.878 . . . . 74.3 112.947 178.835 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 2.8 pp -96.85 -37.63 7.25 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.208 0 N-CA-C 111.846 0.313 . . . . 72.54 111.846 171.723 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -67.62 -48.47 66.67 Favored 'General case' 0 N--CA 1.493 1.713 0 N-CA-C 112.891 0.701 . . . . 73.14 112.891 -173.011 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 27.9 mt -58.79 -52.56 73.85 Favored Pre-proline 0 CA--C 1.556 1.199 0 CA-C-O 118.059 -0.972 . . . . 74.21 113.18 -178.565 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 42.9 Cg_endo -67.09 -36.96 20.16 Favored 'Trans proline' 0 C--N 1.378 2.101 0 CA-C-N 121.77 1.668 . . . . 54.44 113.123 174.115 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 28.6 tt0 -66.64 -32.45 73.78 Favored 'General case' 0 N--CA 1.491 1.599 0 C-N-CA 122.854 0.462 . . . . 64.32 110.52 -177.627 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 24' ' ' PHE . . . . . . . . . . . . . 85.5 t80 -90.09 -40.06 12.51 Favored 'General case' 0 N--CA 1.487 1.396 0 CA-C-N 115.366 -0.833 . . . . 70.33 111.406 -178.5 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 34.8 t -56.91 -55.24 37.08 Favored 'General case' 0 N--CA 1.488 1.449 0 C-N-CA 122.849 0.459 . . . . 55.3 110.837 172.645 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -61.89 -26.32 68.08 Favored 'General case' 0 N--CA 1.487 1.399 0 C-N-CA 123.357 0.663 . . . . 74.53 112.571 175.336 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 57.5 t80 -70.81 -51.74 24.89 Favored 'General case' 0 N--CA 1.48 1.052 0 C-N-CA 123.119 0.568 . . . . 72.43 111.104 178.534 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 13.6 ptm180 -70.53 -21.57 62.71 Favored 'General case' 0 N--CA 1.475 0.824 0 C-N-CA 123.184 0.593 . . . . 74.32 111.108 -177.707 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 49.1 t -73.96 -52.79 19.39 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.969 0 CA-C-N 115.989 -0.551 . . . . 72.42 109.884 172.939 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 21.1 ptmt -70.74 -15.92 62.73 Favored 'General case' 0 N--CA 1.489 1.485 0 C-N-CA 122.773 0.429 . . . . 74.43 111.379 179.17 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -76.64 -36.46 57.39 Favored 'General case' 0 N--CA 1.481 1.1 0 CA-C-O 121.547 0.689 . . . . 64.01 109.737 172.964 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 33.4 t80 -83.61 -19.04 36.2 Favored 'General case' 0 N--CA 1.48 1.036 0 CA-C-N 115.133 -0.94 . . . . 74.31 111.87 -179.735 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -92.63 -56.46 3.01 Favored 'General case' 0 N--CA 1.473 0.722 0 CA-C-N 115.556 -0.747 . . . . 75.2 111.069 175.97 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 46.0 t -88.97 -51.71 5.47 Favored 'General case' 0 N--CA 1.497 1.882 0 CA-C-N 116.247 -0.433 . . . . 72.34 111.585 -168.802 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -71.7 -24.8 61.88 Favored 'General case' 0 N--CA 1.484 1.275 0 C-N-CA 122.656 0.382 . . . . 64.43 111.966 -178.148 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -79.43 -37.25 37.5 Favored 'General case' 0 N--CA 1.481 1.1 0 C-N-CA 122.478 0.311 . . . . 71.04 110.805 174.246 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 37.9 t -61.62 -43.47 98.8 Favored 'General case' 0 N--CA 1.494 1.748 0 C-N-CA 123.075 0.55 . . . . 75.15 111.507 173.245 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 80.1 p -75.83 -27.51 57.89 Favored 'General case' 0 N--CA 1.481 1.107 0 C-N-CA 124.127 0.971 . . . . 54.15 111.637 -177.909 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 16.8 t70 -63.08 -48.03 80.35 Favored 'General case' 0 CA--C 1.553 1.071 0 O-C-N 123.419 0.449 . . . . 64.35 110.712 169.159 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . 0.459 HD22 HD11 ' A' ' 43' ' ' LEU . 96.2 mt -71.04 -26.94 63.31 Favored 'General case' 0 N--CA 1.484 1.253 0 C-N-CA 123.199 0.6 . . . . 64.44 111.244 179.317 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 27.9 tpt180 -72.22 -37.84 69.09 Favored 'General case' 0 CA--C 1.548 0.883 0 C-N-CA 123.894 0.878 . . . . 64.11 110.136 174.845 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 44.7 t-20 -65.95 -38.89 89.77 Favored 'General case' 0 CA--C 1.56 1.329 0 C-N-CA 124.197 0.999 . . . . 55.35 110.36 174.447 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . 0.459 HD11 HD22 ' A' ' 40' ' ' LEU . 96.0 mt -69.5 -33.08 72.33 Favored 'General case' 0 N--CA 1.482 1.125 0 C-N-CA 123.167 0.587 . . . . 71.52 110.979 175.97 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . 0.447 ' O ' ' HG2' ' A' ' 48' ' ' GLU . 60.7 tttp -73.78 -46.42 45.71 Favored 'General case' 0 N--CA 1.474 0.767 0 CA-C-N 116.102 -0.499 . . . . 65.33 110.51 179.93 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 3.7 t -64.01 -32.27 73.75 Favored 'General case' 0 N--CA 1.487 1.389 0 C-N-CA 123.573 0.749 . . . . 70.3 111.168 -174.58 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -68.88 -43.46 75.28 Favored 'General case' 0 N--CA 1.478 0.945 0 CA-C-N 115.035 -0.984 . . . . 74.3 111.679 171.521 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 9.7 tt -60.7 -39.89 90.21 Favored 'General case' 0 N--CA 1.483 1.179 0 C-N-CA 123.976 0.911 . . . . 70.32 110.609 176.514 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 48' ' ' GLU . . . . . 0.447 ' HG2' ' O ' ' A' ' 44' ' ' LYS . 60.8 mm-40 -65.31 -47.87 75.06 Favored 'General case' 0 N--CA 1.476 0.85 0 C-N-CA 123.244 0.618 . . . . 74.53 110.499 179.988 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 59.5 m -61.33 -31.92 71.79 Favored 'General case' 0 N--CA 1.483 1.186 0 C-N-CA 123.356 0.663 . . . . 74.45 112.08 179.543 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -78.5 -52.1 9.01 Favored 'General case' 0 N--CA 1.482 1.156 0 C-N-CA 123.205 0.602 . . . . 72.52 111.965 -178.507 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 51' ' ' PHE . . . . . . . . . . . . . 70.6 m-85 . . . . . 0 N--CA 1.482 1.138 0 N-CA-C 113.482 0.919 . . . . 65.03 113.482 -170.207 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 38.8 p . . . . . 0 N--CA 1.495 1.775 0 CA-C-O 121.081 0.467 . . . . 75.44 111.229 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 44.4 mt -67.84 -19.04 65.01 Favored 'General case' 0 N--CA 1.484 1.271 0 C-N-CA 124.112 0.965 . . . . 75.51 111.846 178.64 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 46.6 mm -87.65 -48.96 14.96 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.167 0 CA-C-N 115.437 -0.801 . . . . 74.14 111.083 -175.362 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 9.0 tp10 -54.12 -47.66 71.61 Favored 'General case' 0 N--CA 1.475 0.78 0 C-N-CA 124.046 0.938 . . . . 70.11 110.959 175.941 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 3.0 pp -64.7 -37.08 86.37 Favored 'General case' 0 N--CA 1.48 1.069 0 C-N-CA 122.843 0.457 . . . . 74.34 111.951 -178.539 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 61.2 tp -59.31 -45.66 90.69 Favored 'General case' 0 CA--C 1.547 0.864 0 C-N-CA 123.495 0.718 . . . . 74.2 111.36 175.093 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 94.1 mt -68.4 -39.74 81.26 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.039 0 C-N-CA 124.272 1.029 . . . . 74.31 111.967 178.779 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 48.5 t -60.82 -47.9 91.23 Favored 'Isoleucine or valine' 0 CA--C 1.554 1.13 0 C-N-CA 123.645 0.778 . . . . 73.32 111.454 175.485 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 76.7 t -64.39 -32.16 56.49 Favored 'Isoleucine or valine' 0 CA--C 1.558 1.269 0 C-N-CA 123.323 0.649 . . . . 74.43 111.571 176.086 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -65.73 -57.22 8.54 Favored 'General case' 0 N--CA 1.482 1.156 0 C-N-CA 122.983 0.513 . . . . 72.14 111.584 176.181 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 12' ' ' ILE . . . . . 0.55 ' HA ' HD11 ' A' ' 15' ' ' ILE . 22.5 pt -66.14 -42.39 91.17 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.011 0 C-N-CA 123.548 0.739 . . . . 62.42 112.054 -175.122 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 58.2 mt -65.2 -34.88 73.57 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.13 0 C-N-CA 123.764 0.825 . . . . 71.12 110.57 174.149 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -60.67 -37.33 93.31 Favored Glycine 0 C--N 1.353 1.525 0 CA-C-N 115.674 -0.694 . . . . 42.11 112.67 174.402 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 15' ' ' ILE . . . . . 0.55 HD11 ' HA ' ' A' ' 12' ' ' ILE . 21.8 mt -71.31 -46.96 62.45 Favored 'Isoleucine or valine' 0 C--N 1.353 0.742 0 C-N-CA 123.577 0.751 . . . . 72.42 110.976 175.872 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . 0.465 ' HG ' ' O ' ' A' ' 12' ' ' ILE . 21.4 mt -56.2 -43.47 78.51 Favored 'General case' 0 N--CA 1.488 1.472 0 C-N-CA 123.378 0.671 . . . . 74.03 111.35 -178.554 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -74.78 -47.53 30.4 Favored 'General case' 0 CA--C 1.544 0.749 0 C-N-CA 123.36 0.664 . . . . 40.3 111.209 -178.078 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -63.91 -23.01 67.18 Favored 'General case' 0 N--CA 1.484 1.253 0 N-CA-C 113.037 0.755 . . . . 70.44 113.037 -177.926 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 2.7 pp -90.3 -38.19 10.58 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.195 0 CA-C-N 118.151 0.432 . . . . 72.34 111.502 171.973 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -63.96 -50.31 69.1 Favored 'General case' 0 N--CA 1.487 1.401 0 C-N-CA 123.549 0.74 . . . . 70.34 112.704 -175.309 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 28.5 mt -55.44 -55.51 39.21 Favored Pre-proline 0 CA--C 1.558 1.271 0 CA-C-O 118.149 -0.929 . . . . 61.43 113.308 -175.621 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 40.4 Cg_endo -66.31 -40.77 13.91 Favored 'Trans proline' 0 C--N 1.379 2.171 0 CA-C-N 121.323 1.508 . . . . 63.12 112.991 175.979 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 21.3 tt0 -62.56 -38.03 88.44 Favored 'General case' 0 N--CA 1.486 1.366 0 C-N-CA 123.273 0.629 . . . . 74.05 111.034 -175.595 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 24' ' ' PHE . . . . . . . . . . . . . 26.7 m-85 -96.28 -32.39 12.44 Favored 'General case' 0 N--CA 1.485 1.316 0 CA-C-N 115.082 -0.963 . . . . 64.14 112.104 -173.348 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 47.0 t -62.96 -55.11 28.72 Favored 'General case' 0 N--CA 1.49 1.567 0 N-CA-C 109.853 -0.425 . . . . 74.11 109.853 171.181 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -62.18 -27.06 68.71 Favored 'General case' 0 N--CA 1.483 1.204 0 C-N-CA 123.913 0.885 . . . . 64.24 112.495 177.749 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 87.9 t80 -65.42 -54.07 33.95 Favored 'General case' 0 N--CA 1.484 1.275 0 C-N-CA 122.745 0.418 . . . . 72.23 110.726 175.053 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 49.8 mtp180 -69.99 -24.3 63.29 Favored 'General case' 0 N--CA 1.481 1.121 0 C-N-CA 123.485 0.714 . . . . 73.21 111.8 -178.578 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 24.7 t -72.48 -46.17 56.72 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.266 0 CA-C-N 116.02 -0.537 . . . . 75.32 110.6 175.471 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 18.8 ptmt -79.02 -16.9 56.23 Favored 'General case' 0 N--CA 1.48 1.029 0 CA-C-N 115.715 -0.675 . . . . 72.31 111.114 178.178 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -81.9 -29.18 32.49 Favored 'General case' 0 N--CA 1.486 1.364 0 C-N-CA 123.233 0.613 . . . . 61.11 110.129 174.013 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 62.5 t80 -62.79 -53.77 49.14 Favored 'General case' 0 C--O 1.21 -1.013 0 N-CA-C 108.945 -0.761 . . . . 74.32 108.945 168.559 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 3.4 m-20 -57.23 -43.24 82.69 Favored 'General case' 0 N--CA 1.487 1.384 0 C-N-CA 123.898 0.879 . . . . 73.41 112.334 175.477 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 35.5 t -62.54 -65.94 0.61 Allowed 'General case' 0 N--CA 1.484 1.258 0 C-N-CA 123.17 0.588 . . . . 74.33 111.11 -179.86 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -65.09 -31.36 72.54 Favored 'General case' 0 N--CA 1.481 1.081 0 N-CA-C 113.016 0.747 . . . . 73.21 113.016 -176.165 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -69.46 -60.57 2.25 Favored 'General case' 0 N--CA 1.492 1.668 0 CA-C-N 117.608 0.186 . . . . 65.14 111.248 177.29 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 48.7 m -66.37 -25.06 66.62 Favored 'General case' 0 N--CA 1.484 1.257 0 C-N-CA 123.023 0.529 . . . . 72.33 112.401 -177.909 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 42.4 t -75.98 -39.26 56.28 Favored 'General case' 0 N--CA 1.491 1.603 0 C-N-CA 123.021 0.528 . . . . 64.03 111.088 176.163 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 28.2 t70 -58.01 -50.73 72.4 Favored 'General case' 0 N--CA 1.481 1.116 0 C-N-CA 123.059 0.544 . . . . 74.14 110.369 170.186 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 95.1 mt -65.01 -38.81 92.15 Favored 'General case' 0 N--CA 1.478 0.943 0 CA-C-N 115.066 -0.97 . . . . 71.44 110.937 -176.155 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 36.4 ttt180 -71.37 -54.49 10.58 Favored 'General case' 0 CA--C 1.542 0.644 0 C-N-CA 123.385 0.674 . . . . 64.22 110.678 -179.134 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 2.8 t-20 -57.55 -41.64 81.37 Favored 'General case' 0 N--CA 1.488 1.473 0 C-N-CA 124.059 0.943 . . . . 70.0 112.348 -175.06 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 98.1 mt -72.44 -47.14 51.35 Favored 'General case' 0 N--CA 1.48 1.069 0 C-N-CA 122.924 0.49 . . . . 70.23 111.083 -179.675 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 36.4 ttpt -67.27 -46.33 73.97 Favored 'General case' 0 N--CA 1.481 1.09 0 C-N-CA 123.525 0.73 . . . . 73.43 110.967 -173.893 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 45' ' ' THR . . . . . 0.506 ' HA ' ' HG2' ' A' ' 48' ' ' GLU . 1.8 t -71.76 -33.86 68.99 Favored 'General case' 0 N--CA 1.472 0.655 0 CA-C-N 115.056 -0.974 . . . . 72.24 111.357 -173.936 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -68.81 -43.06 76.38 Favored 'General case' 0 N--CA 1.475 0.791 0 CA-C-N 115.885 -0.598 . . . . 71.52 110.492 176.513 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 1.8 pp -75.96 -32.99 59.78 Favored 'General case' 0 N--CA 1.481 1.104 0 C-N-CA 122.653 0.381 . . . . 74.4 111.61 -177.073 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 48' ' ' GLU . . . . . 0.506 ' HG2' ' HA ' ' A' ' 45' ' ' THR . 11.0 pt-20 -78.6 -36.07 44.81 Favored 'General case' 0 N--CA 1.489 1.513 0 CA-C-N 117.756 0.253 . . . . 53.05 111.314 -178.208 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 67.8 m -68.59 -35.0 76.75 Favored 'General case' 0 N--CA 1.485 1.315 0 C-N-CA 123.083 0.553 . . . . 74.53 110.326 173.334 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -65.83 -42.9 89.99 Favored 'General case' 0 N--CA 1.474 0.739 0 CA-C-N 115.397 -0.819 . . . . 73.52 110.657 172.825 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 51' ' ' PHE . . . . . . . . . . . . . 61.0 t80 . . . . . 0 N--CA 1.483 1.182 0 C-N-CA 123.783 0.833 . . . . 74.31 111.468 178.994 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 2' ' ' THR . . . . . 0.544 HG21 ' H ' ' A' ' 4' ' ' ILE . 22.1 m . . . . . 0 N--CA 1.482 1.165 0 CA-C-O 120.631 0.253 . . . . 73.34 111.3 . . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 2.8 mm? -64.63 -18.16 64.68 Favored 'General case' 0 N--CA 1.49 1.563 0 C-N-CA 123.923 0.889 . . . . 73.43 111.908 178.859 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 4' ' ' ILE . . . . . 0.544 ' H ' HG21 ' A' ' 2' ' ' THR . 50.6 mm -71.18 -39.68 73.78 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.267 0 C-N-CA 123.599 0.76 . . . . 72.31 110.276 175.223 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 43.3 mt-10 -54.82 -48.26 73.04 Favored 'General case' 0 N--CA 1.485 1.275 0 C-N-CA 123.044 0.538 . . . . 65.23 111.407 175.671 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -60.96 -37.29 81.86 Favored 'General case' 0 N--CA 1.488 1.454 0 O-C-N 123.567 0.542 . . . . 73.5 110.733 -179.311 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 34.0 tp -68.6 -34.06 75.12 Favored 'General case' 0 CA--C 1.551 1.016 0 C-N-CA 123.455 0.702 . . . . 73.45 112.222 179.77 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 89.1 mt -73.62 -45.69 50.25 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.639 0 C-N-CA 123.355 0.662 . . . . 72.05 110.943 175.392 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 73.3 t -62.1 -42.93 96.93 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.868 0 C-N-CA 123.624 0.77 . . . . 52.21 111.618 179.493 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 6.1 p -68.93 -31.45 50.59 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.074 0 O-C-N 122.205 -0.309 . . . . 74.14 111.519 177.321 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -69.07 -53.49 20.07 Favored 'General case' 0 C--N 1.361 1.087 0 C-N-CA 122.775 0.43 . . . . 73.1 111.437 178.661 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 12' ' ' ILE . . . . . 0.579 ' HA ' HD13 ' A' ' 15' ' ' ILE . 29.6 pt -65.17 -45.57 93.58 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.953 0 C-N-CA 123.306 0.643 . . . . 63.25 111.636 -178.346 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 1.7 mp -61.93 -32.89 55.6 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.532 0 C-N-CA 123.717 0.807 . . . . 74.4 110.457 174.253 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -58.91 -40.3 95.11 Favored Glycine 0 C--N 1.355 1.614 0 O-C-N 123.5 0.5 . . . . 53.11 112.618 174.146 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 15' ' ' ILE . . . . . 0.579 HD13 ' HA ' ' A' ' 12' ' ' ILE . 19.2 mt -72.13 -46.81 57.09 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.748 0 C-N-CA 124.049 0.94 . . . . 71.14 110.902 175.843 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . 0.515 ' HG ' ' O ' ' A' ' 12' ' ' ILE . 25.6 mt -59.74 -37.77 79.89 Favored 'General case' 0 N--CA 1.482 1.137 0 C-N-CA 123.549 0.739 . . . . 65.23 111.6 -176.749 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -75.97 -48.03 22.7 Favored 'General case' 0 N--CA 1.474 0.756 0 C-N-CA 123.103 0.561 . . . . 63.21 110.381 178.344 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -56.92 -26.85 60.09 Favored 'General case' 0 N--CA 1.481 1.087 0 N-CA-C 113.249 0.833 . . . . 70.44 113.249 -179.139 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 2.8 pp -91.18 -38.27 10.37 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.982 0 N-CA-C 111.758 0.281 . . . . 72.15 111.758 172.117 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -64.72 -50.41 67.04 Favored 'General case' 0 N--CA 1.489 1.483 0 N-CA-C 113.204 0.816 . . . . 71.13 113.204 -171.374 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 2.4 mp -63.78 -53.06 53.21 Favored Pre-proline 0 CA--C 1.563 1.451 0 CA-C-O 118.544 -0.741 . . . . 71.22 112.461 -174.035 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 36.7 Cg_endo -63.7 -35.49 57.68 Favored 'Trans proline' 0 C--N 1.38 2.194 0 C-N-CA 121.895 1.73 . . . . 70.03 113.374 175.025 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 29.9 tt0 -66.14 -38.78 88.96 Favored 'General case' 0 N--CA 1.487 1.382 0 C-N-CA 123.034 0.533 . . . . 71.32 110.259 179.899 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 24' ' ' PHE . . . . . . . . . . . . . 79.9 t80 -79.69 -38.79 32.75 Favored 'General case' 0 N--CA 1.487 1.423 0 CA-C-N 114.742 -1.117 . . . . 71.13 110.67 -176.241 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 47.8 t -56.44 -59.19 5.33 Favored 'General case' 0 N--CA 1.475 0.798 0 C-N-CA 123.696 0.798 . . . . 75.02 109.244 172.25 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -57.56 -29.31 64.32 Favored 'General case' 0 N--CA 1.48 1.057 0 C-N-CA 124.141 0.976 . . . . 54.1 112.652 177.444 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 64.3 t80 -75.19 -47.92 26.04 Favored 'General case' 0 N--CA 1.483 1.196 0 C-N-CA 123.173 0.589 . . . . 62.32 111.361 -177.145 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 40.6 ptt180 -78.28 -21.38 49.84 Favored 'General case' 0 N--CA 1.48 1.044 0 CA-C-N 115.589 -0.732 . . . . 72.05 110.935 -178.92 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 42.9 t -72.99 -54.42 15.83 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.027 0 N-CA-C 109.485 -0.561 . . . . 72.33 109.485 172.797 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 14.3 ptmm? -65.29 -20.27 66.33 Favored 'General case' 0 N--CA 1.489 1.519 0 C-N-CA 122.49 0.316 . . . . 64.43 111.235 178.541 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -68.62 -44.86 73.34 Favored 'General case' 0 N--CA 1.476 0.859 0 CA-C-O 121.404 0.621 . . . . 64.23 109.94 170.531 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 30.9 t80 -83.8 -12.02 56.24 Favored 'General case' 0 N--CA 1.481 1.108 0 CA-C-N 114.97 -1.013 . . . . 73.31 112.543 -177.066 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -96.57 -54.11 3.35 Favored 'General case' 0 N--CA 1.478 0.971 0 C-N-CA 123.441 0.696 . . . . 73.34 110.432 176.874 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 46.6 t -77.7 -51.24 10.89 Favored 'General case' 0 N--CA 1.494 1.754 0 CA-C-N 115.98 -0.555 . . . . 72.02 111.658 -171.139 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -68.72 -28.73 67.09 Favored 'General case' 0 N--CA 1.483 1.182 0 C-N-CA 122.602 0.361 . . . . 53.33 111.567 179.647 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -69.98 -42.82 72.62 Favored 'General case' 0 N--CA 1.482 1.14 0 C-N-CA 122.49 0.316 . . . . 62.42 111.024 175.122 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 37' ' ' SER . . . . . 0.414 ' O ' ' HG2' ' A' ' 41' ' ' ARG . 71.1 m -59.86 -46.84 88.02 Favored 'General case' 0 N--CA 1.482 1.169 0 C-N-CA 122.807 0.443 . . . . 71.24 110.797 173.406 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 50.6 m -66.69 -31.55 72.29 Favored 'General case' 0 N--CA 1.481 1.113 0 C-N-CA 123.664 0.785 . . . . 72.43 112.031 -178.354 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 28.8 t70 -60.21 -51.03 71.29 Favored 'General case' 0 N--CA 1.477 0.882 0 C-N-CA 123.24 0.616 . . . . 75.44 110.454 171.052 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 85.7 mt -70.89 -30.93 67.42 Favored 'General case' 0 N--CA 1.481 1.119 0 C-N-CA 123.388 0.675 . . . . 70.01 111.585 -175.769 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 41' ' ' ARG . . . . . 0.414 ' HG2' ' O ' ' A' ' 37' ' ' SER . 14.7 mmt180 -78.32 -32.74 49.41 Favored 'General case' 0 N--CA 1.48 1.067 0 CA-C-N 115.777 -0.647 . . . . 72.31 110.408 177.853 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 64.1 t30 -64.93 -38.87 92.4 Favored 'General case' 0 N--CA 1.484 1.248 0 C-N-CA 123.14 0.576 . . . . 74.3 110.432 172.56 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . 0.458 ' O ' HD13 ' A' ' 47' ' ' LEU . 94.3 mt -70.42 -42.69 71.29 Favored 'General case' 0 N--CA 1.479 1.0 0 C-N-CA 123.304 0.641 . . . . 64.14 110.407 178.607 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . 0.481 ' O ' ' HG2' ' A' ' 48' ' ' GLU . 3.7 tppp? -68.84 -51.06 44.55 Favored 'General case' 0 N--CA 1.466 0.353 0 CA-C-N 115.934 -0.576 . . . . 72.32 110.074 -175.487 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 1.7 t -61.84 -33.6 74.46 Favored 'General case' 0 N--CA 1.486 1.328 0 C-N-CA 123.933 0.893 . . . . 63.11 111.786 -178.392 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -63.62 -47.69 80.35 Favored 'General case' 0 N--CA 1.482 1.165 0 C-N-CA 123.757 0.823 . . . . 72.12 111.41 174.926 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 47' ' ' LEU . . . . . 0.458 HD13 ' O ' ' A' ' 43' ' ' LEU . 9.2 mp -65.49 -41.22 93.49 Favored 'General case' 0 CA--C 1.554 1.118 0 CA-C-N 115.51 -0.768 . . . . 75.13 111.791 176.559 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 48' ' ' GLU . . . . . 0.481 ' HG2' ' O ' ' A' ' 44' ' ' LYS . 11.2 mm-40 -65.48 -41.96 92.73 Favored 'General case' 0 N--CA 1.482 1.161 0 C-N-CA 122.553 0.341 . . . . 75.24 110.839 -178.346 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 68.1 m -69.79 -28.01 65.38 Favored 'General case' 0 N--CA 1.485 1.315 0 C-N-CA 123.191 0.596 . . . . 63.32 112.037 177.725 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -75.66 -53.15 9.02 Favored 'General case' 0 N--CA 1.48 1.036 0 C-N-CA 122.891 0.476 . . . . 72.32 110.765 -178.15 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 51' ' ' PHE . . . . . . . . . . . . . 44.9 m-85 . . . . . 0 N--CA 1.482 1.15 0 CA-C-N 115.176 -0.92 . . . . 73.42 112.569 -174.868 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 66.2 p . . . . . 0 N--CA 1.494 1.751 0 N-CA-C 112.066 0.395 . . . . 72.24 112.066 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 3' ' ' LEU . . . . . 0.403 HD22 HD11 ' A' ' 6' ' ' LEU . 63.0 mt -57.33 -23.41 48.64 Favored 'General case' 0 N--CA 1.487 1.396 0 C-N-CA 123.828 0.851 . . . . 64.1 111.54 174.285 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 50.7 mm -66.79 -53.29 36.08 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.873 0 CA-C-N 115.155 -0.929 . . . . 72.33 110.339 172.83 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 48.2 mm-40 -64.45 -31.76 73.11 Favored 'General case' 0 N--CA 1.485 1.318 0 C-N-CA 123.546 0.738 . . . . 65.42 112.366 179.654 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 6' ' ' LEU . . . . . 0.403 HD11 HD22 ' A' ' 3' ' ' LEU . 92.9 mt -66.59 -45.33 79.57 Favored 'General case' 0 N--CA 1.481 1.085 0 C-N-CA 123.242 0.617 . . . . 72.12 110.923 173.935 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 40.9 tp -58.85 -43.28 90.75 Favored 'General case' 0 CA--C 1.551 1.004 0 C-N-CA 123.411 0.685 . . . . 72.11 111.488 175.378 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 96.6 mt -67.99 -47.36 79.26 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.866 0 C-N-CA 124.227 1.011 . . . . 71.34 112.927 179.626 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 8.3 p -64.67 -40.24 88.39 Favored 'Isoleucine or valine' 0 C--N 1.357 0.901 0 CA-C-N 118.44 0.563 . . . . 37.84 111.481 -177.812 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 76.6 t -66.67 -39.14 83.07 Favored 'Isoleucine or valine' 0 CA--C 1.555 1.141 0 C-N-CA 123.13 0.572 . . . . 73.11 111.026 173.827 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -64.91 -47.42 77.84 Favored 'General case' 0 N--CA 1.482 1.133 0 C-N-CA 122.941 0.497 . . . . 74.2 111.853 -179.84 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 12' ' ' ILE . . . . . 0.62 ' HA ' HD11 ' A' ' 15' ' ' ILE . 2.7 pp -68.89 -40.16 80.81 Favored 'Isoleucine or valine' 0 C--N 1.355 0.81 0 CA-C-O 119.042 -0.504 . . . . 72.32 111.416 -177.261 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 58.5 mt -60.92 -33.32 55.11 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.253 0 C-N-CA 123.564 0.746 . . . . 75.32 110.95 173.289 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -59.87 -43.44 98.01 Favored Glycine 0 C--N 1.352 1.444 0 CA-C-N 115.882 -0.599 . . . . 74.43 112.548 173.111 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 15' ' ' ILE . . . . . 0.62 HD11 ' HA ' ' A' ' 12' ' ' ILE . 18.7 mt -70.33 -43.94 77.97 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.738 0 C-N-CA 123.528 0.731 . . . . 74.02 111.066 178.455 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . 0.497 ' HG ' ' O ' ' A' ' 12' ' ' ILE . 23.8 mt -57.62 -41.67 81.8 Favored 'General case' 0 N--CA 1.483 1.18 0 C-N-CA 123.346 0.658 . . . . 64.44 111.121 -177.996 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -70.72 -51.16 29.22 Favored 'General case' 0 N--CA 1.474 0.757 0 CA-C-O 121.239 0.543 . . . . 60.33 110.8 178.592 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -61.35 -21.59 64.15 Favored 'General case' 0 CA--C 1.55 0.979 0 N-CA-C 113.372 0.878 . . . . 73.22 113.372 -177.266 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 2.7 pp -94.2 -39.18 10.19 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.09 0 CA-C-N 118.004 0.366 . . . . 72.01 111.782 172.387 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -69.56 -52.78 23.03 Favored 'General case' 0 N--CA 1.485 1.295 0 N-CA-C 112.42 0.526 . . . . 62.51 112.42 -171.415 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 2.4 mp -54.51 -54.97 42.72 Favored Pre-proline 0 CA--C 1.568 1.641 0 CA-C-O 118.119 -0.943 . . . . 73.44 112.272 -176.722 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 29.0 Cg_endo -63.2 -42.75 21.44 Favored 'Trans proline' 0 C--N 1.381 2.282 0 C-N-CA 121.963 1.775 . . . . 74.15 113.64 176.823 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 6.3 tt0 -62.76 -42.29 99.61 Favored 'General case' 0 N--CA 1.486 1.366 0 C-N-CA 124.061 0.944 . . . . 75.51 110.996 -175.333 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 24' ' ' PHE . . . . . . . . . . . . . 44.4 m-85 -90.62 -25.68 20.02 Favored 'General case' 0 N--CA 1.482 1.128 0 CA-C-N 114.27 -1.332 . . . . 75.42 111.136 -174.764 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 43.9 t -63.62 -59.23 4.87 Favored 'General case' 0 N--CA 1.48 1.04 0 N-CA-C 108.644 -0.872 . . . . 63.34 108.644 170.069 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -55.84 -32.65 63.81 Favored 'General case' 0 N--CA 1.479 1.019 0 C-N-CA 123.841 0.856 . . . . 72.13 112.971 177.222 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 19.6 t80 -72.74 -49.6 30.02 Favored 'General case' 0 N--CA 1.486 1.353 0 C-N-CA 123.168 0.587 . . . . 74.21 111.822 -179.6 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 70.4 mtp180 -81.36 -16.19 53.05 Favored 'General case' 0 N--CA 1.48 1.072 0 C-N-CA 123.286 0.635 . . . . 74.04 111.62 -177.076 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 73.5 t -90.17 -32.43 5.52 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.635 0 C-N-CA 122.651 0.381 . . . . 74.42 110.828 175.365 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 19.3 ptmt -74.14 -23.83 59.33 Favored 'General case' 0 N--CA 1.488 1.464 0 N-CA-C 109.279 -0.637 . . . . 72.43 109.279 170.121 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -72.74 -36.56 67.77 Favored 'General case' 0 C--N 1.359 0.988 0 C-N-CA 122.778 0.431 . . . . 63.15 110.094 171.887 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 83.1 t80 -60.02 -56.41 22.05 Favored 'General case' 0 N--CA 1.478 0.926 0 CA-C-N 115.688 -0.687 . . . . 74.41 110.02 171.71 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 5.4 m-20 -55.49 -53.71 52.92 Favored 'General case' 0 N--CA 1.48 1.057 0 C-N-CA 124.505 1.122 . . . . 71.11 112.683 177.985 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 32.1 t -66.87 -52.33 44.8 Favored 'General case' 0 N--CA 1.492 1.63 0 C-N-CA 122.92 0.488 . . . . 62.22 111.811 -173.821 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -64.0 -42.51 97.14 Favored 'General case' 0 N--CA 1.475 0.82 0 CA-C-O 119.094 -0.479 . . . . 62.32 111.832 179.347 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -66.33 -48.38 70.45 Favored 'General case' 0 N--CA 1.495 1.825 0 N-CA-C 111.942 0.349 . . . . 64.04 111.942 -177.931 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 37' ' ' SER . . . . . 0.479 ' O ' ' HG2' ' A' ' 41' ' ' ARG . 70.9 m -63.38 -49.44 73.81 Favored 'General case' 0 N--CA 1.483 1.183 0 C-N-CA 123.284 0.634 . . . . 74.32 111.612 179.689 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 47.1 t -72.78 -26.63 61.6 Favored 'General case' 0 N--CA 1.486 1.365 0 N-CA-C 112.337 0.495 . . . . 63.12 112.337 -177.678 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 27.6 t70 -62.52 -49.79 73.94 Favored 'General case' 0 N--CA 1.482 1.131 0 C-N-CA 122.758 0.423 . . . . 64.02 111.206 171.514 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . 0.412 ' HG ' ' O ' ' A' ' 37' ' ' SER . 4.0 pp -72.34 -21.92 61.25 Favored 'General case' 0 N--CA 1.488 1.44 0 CA-C-O 120.758 0.314 . . . . 72.31 111.315 -175.274 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 41' ' ' ARG . . . . . 0.479 ' HG2' ' O ' ' A' ' 37' ' ' SER . 27.1 mmt180 -80.1 -39.72 29.01 Favored 'General case' 0 N--CA 1.485 1.281 0 C-N-CA 123.13 0.572 . . . . 75.51 110.758 171.95 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 42' ' ' ASN . . . . . 0.407 ' O ' HG22 ' A' ' 45' ' ' THR . 61.1 t30 -68.02 -40.77 82.88 Favored 'General case' 0 N--CA 1.488 1.464 0 C-N-CA 123.534 0.734 . . . . 74.11 112.408 -178.095 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 4.3 pp -72.89 -29.87 63.49 Favored 'General case' 0 N--CA 1.485 1.318 0 O-C-N 122.083 -0.386 . . . . 71.21 110.727 177.025 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 44.5 tttm -67.86 -40.22 83.68 Favored 'General case' 0 N--CA 1.471 0.612 0 C-N-CA 123.517 0.727 . . . . 64.42 109.81 174.708 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 45' ' ' THR . . . . . 0.536 ' HA ' ' HG2' ' A' ' 48' ' ' GLU . 0.9 OUTLIER -77.97 -31.49 50.82 Favored 'General case' 0 N--CA 1.483 1.18 0 CA-C-N 115.414 -0.812 . . . . 72.52 111.258 -171.501 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -63.57 -46.77 84.36 Favored 'General case' 0 CA--C 1.547 0.836 0 C-N-CA 123.986 0.914 . . . . 63.43 110.888 171.306 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 87.2 mt -67.83 -43.6 79.18 Favored 'General case' 0 N--CA 1.481 1.123 0 C-N-CA 123.729 0.811 . . . . 73.31 112.581 179.354 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 48' ' ' GLU . . . . . 0.536 ' HG2' ' HA ' ' A' ' 45' ' ' THR . 11.3 pt-20 -71.95 -26.74 62.4 Favored 'General case' 0 N--CA 1.483 1.207 0 O-C-N 122.153 -0.342 . . . . 43.13 111.395 -176.246 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 57.1 m -73.05 -30.0 63.39 Favored 'General case' 0 N--CA 1.49 1.559 0 C-N-CA 122.954 0.501 . . . . 73.5 111.209 169.823 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -76.52 -27.7 56.1 Favored 'General case' 0 N--CA 1.482 1.17 0 C-N-CA 124.151 0.981 . . . . 55.15 112.428 -176.41 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 51' ' ' PHE . . . . . . . . . . . . . 96.5 m-85 . . . . . 0 N--CA 1.483 1.211 0 C-N-CA 123.965 0.906 . . . . 74.34 111.04 177.711 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 2' ' ' THR . . . . . 0.569 HG21 ' H ' ' A' ' 4' ' ' ILE . 16.6 m . . . . . 0 N--CA 1.487 1.385 0 N-CA-C 112.462 0.541 . . . . 73.43 112.462 . . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 49.7 tp -57.5 -26.51 61.41 Favored 'General case' 0 N--CA 1.483 1.179 0 C-N-CA 124.124 0.97 . . . . 71.54 111.808 175.649 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 4' ' ' ILE . . . . . 0.569 ' H ' HG21 ' A' ' 2' ' ' THR . 52.1 mm -67.37 -41.97 86.91 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.148 0 CA-C-N 115.959 -0.564 . . . . 75.32 110.717 175.622 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 44.3 mt-10 -64.68 -36.35 84.0 Favored 'General case' 0 N--CA 1.488 1.461 0 C-N-CA 123.543 0.737 . . . . 64.13 111.123 175.854 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 6' ' ' LEU . . . . . 0.423 ' HA ' HG12 ' A' ' 9' ' ' VAL . 77.2 mt -69.11 -33.49 73.57 Favored 'General case' 0 N--CA 1.476 0.83 0 CA-C-N 115.524 -0.762 . . . . 74.22 111.296 174.289 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 26.9 tp -69.55 -33.35 72.64 Favored 'General case' 0 CA--C 1.56 1.327 0 C-N-CA 123.156 0.582 . . . . 74.42 111.346 174.522 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 8' ' ' ILE . . . . . 0.439 HG13 ' O ' ' A' ' 4' ' ' ILE . 77.8 mt -68.68 -49.39 65.0 Favored 'Isoleucine or valine' 0 C--N 1.363 1.178 0 C-N-CA 123.399 0.68 . . . . 71.15 111.412 175.935 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . 0.423 HG12 ' HA ' ' A' ' 6' ' ' LEU . 8.6 p -63.31 -38.1 81.23 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.972 0 C-N-CA 122.787 0.435 . . . . 61.12 111.852 -179.33 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 44.4 t -66.9 -36.57 77.49 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.064 0 C-N-CA 123.155 0.582 . . . . 75.21 111.889 172.418 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -66.94 -56.42 10.29 Favored 'General case' 0 N--CA 1.485 1.286 0 N-CA-C 111.821 0.304 . . . . 74.44 111.821 178.284 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 12' ' ' ILE . . . . . 0.512 ' O ' ' HG ' ' A' ' 16' ' ' LEU . 28.8 pt -59.9 -50.82 78.65 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.913 0 C-N-CA 122.992 0.517 . . . . 74.32 111.83 -175.473 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 81.4 mt -69.73 -31.12 47.33 Favored 'Isoleucine or valine' 0 C--N 1.36 1.064 0 C-N-CA 123.589 0.756 . . . . 63.23 110.092 -179.233 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -61.28 -34.27 87.56 Favored Glycine 0 C--N 1.349 1.284 0 CA-C-N 115.894 -0.594 . . . . 73.02 113.533 174.335 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 1.7 mp -79.85 -44.61 23.05 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.99 0 C-N-CA 122.934 0.494 . . . . 64.41 110.085 175.484 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . 0.512 ' HG ' ' O ' ' A' ' 12' ' ' ILE . 31.9 mt -54.52 -42.64 71.06 Favored 'General case' 0 N--CA 1.488 1.43 0 C-N-CA 123.13 0.572 . . . . 74.14 111.324 -179.463 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -77.06 -48.73 17.03 Favored 'General case' 0 CA--C 1.55 0.969 0 C-N-CA 123.356 0.662 . . . . 75.42 111.378 179.337 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -55.78 -27.19 49.79 Favored 'General case' 0 N--CA 1.493 1.711 0 N-CA-C 113.182 0.808 . . . . 44.4 113.182 -178.863 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 2.8 pp -90.54 -35.85 7.71 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.105 0 N-CA-C 112.067 0.395 . . . . 71.5 112.067 173.097 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -67.63 -45.71 74.58 Favored 'General case' 0 N--CA 1.484 1.228 0 C-N-CA 123.224 0.609 . . . . 50.51 111.972 -172.639 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 1.9 mp -59.4 -52.98 70.46 Favored Pre-proline 0 CA--C 1.571 1.766 0 CA-C-O 118.486 -0.768 . . . . 60.4 112.478 -177.141 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 40.1 Cg_endo -66.66 -36.4 25.19 Favored 'Trans proline' 0 C--N 1.381 2.27 0 C-N-CA 121.911 1.74 . . . . 71.23 113.498 173.356 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 28.8 tt0 -66.58 -30.93 71.34 Favored 'General case' 0 N--CA 1.495 1.815 0 C-N-CA 123.133 0.573 . . . . 74.04 111.16 -178.096 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 24' ' ' PHE . . . . . . . . . . . . . 75.1 t80 -91.15 -40.13 11.75 Favored 'General case' 0 N--CA 1.489 1.482 0 CA-C-N 115.179 -0.919 . . . . 71.34 110.782 -176.6 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 25' ' ' SER . . . . . 0.423 ' O ' HG22 ' A' ' 29' ' ' VAL . 48.2 t -60.41 -55.47 33.15 Favored 'General case' 0 N--CA 1.479 1.003 0 C-N-CA 123.204 0.602 . . . . 73.41 110.051 174.669 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -64.7 -22.64 67.03 Favored 'General case' 0 N--CA 1.483 1.21 0 C-N-CA 123.74 0.816 . . . . 74.34 112.525 177.252 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 80.4 t80 -66.95 -47.59 71.17 Favored 'General case' 0 N--CA 1.48 1.063 0 CA-C-O 121.088 0.471 . . . . 64.25 110.206 172.92 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 19.9 mtp180 -72.41 -23.1 61.04 Favored 'General case' 0 N--CA 1.474 0.759 0 CA-C-N 115.196 -0.911 . . . . 65.0 111.173 179.806 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . 0.423 HG22 ' O ' ' A' ' 25' ' ' SER . 68.7 t -69.59 -50.79 47.43 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.184 0 N-CA-C 109.909 -0.404 . . . . 63.15 109.909 173.791 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . 0.451 ' HA ' ' HB3' ' A' ' 33' ' ' ASN . 14.7 ptmm? -75.71 -13.96 60.33 Favored 'General case' 0 N--CA 1.484 1.246 0 C-N-CA 122.862 0.465 . . . . 71.44 111.782 178.836 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -74.14 -40.69 62.45 Favored 'General case' 0 N--CA 1.481 1.088 0 CA-C-O 121.647 0.737 . . . . 65.11 109.593 172.393 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 32' ' ' TYR . . . . . 0.401 ' O ' ' HB3' ' A' ' 36' ' ' ALA . 36.2 t80 -85.77 -18.83 31.88 Favored 'General case' 0 N--CA 1.48 1.034 0 CA-C-N 115.068 -0.969 . . . . 73.31 111.582 -179.29 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 33' ' ' ASN . . . . . 0.451 ' HB3' ' HA ' ' A' ' 30' ' ' LYS . 27.8 t-20 -84.6 -63.24 1.37 Allowed 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 115.585 -0.734 . . . . 63.33 109.971 174.965 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 20.3 m -80.45 -51.46 8.79 Favored 'General case' 0 N--CA 1.487 1.409 0 CA-C-N 115.258 -0.883 . . . . 70.35 111.379 -166.539 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -70.21 -38.64 75.34 Favored 'General case' 0 N--CA 1.481 1.097 0 N-CA-C 111.613 0.227 . . . . 63.15 111.613 -178.281 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . 0.401 ' HB3' ' O ' ' A' ' 32' ' ' TYR . . . -69.82 -41.11 75.42 Favored 'General case' 0 N--CA 1.482 1.17 0 N-CA-C 111.425 0.157 . . . . 74.45 111.425 -179.07 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 68.0 m -67.38 -28.76 68.2 Favored 'General case' 0 N--CA 1.487 1.377 0 C-N-CA 122.45 0.3 . . . . 73.13 111.807 172.776 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 43.0 t -72.14 -37.88 69.34 Favored 'General case' 0 N--CA 1.484 1.256 0 C-N-CA 122.69 0.396 . . . . 54.32 111.128 176.399 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 33.1 m-20 -62.85 -49.05 76.42 Favored 'General case' 0 CA--C 1.544 0.72 0 C-N-CA 123.253 0.621 . . . . 75.24 111.084 170.013 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 73.5 mt -66.56 -32.69 74.2 Favored 'General case' 0 N--CA 1.487 1.405 0 C-N-CA 122.473 0.309 . . . . 62.53 111.066 -176.139 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 33.7 ttm180 -73.08 -47.68 42.42 Favored 'General case' 0 CA--C 1.537 0.444 0 C-N-CA 123.353 0.661 . . . . 74.1 110.016 177.871 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 66.2 t30 -62.71 -33.51 75.27 Favored 'General case' 0 N--CA 1.484 1.271 0 CA-C-N 115.436 -0.802 . . . . 75.31 112.162 179.748 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 91.7 mt -79.57 -37.8 35.56 Favored 'General case' 0 N--CA 1.481 1.1 0 C-N-CA 123.0 0.52 . . . . 72.21 110.717 179.938 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . 0.457 ' O ' ' HG2' ' A' ' 48' ' ' GLU . 0.8 OUTLIER -74.31 -43.54 56.33 Favored 'General case' 0 N--CA 1.476 0.845 0 N-CA-C 109.645 -0.502 . . . . 63.43 109.645 -176.077 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 3.0 t -65.82 -31.12 71.91 Favored 'General case' 0 N--CA 1.483 1.201 0 C-N-CA 123.428 0.691 . . . . 71.25 110.916 178.141 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -69.36 -31.92 70.65 Favored 'General case' 0 N--CA 1.479 1.001 0 CA-C-N 115.209 -0.905 . . . . 72.32 111.477 173.605 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 97.9 mt -67.45 -50.35 59.58 Favored 'General case' 0 N--CA 1.483 1.212 0 C-N-CA 122.768 0.427 . . . . 65.12 110.779 170.842 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 48' ' ' GLU . . . . . 0.457 ' HG2' ' O ' ' A' ' 44' ' ' LYS . 5.7 mm-40 -60.76 -35.05 75.44 Favored 'General case' 0 N--CA 1.493 1.702 0 C-N-CA 122.954 0.502 . . . . 73.25 110.797 -179.438 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 37.9 t -67.41 -58.77 4.16 Favored 'General case' 0 CA--C 1.54 0.583 0 CA-C-N 115.457 -0.792 . . . . 74.23 110.499 175.272 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -60.85 -38.13 84.46 Favored 'General case' 0 N--CA 1.487 1.415 0 C-N-CA 123.813 0.845 . . . . 74.1 112.17 -172.03 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 51' ' ' PHE . . . . . . . . . . . . . 2.7 m-85 . . . . . 0 CA--C 1.542 0.65 0 CA-C-N 115.061 -0.972 . . . . 73.32 110.366 178.968 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 2' ' ' THR . . . . . 0.412 HG22 ' H ' ' A' ' 5' ' ' GLU . 4.1 t . . . . . 0 N--CA 1.488 1.449 0 CA-C-O 120.668 0.27 . . . . 73.14 110.982 . . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 4.6 pp -63.36 -18.18 63.38 Favored 'General case' 0 N--CA 1.481 1.078 0 C-N-CA 123.942 0.897 . . . . 74.13 111.391 177.423 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 50.2 mm -64.06 -54.68 28.4 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.807 0 C-N-CA 123.436 0.695 . . . . 75.12 110.325 174.702 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 5' ' ' GLU . . . . . 0.412 ' H ' HG22 ' A' ' 2' ' ' THR . 42.7 mm-40 -66.84 -29.84 69.87 Favored 'General case' 0 N--CA 1.481 1.087 0 C-N-CA 122.958 0.503 . . . . 63.13 112.113 178.476 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 95.0 mt -67.62 -42.1 82.92 Favored 'General case' 0 N--CA 1.481 1.122 0 C-N-CA 122.966 0.507 . . . . 64.24 111.403 174.068 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -60.69 -50.37 73.76 Favored 'General case' 0 CA--C 1.555 1.172 0 C-N-CA 123.817 0.847 . . . . 65.35 109.962 176.283 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 96.5 mt -63.79 -46.37 94.61 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.869 0 C-N-CA 124.207 1.003 . . . . 55.02 112.603 -178.749 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 6.4 p -65.37 -38.83 83.49 Favored 'Isoleucine or valine' 0 CA--C 1.551 1.011 0 C-N-CA 122.694 0.398 . . . . 73.44 111.181 -178.482 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 8.9 t -66.12 -37.41 79.7 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.083 0 C-N-CA 123.403 0.681 . . . . 64.12 111.578 172.485 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -66.27 -51.68 55.05 Favored 'General case' 0 N--CA 1.48 1.031 0 C-N-CA 123.02 0.528 . . . . 51.43 111.546 -179.066 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 12' ' ' ILE . . . . . 0.532 ' HA ' HD11 ' A' ' 15' ' ' ILE . 20.8 pt -67.49 -44.71 86.5 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.935 0 C-N-CA 123.231 0.613 . . . . 73.23 111.823 -176.878 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 82.4 mt -64.37 -32.67 58.59 Favored 'Isoleucine or valine' 0 C--N 1.361 1.099 0 C-N-CA 123.614 0.766 . . . . 73.15 110.427 174.35 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -61.77 -36.95 93.5 Favored Glycine 0 C--N 1.349 1.291 0 CA-C-N 115.558 -0.746 . . . . 63.14 112.914 175.169 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 15' ' ' ILE . . . . . 0.532 HD11 ' HA ' ' A' ' 12' ' ' ILE . 22.9 mt -70.76 -42.91 77.62 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.904 0 C-N-CA 123.852 0.861 . . . . 74.52 110.705 175.343 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . 0.497 ' HG ' ' O ' ' A' ' 12' ' ' ILE . 28.6 mt -60.99 -38.36 85.71 Favored 'General case' 0 N--CA 1.482 1.137 0 C-N-CA 123.361 0.664 . . . . 63.23 111.256 -179.948 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -74.36 -48.32 28.8 Favored 'General case' 0 CA--C 1.55 0.966 0 C-N-CA 123.218 0.607 . . . . 72.41 110.754 176.251 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -57.74 -22.83 48.85 Favored 'General case' 0 N--CA 1.487 1.379 0 N-CA-C 113.602 0.964 . . . . 61.14 113.602 -179.287 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 2.8 pp -94.79 -35.56 6.22 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.218 0 N-CA-C 112.07 0.396 . . . . 73.2 112.07 171.687 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -66.71 -46.66 74.83 Favored 'General case' 0 N--CA 1.484 1.275 0 C-N-CA 123.381 0.673 . . . . 74.25 112.471 -172.586 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 2.2 mp -61.78 -53.67 58.35 Favored Pre-proline 0 CA--C 1.574 1.881 0 CA-C-O 118.739 -0.648 . . . . 75.14 112.533 -177.053 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 34.3 Cg_endo -64.53 -37.53 37.58 Favored 'Trans proline' 0 C--N 1.384 2.411 0 C-N-CA 122.256 1.97 . . . . 74.21 113.523 175.013 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 26.0 tt0 -64.98 -38.89 92.45 Favored 'General case' 0 N--CA 1.487 1.381 0 C-N-CA 123.196 0.598 . . . . 50.23 110.502 -178.098 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 24' ' ' PHE . . . . . . . . . . . . . 72.8 t80 -81.99 -34.28 29.74 Favored 'General case' 0 N--CA 1.487 1.393 0 CA-C-N 114.998 -1.001 . . . . 72.05 110.291 -176.068 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 25' ' ' SER . . . . . 0.494 ' O ' HG22 ' A' ' 29' ' ' VAL . 48.4 t -53.76 -59.21 4.92 Favored 'General case' 0 N--CA 1.478 0.97 0 C-N-CA 123.108 0.563 . . . . 64.34 109.868 168.866 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -65.18 -21.32 66.75 Favored 'General case' 0 N--CA 1.482 1.132 0 C-N-CA 124.319 1.047 . . . . 72.2 112.784 179.302 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 57.4 t80 -72.37 -45.02 61.66 Favored 'General case' 0 N--CA 1.483 1.188 0 C-N-CA 123.06 0.544 . . . . 74.24 111.076 174.911 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 27.8 mmm180 -70.2 -25.86 63.61 Favored 'General case' 0 N--CA 1.482 1.153 0 C-N-CA 123.545 0.738 . . . . 73.32 110.334 176.366 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . 0.494 HG22 ' O ' ' A' ' 25' ' ' SER . 91.1 t -69.5 -48.02 68.81 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.152 0 CA-C-N 115.75 -0.659 . . . . 75.15 109.41 172.359 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . 0.498 ' O ' ' HB3' ' A' ' 34' ' ' SER . 55.9 mttp -66.44 -21.28 66.2 Favored 'General case' 0 N--CA 1.488 1.455 0 C-N-CA 123.293 0.637 . . . . 72.41 112.297 175.799 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -68.1 -53.05 28.23 Favored 'General case' 0 N--CA 1.473 0.685 0 O-C-N 121.893 -0.504 . . . . 75.11 109.685 171.719 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 62.9 t80 -69.2 -64.08 0.94 Allowed 'General case' 0 C--O 1.219 -0.53 0 CA-C-N 115.274 -0.875 . . . . 74.34 111.235 -177.435 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 2.8 m-20 -56.91 -55.43 34.69 Favored 'General case' 0 N--CA 1.482 1.137 0 C-N-CA 125.213 1.405 . . . . 61.42 113.518 -177.414 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 34' ' ' SER . . . . . 0.498 ' HB3' ' O ' ' A' ' 30' ' ' LYS . 44.1 t -73.76 -44.62 55.58 Favored 'General case' 0 N--CA 1.493 1.712 0 N-CA-C 111.685 0.254 . . . . 52.41 111.685 -170.486 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -68.18 -30.3 69.37 Favored 'General case' 0 N--CA 1.479 1.008 0 CA-C-O 119.596 -0.24 . . . . 71.1 111.445 176.856 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -64.48 -46.92 80.95 Favored 'General case' 0 N--CA 1.494 1.76 0 N-CA-C 111.908 0.336 . . . . 74.4 111.908 170.529 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 71.1 m -63.62 -41.94 98.24 Favored 'General case' 0 N--CA 1.489 1.504 0 C-N-CA 123.374 0.67 . . . . 72.1 111.742 -179.562 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 80.9 p -77.64 -26.45 50.47 Favored 'General case' 0 N--CA 1.48 1.043 0 C-N-CA 123.441 0.696 . . . . 74.14 111.638 -179.211 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 31.2 t70 -62.48 -51.62 66.74 Favored 'General case' 0 N--CA 1.479 0.998 0 C-N-CA 123.17 0.588 . . . . 55.34 110.011 169.265 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 95.3 mt -64.14 -36.92 85.61 Favored 'General case' 0 N--CA 1.479 1.004 0 CA-C-N 115.498 -0.774 . . . . 73.55 110.859 -178.266 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 20.6 tpt85 -66.98 -44.15 81.17 Favored 'General case' 0 CA--C 1.547 0.83 0 C-N-CA 123.788 0.835 . . . . 74.44 110.475 176.647 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 63.5 t30 -66.94 -35.46 80.04 Favored 'General case' 0 N--CA 1.482 1.132 0 C-N-CA 123.762 0.825 . . . . 74.31 111.591 179.739 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 92.2 mt -72.71 -36.9 67.91 Favored 'General case' 0 N--CA 1.482 1.171 0 C-N-CA 123.135 0.574 . . . . 73.13 110.18 177.665 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 23.2 tptm -73.59 -41.65 62.6 Favored 'General case' 0 CA--C 1.538 0.505 0 CA-C-O 121.383 0.611 . . . . 73.21 110.077 -174.18 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 5.1 t -73.62 -32.58 64.13 Favored 'General case' 0 CA--C 1.547 0.846 0 CA-C-N 115.899 -0.592 . . . . 71.13 111.876 -177.419 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -79.96 -60.67 2.25 Favored 'General case' 0 N--CA 1.482 1.169 0 C-N-CA 123.383 0.673 . . . . 74.22 111.938 179.889 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -65.14 -44.31 89.03 Favored 'General case' 0 N--CA 1.479 1.02 0 C-N-CA 123.038 0.535 . . . . 72.34 112.034 -175.616 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 56.8 mm-40 -73.9 -16.31 61.11 Favored 'General case' 0 N--CA 1.485 1.324 0 CA-C-N 118.215 0.462 . . . . 74.32 112.12 -177.837 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 36.8 t -71.13 -36.25 72.04 Favored 'General case' 0 N--CA 1.485 1.298 0 CA-C-O 121.048 0.451 . . . . 75.01 110.058 168.88 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -69.86 -40.66 75.62 Favored 'General case' 0 N--CA 1.48 1.03 0 C-N-CA 123.756 0.823 . . . . 70.53 111.152 178.681 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 51' ' ' PHE . . . . . . . . . . . . . 60.5 m-85 . . . . . 0 N--CA 1.478 0.967 0 CA-C-N 115.863 -0.608 . . . . 74.4 110.358 176.217 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 2' ' ' THR . . . . . 0.422 HG22 ' H ' ' A' ' 5' ' ' GLU . 5.7 t . . . . . 0 N--CA 1.488 1.443 0 CA-C-O 121.207 0.527 . . . . 65.43 111.732 . . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 3' ' ' LEU . . . . . 0.457 HD13 HD13 ' A' ' 6' ' ' LEU . 3.2 mm? -68.8 -17.99 64.11 Favored 'General case' 0 N--CA 1.479 0.995 0 CA-C-N 115.038 -0.983 . . . . 70.21 111.028 175.913 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 50.4 mm -65.05 -51.21 69.22 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.216 0 C-N-CA 123.194 0.598 . . . . 63.1 110.572 176.886 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 5' ' ' GLU . . . . . 0.422 ' H ' HG22 ' A' ' 2' ' ' THR . 18.9 mm-40 -62.76 -41.09 99.06 Favored 'General case' 0 N--CA 1.481 1.097 0 C-N-CA 123.001 0.52 . . . . 75.42 111.689 177.725 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 6' ' ' LEU . . . . . 0.457 HD13 HD13 ' A' ' 3' ' ' LEU . 90.9 mt -62.54 -37.33 85.69 Favored 'General case' 0 N--CA 1.489 1.524 0 C-N-CA 123.051 0.541 . . . . 73.41 111.96 174.182 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 34.4 tp -64.75 -41.15 96.13 Favored 'General case' 0 N--CA 1.476 0.861 0 C-N-CA 123.817 0.847 . . . . 51.4 111.736 178.504 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 93.4 mt -69.47 -43.81 80.44 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.768 0 C-N-CA 123.654 0.781 . . . . 74.21 111.226 178.333 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 82.9 t -61.92 -47.25 94.11 Favored 'Isoleucine or valine' 0 CA--C 1.556 1.18 0 C-N-CA 122.976 0.511 . . . . 65.3 111.465 176.041 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 2.5 p -68.07 -29.44 44.66 Favored 'Isoleucine or valine' 0 CA--C 1.556 1.179 0 C-N-CA 122.572 0.349 . . . . 74.11 111.6 179.656 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -70.75 -53.63 14.79 Favored 'General case' 0 C--N 1.365 1.258 0 C-N-CA 122.698 0.399 . . . . 70.1 111.164 177.558 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 12' ' ' ILE . . . . . 0.517 ' O ' ' HG ' ' A' ' 16' ' ' LEU . 21.4 pt -63.83 -42.14 94.87 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.101 0 C-N-CA 123.168 0.587 . . . . 65.32 111.794 -176.554 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 65.7 mt -66.08 -32.76 59.55 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.047 0 C-N-CA 123.697 0.799 . . . . 74.14 110.275 173.809 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -63.75 -32.78 85.32 Favored Glycine 0 C--N 1.351 1.412 0 CA-C-N 116.029 -0.532 . . . . 37.25 113.179 172.23 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 18.8 mm -72.55 -44.91 60.39 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.202 0 N-CA-C 109.216 -0.661 . . . . 73.34 109.216 175.116 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . 0.517 ' HG ' ' O ' ' A' ' 12' ' ' ILE . 26.3 mt -59.77 -36.09 75.95 Favored 'General case' 0 N--CA 1.484 1.25 0 C-N-CA 123.655 0.782 . . . . 61.43 111.257 -179.316 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -70.62 -51.96 24.59 Favored 'General case' 0 N--CA 1.476 0.872 0 C-N-CA 123.232 0.613 . . . . 62.43 110.808 174.48 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -61.84 -22.9 65.9 Favored 'General case' 0 N--CA 1.481 1.095 0 N-CA-C 113.618 0.97 . . . . 72.12 113.618 -176.635 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 2.8 pp -92.4 -38.87 10.76 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.292 0 N-CA-C 111.835 0.309 . . . . 74.01 111.835 173.907 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -67.86 -43.39 79.55 Favored 'General case' 0 N--CA 1.485 1.323 0 N-CA-C 112.726 0.639 . . . . 72.43 112.726 -173.613 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 27.9 mt -61.06 -52.83 69.1 Favored Pre-proline 0 CA--C 1.563 1.454 0 CA-C-O 118.09 -0.957 . . . . 64.45 113.194 -177.071 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 46.2 Cg_endo -67.39 -35.78 22.58 Favored 'Trans proline' 0 C--N 1.377 2.077 0 CA-C-N 121.521 1.579 . . . . 74.41 112.956 173.765 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 29.3 tt0 -69.84 -31.08 68.75 Favored 'General case' 0 N--CA 1.483 1.201 0 CA-C-O 121.13 0.49 . . . . 63.52 111.106 -177.067 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 24' ' ' PHE . . . . . . . . . . . . . 16.4 t80 -95.22 -30.61 13.91 Favored 'General case' 0 N--CA 1.491 1.58 0 CA-C-N 115.796 -0.638 . . . . 74.41 110.781 -176.668 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 25' ' ' SER . . . . . 0.419 ' O ' HG22 ' A' ' 29' ' ' VAL . 41.6 t -57.02 -56.88 16.07 Favored 'General case' 0 N--CA 1.486 1.337 0 N-CA-C 109.87 -0.418 . . . . 70.22 109.87 165.446 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -67.26 -17.55 64.84 Favored 'General case' 0 N--CA 1.486 1.362 0 C-N-CA 123.965 0.906 . . . . 65.32 112.843 177.996 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 93.2 t80 -67.01 -46.71 73.69 Favored 'General case' 0 N--CA 1.485 1.306 0 C-N-CA 123.286 0.634 . . . . 74.31 110.273 171.422 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 39.9 mtt180 -70.91 -29.64 65.75 Favored 'General case' 0 N--CA 1.478 0.966 0 CA-C-N 115.716 -0.675 . . . . 71.34 110.591 177.225 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . 0.419 HG22 ' O ' ' A' ' 25' ' ' SER . 73.2 t -67.65 -54.08 26.09 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.409 0 CA-C-N 116.033 -0.53 . . . . 71.33 110.398 177.4 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 12.4 ptmm? -68.96 -21.45 64.18 Favored 'General case' 0 N--CA 1.479 0.999 0 CA-C-N 115.659 -0.701 . . . . 74.1 110.803 177.645 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -69.1 -39.27 79.08 Favored 'General case' 0 N--CA 1.482 1.171 0 O-C-N 121.931 -0.481 . . . . 75.52 110.114 173.551 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 92.9 t80 -66.42 -43.72 84.9 Favored 'General case' 0 N--CA 1.474 0.727 0 CA-C-N 115.539 -0.755 . . . . 74.14 111.769 -179.552 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 22.3 m120 -83.87 -45.83 12.81 Favored 'General case' 0 N--CA 1.476 0.851 0 C-N-CA 123.627 0.771 . . . . 64.24 112.701 -175.233 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 30.3 t -77.6 -47.01 20.43 Favored 'General case' 0 N--CA 1.494 1.739 0 N-CA-C 111.49 0.182 . . . . 65.32 111.49 -171.506 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -62.28 -35.51 79.23 Favored 'General case' 0 N--CA 1.481 1.077 0 C-N-CA 122.473 0.309 . . . . 72.35 111.203 174.915 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -63.01 -49.89 72.88 Favored 'General case' 0 N--CA 1.486 1.343 0 O-C-N 123.418 0.449 . . . . 75.21 111.619 175.348 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 71.2 m -57.1 -38.68 73.74 Favored 'General case' 0 N--CA 1.491 1.59 0 C-N-CA 122.871 0.468 . . . . 71.03 112.2 -178.688 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 33.5 t -85.96 -31.59 22.0 Favored 'General case' 0 N--CA 1.487 1.397 0 C-N-CA 123.625 0.77 . . . . 61.24 112.648 -177.619 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 38.8 t70 -70.07 -44.61 68.77 Favored 'General case' 0 N--CA 1.48 1.052 0 CA-C-O 120.846 0.355 . . . . 71.11 110.616 176.406 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 97.0 mt -71.99 -27.53 62.81 Favored 'General case' 0 N--CA 1.475 0.79 0 CA-C-N 115.702 -0.681 . . . . 71.13 110.242 -178.732 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 20.5 tpp180 -71.63 -43.13 66.68 Favored 'General case' 0 N--CA 1.475 0.787 0 C-N-CA 123.604 0.762 . . . . 70.43 110.483 173.319 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 58.2 t30 -61.66 -44.07 97.65 Favored 'General case' 0 N--CA 1.486 1.335 0 C-N-CA 124.076 0.95 . . . . 72.55 111.944 177.218 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 94.6 mt -75.15 -33.11 61.48 Favored 'General case' 0 N--CA 1.479 1.001 0 CA-C-N 115.923 -0.581 . . . . 75.21 111.142 -179.05 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . 0.412 ' O ' ' HG2' ' A' ' 48' ' ' GLU . 22.4 ttmm -71.44 -48.1 51.63 Favored 'General case' 0 N--CA 1.475 0.799 0 N-CA-C 109.747 -0.464 . . . . 75.24 109.747 179.789 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 3.4 t -61.76 -36.0 79.76 Favored 'General case' 0 N--CA 1.484 1.256 0 C-N-CA 123.025 0.53 . . . . 55.1 111.197 -176.354 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -63.71 -50.49 68.96 Favored 'General case' 0 N--CA 1.477 0.879 0 C-N-CA 123.586 0.754 . . . . 60.21 111.634 175.397 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 8.3 mp -66.91 -42.05 86.08 Favored 'General case' 0 N--CA 1.488 1.473 0 C-N-CA 123.503 0.721 . . . . 75.43 112.715 -179.024 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 48' ' ' GLU . . . . . 0.412 ' HG2' ' O ' ' A' ' 44' ' ' LYS . 36.9 mm-40 -67.85 -45.8 73.57 Favored 'General case' 0 N--CA 1.477 0.886 0 C-N-CA 123.363 0.665 . . . . 73.01 110.755 -178.596 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 62.3 m -66.07 -37.16 85.11 Favored 'General case' 0 N--CA 1.482 1.165 0 C-N-CA 122.626 0.37 . . . . 74.52 111.599 179.439 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -68.02 -49.63 60.31 Favored 'General case' 0 N--CA 1.489 1.512 0 C-N-CA 123.264 0.626 . . . . 73.21 112.135 179.113 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 51' ' ' PHE . . . . . . . . . . . . . 28.9 t80 . . . . . 0 N--CA 1.484 1.263 0 C-N-CA 123.491 0.717 . . . . 72.12 111.563 -176.948 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 2' ' ' THR . . . . . 0.559 HG21 ' H ' ' A' ' 4' ' ' ILE . 36.7 m . . . . . 0 N--CA 1.484 1.226 0 CA-C-O 120.543 0.211 . . . . 70.24 110.93 . . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 2.5 pt? -61.22 -17.46 53.36 Favored 'General case' 0 N--CA 1.49 1.57 0 C-N-CA 124.123 0.969 . . . . 75.01 113.202 179.175 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 4' ' ' ILE . . . . . 0.559 ' H ' HG21 ' A' ' 2' ' ' THR . 50.6 mm -86.17 -45.05 16.88 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.735 0 C-N-CA 123.369 0.668 . . . . 60.11 110.322 179.461 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 20.1 mm-40 -64.16 -33.77 76.55 Favored 'General case' 0 N--CA 1.481 1.08 0 C-N-CA 123.304 0.642 . . . . 72.21 111.799 -179.812 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 3.5 pp -70.07 -34.0 72.64 Favored 'General case' 0 N--CA 1.477 0.921 0 O-C-N 123.156 0.285 . . . . 63.41 111.332 174.245 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -67.7 -37.69 82.63 Favored 'General case' 0 CA--C 1.561 1.398 0 C-N-CA 123.814 0.846 . . . . 74.12 110.904 176.759 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 87.4 mt -70.39 -49.37 54.09 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.707 0 C-N-CA 123.292 0.637 . . . . 73.31 111.99 178.996 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 9.7 p -64.52 -39.66 86.36 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.901 0 C-N-CA 122.684 0.394 . . . . 74.33 111.789 -179.527 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 2.0 p -67.28 -30.0 47.71 Favored 'Isoleucine or valine' 0 CA--C 1.56 1.351 0 C-N-CA 122.435 0.294 . . . . 72.23 111.3 175.697 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -69.15 -52.76 24.89 Favored 'General case' 0 N--CA 1.483 1.219 0 C-N-CA 122.652 0.381 . . . . 54.13 111.583 177.533 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 12' ' ' ILE . . . . . 0.513 ' O ' ' HG ' ' A' ' 16' ' ' LEU . 21.3 pt -62.54 -41.5 92.24 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.967 0 C-N-CA 122.723 0.409 . . . . 71.13 111.46 -179.117 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 56.0 mt -62.15 -36.21 73.09 Favored 'Isoleucine or valine' 0 C--N 1.362 1.139 0 C-N-CA 124.277 1.031 . . . . 75.22 111.097 174.382 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -58.13 -36.43 81.94 Favored Glycine 0 C--N 1.355 1.596 0 O-C-N 123.553 0.533 . . . . 74.41 113.198 174.856 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 1.7 mp -75.98 -42.81 39.12 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.877 0 C-N-CA 123.06 0.544 . . . . 72.41 109.995 175.768 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . 0.513 ' HG ' ' O ' ' A' ' 12' ' ' ILE . 37.9 mt -59.52 -36.59 76.4 Favored 'General case' 0 N--CA 1.489 1.488 0 C-N-CA 122.975 0.51 . . . . 74.45 112.006 -176.623 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -73.73 -52.43 13.23 Favored 'General case' 0 CA--C 1.546 0.826 0 C-N-CA 122.738 0.415 . . . . 62.02 110.228 175.143 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -53.87 -30.05 44.08 Favored 'General case' 0 N--CA 1.488 1.431 0 C-N-CA 124.226 1.01 . . . . 71.11 113.444 -178.168 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 19' ' ' ILE . . . . . 0.517 ' O ' ' HB3' ' A' ' 23' ' ' GLN . 2.8 pp -88.47 -35.94 8.55 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.297 0 N-CA-C 112.177 0.436 . . . . 73.04 112.177 175.501 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -71.74 -42.98 66.62 Favored 'General case' 0 N--CA 1.481 1.092 0 N-CA-C 112.872 0.693 . . . . 72.31 112.872 -170.985 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 1.9 mp -57.07 -54.13 57.83 Favored Pre-proline 0 CA--C 1.567 1.624 0 CA-C-O 118.723 -0.656 . . . . 64.53 111.591 -178.286 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 36.3 Cg_endo -64.72 -39.64 25.77 Favored 'Trans proline' 0 C--N 1.386 2.515 0 C-N-CA 121.493 1.462 . . . . 75.15 113.441 173.226 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 23' ' ' GLN . . . . . 0.517 ' HB3' ' O ' ' A' ' 19' ' ' ILE . 0.1 OUTLIER -64.94 -29.88 70.85 Favored 'General case' 0 N--CA 1.496 1.841 0 C-N-CA 122.77 0.428 . . . . 75.53 110.685 -175.669 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 24' ' ' PHE . . . . . . . . . . . . . 73.7 t80 -96.59 -37.94 10.17 Favored 'General case' 0 N--CA 1.485 1.276 0 CA-C-N 115.533 -0.758 . . . . 74.34 111.135 -173.61 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 25' ' ' SER . . . . . 0.427 ' O ' HG22 ' A' ' 29' ' ' VAL . 46.2 t -61.09 -57.51 12.25 Favored 'General case' 0 N--CA 1.477 0.884 0 N-CA-C 109.167 -0.679 . . . . 60.43 109.167 174.524 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -63.34 -22.02 66.62 Favored 'General case' 0 N--CA 1.482 1.159 0 C-N-CA 123.632 0.773 . . . . 64.23 112.658 177.275 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 27' ' ' TYR . . . . . 0.425 ' HB2' ' O ' ' A' ' 23' ' ' GLN . 75.7 t80 -67.23 -48.73 66.93 Favored 'General case' 0 N--CA 1.489 1.497 0 CA-C-O 121.278 0.561 . . . . 74.35 110.502 173.488 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 74.4 mtp180 -73.28 -27.27 61.46 Favored 'General case' 0 N--CA 1.472 0.643 0 CA-C-N 115.612 -0.722 . . . . 74.2 111.617 178.26 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . 0.427 HG22 ' O ' ' A' ' 25' ' ' SER . 55.5 t -73.62 -42.65 55.29 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.4 0 O-C-N 123.347 0.404 . . . . 74.3 110.494 178.636 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . 0.425 ' HG2' ' O ' ' A' ' 27' ' ' TYR . 11.7 ptmm? -68.59 -30.32 69.05 Favored 'General case' 0 N--CA 1.476 0.869 0 CA-C-N 116.311 -0.404 . . . . 74.11 110.147 177.29 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -80.09 -34.83 37.66 Favored 'General case' 0 N--CA 1.482 1.138 0 C-N-CA 122.903 0.481 . . . . 74.1 110.837 -179.3 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 39.8 t80 -72.26 -21.56 61.35 Favored 'General case' 0 N--CA 1.485 1.291 0 C-N-CA 123.544 0.738 . . . . 75.52 110.922 -179.282 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 2.9 m-20 -94.49 -45.72 7.3 Favored 'General case' 0 N--CA 1.478 0.929 0 C-N-CA 123.872 0.869 . . . . 75.11 111.658 175.025 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 42.4 t -65.33 -55.33 18.82 Favored 'General case' 0 N--CA 1.495 1.817 0 C-N-CA 122.835 0.454 . . . . 61.14 111.75 -176.63 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -62.23 -39.29 92.31 Favored 'General case' 0 N--CA 1.474 0.747 0 CA-C-N 115.954 -0.566 . . . . 61.22 111.578 179.152 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -61.29 -60.57 3.54 Favored 'General case' 0 N--CA 1.485 1.318 0 C-N-CA 123.158 0.583 . . . . 61.23 111.569 178.695 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 37.7 t -53.26 -50.54 64.62 Favored 'General case' 0 N--CA 1.479 1.007 0 C-N-CA 123.937 0.895 . . . . 63.1 111.913 -179.713 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 30.5 t -72.01 -29.8 64.56 Favored 'General case' 0 N--CA 1.478 0.952 0 N-CA-C 112.621 0.6 . . . . 74.22 112.621 -175.967 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 37.0 t70 -63.93 -49.73 71.44 Favored 'General case' 0 N--CA 1.484 1.245 0 C-N-CA 122.64 0.376 . . . . 74.45 111.075 172.69 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 88.3 mt -67.78 -35.48 78.75 Favored 'General case' 0 N--CA 1.481 1.118 0 CA-C-N 115.622 -0.717 . . . . 74.43 110.782 -174.981 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 99.6 mtt180 -70.66 -42.24 71.03 Favored 'General case' 0 N--CA 1.48 1.064 0 CA-C-N 115.054 -0.976 . . . . 73.44 110.681 175.363 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 65.2 t30 -64.75 -36.13 83.31 Favored 'General case' 0 N--CA 1.489 1.516 0 C-N-CA 123.462 0.705 . . . . 43.35 111.671 179.774 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . 0.432 ' O ' HD13 ' A' ' 47' ' ' LEU . 93.6 mt -76.64 -34.77 58.28 Favored 'General case' 0 N--CA 1.478 0.97 0 C-N-CA 122.976 0.511 . . . . 71.51 110.974 179.632 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 79.4 tttt -70.98 -48.29 54.13 Favored 'General case' 0 N--CA 1.472 0.658 0 N-CA-C 109.822 -0.436 . . . . 64.41 109.822 -178.396 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 6.2 t -65.47 -31.76 73.01 Favored 'General case' 0 N--CA 1.478 0.973 0 C-N-CA 123.863 0.865 . . . . 75.41 111.674 -177.481 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -61.63 -46.48 89.62 Favored 'General case' 0 N--CA 1.481 1.121 0 C-N-CA 124.024 0.93 . . . . 64.44 111.243 172.149 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 47' ' ' LEU . . . . . 0.432 HD13 ' O ' ' A' ' 43' ' ' LEU . 8.4 mp -66.92 -39.15 87.3 Favored 'General case' 0 N--CA 1.479 1.002 0 CA-C-N 115.622 -0.717 . . . . 72.22 111.675 176.326 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 49.8 mt-10 -66.95 -38.2 85.7 Favored 'General case' 0 N--CA 1.484 1.247 0 C-N-CA 122.872 0.469 . . . . 61.14 111.147 179.647 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 34.2 t -69.04 -27.61 65.81 Favored 'General case' 0 N--CA 1.479 1.011 0 C-N-CA 123.509 0.723 . . . . 53.41 111.145 175.393 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -74.83 -53.58 8.86 Favored 'General case' 0 N--CA 1.477 0.881 0 C-N-CA 123.283 0.633 . . . . 62.51 110.341 178.057 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 51' ' ' PHE . . . . . . . . . . . . . 57.9 m-85 . . . . . 0 N--CA 1.487 1.377 0 C-N-CA 123.961 0.905 . . . . 63.5 112.466 -177.404 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 1' ' ' PHE . . . . . . . . . . . . . 46.8 p90 . . . . . 0 N--CA 1.484 1.228 0 N-CA-C 112.393 0.516 . . . . 73.4 112.393 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' THR . . . . . 0.524 HG21 ' H ' ' A' ' 5' ' ' GLU . 7.2 t -90.26 144.39 25.88 Favored 'General case' 0 N--CA 1.492 1.659 0 CA-C-N 118.526 0.603 . . . . 73.51 111.834 -176.164 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . 0.564 HD13 HD11 ' A' ' 6' ' ' LEU . 4.3 mm? -61.23 -22.72 65.06 Favored 'General case' 0 N--CA 1.482 1.139 0 CA-C-N 115.743 -0.662 . . . . 73.42 111.147 174.802 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 1.5 mp -62.14 -45.73 98.08 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.427 0 C-N-CA 123.596 0.758 . . . . 54.54 110.474 177.338 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . 0.524 ' H ' HG21 ' A' ' 2' ' ' THR . 14.4 mm-40 -56.23 -47.32 78.7 Favored 'General case' 0 N--CA 1.484 1.244 0 C-N-CA 123.021 0.528 . . . . 74.14 111.422 174.856 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . 0.564 HD11 HD13 ' A' ' 3' ' ' LEU . 85.5 mt -64.08 -41.66 97.24 Favored 'General case' 0 N--CA 1.478 0.953 0 C-N-CA 123.436 0.694 . . . . 75.43 111.956 -179.759 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 90.9 mt -61.75 -45.43 93.94 Favored 'General case' 0 N--CA 1.48 1.067 0 C-N-CA 123.174 0.589 . . . . 73.21 111.82 177.672 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 87.1 mt -63.77 -47.94 88.73 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.801 0 C-N-CA 123.324 0.65 . . . . 63.43 112.235 176.998 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 50.3 t -62.01 -44.57 99.13 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.834 0 C-N-CA 123.38 0.672 . . . . 71.25 111.379 -178.953 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 40.2 t -67.82 -31.64 53.07 Favored 'Isoleucine or valine' 0 CA--C 1.555 1.173 0 C-N-CA 123.041 0.536 . . . . 54.12 111.355 176.427 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -68.5 -58.91 3.6 Favored 'General case' 0 N--CA 1.481 1.086 0 C-N-CA 122.44 0.296 . . . . 62.53 111.274 177.855 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' ILE . . . . . 0.529 ' O ' ' HG ' ' A' ' 16' ' ' LEU . 20.9 pt -60.58 -49.21 85.32 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.955 0 C-N-CA 123.464 0.706 . . . . 50.35 111.83 -176.387 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 71.3 mt -68.47 -30.41 47.4 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.934 0 C-N-CA 123.613 0.765 . . . . 73.21 110.665 178.994 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -61.04 -36.39 92.24 Favored Glycine 0 C--N 1.351 1.369 0 CA-C-N 115.938 -0.574 . . . . 42.54 112.968 175.256 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 17.4 mt -75.79 -45.92 36.9 Favored 'Isoleucine or valine' 0 C--N 1.354 0.795 0 C-N-CA 123.289 0.636 . . . . 62.52 110.11 176.194 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . 0.529 ' HG ' ' O ' ' A' ' 12' ' ' ILE . 36.5 mt -55.17 -43.25 74.13 Favored 'General case' 0 N--CA 1.485 1.294 0 O-C-N 124.055 0.847 . . . . 70.41 111.501 -178.81 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -75.1 -49.81 18.42 Favored 'General case' 0 N--CA 1.476 0.861 0 C-N-CA 123.071 0.548 . . . . 61.11 111.33 -177.857 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -55.28 -30.18 59.64 Favored 'General case' 0 N--CA 1.482 1.148 0 C-N-CA 123.665 0.786 . . . . 74.11 112.921 -178.037 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 2.8 pp -89.1 -37.52 10.11 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.974 0 N-CA-C 112.155 0.428 . . . . 71.23 112.155 173.624 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -65.96 -53.04 44.12 Favored 'General case' 0 N--CA 1.487 1.388 0 N-CA-C 113.052 0.76 . . . . 72.33 113.052 -171.093 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 2.4 mp -54.64 -56.3 28.65 Favored Pre-proline 0 CA--C 1.566 1.562 0 CA-C-O 118.629 -0.7 . . . . 72.3 112.494 -174.759 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 37.2 Cg_endo -65.31 -41.05 17.05 Favored 'Trans proline' 0 C--N 1.38 2.224 0 C-N-CA 121.576 1.517 . . . . 70.24 113.493 177.624 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 28.2 tt0 -63.87 -36.47 84.04 Favored 'General case' 0 N--CA 1.488 1.464 0 C-N-CA 123.369 0.668 . . . . 71.04 111.098 -176.13 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' PHE . . . . . . . . . . . . . 37.5 t80 -88.33 -36.24 16.74 Favored 'General case' 0 N--CA 1.485 1.31 0 CA-C-N 114.837 -1.074 . . . . 64.4 111.023 -174.84 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 31.3 t -60.3 -51.18 70.65 Favored 'General case' 0 N--CA 1.478 0.943 0 C-N-CA 122.991 0.517 . . . . 75.43 110.411 173.612 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -69.99 -21.29 63.24 Favored 'General case' 0 CA--C 1.551 0.998 0 CA-C-N 115.486 -0.779 . . . . 74.15 112.644 176.789 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 79.7 t80 -71.19 -48.47 51.41 Favored 'General case' 0 N--CA 1.488 1.427 0 C-N-CA 122.686 0.395 . . . . 70.21 110.995 175.361 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 73.5 mtp180 -67.62 -27.14 66.64 Favored 'General case' 0 N--CA 1.477 0.886 0 C-N-CA 123.015 0.526 . . . . 72.03 111.106 177.62 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 24.0 t -71.17 -49.03 51.37 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.892 0 CA-C-N 115.694 -0.685 . . . . 45.05 110.69 174.214 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 18.9 ptmt -70.73 -22.39 62.43 Favored 'General case' 0 N--CA 1.476 0.861 0 CA-C-O 119.427 -0.32 . . . . 71.11 111.024 -179.099 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -78.19 -36.57 47.21 Favored 'General case' 0 N--CA 1.48 1.052 0 CA-C-O 120.909 0.385 . . . . 72.41 110.132 176.501 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 88.6 t80 -63.76 -43.87 95.13 Favored 'General case' 0 C--O 1.218 -0.559 0 CA-C-N 115.059 -0.973 . . . . 75.4 109.935 174.652 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 82.5 m-20 -80.0 -31.82 39.72 Favored 'General case' 0 N--CA 1.484 1.247 0 C-N-CA 124.075 0.95 . . . . 70.41 112.608 -176.667 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 39.7 t -66.01 -51.56 57.19 Favored 'General case' 0 N--CA 1.492 1.662 0 C-N-CA 122.521 0.329 . . . . 71.15 110.235 173.907 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -65.91 -38.52 88.93 Favored 'General case' 0 CA--C 1.541 0.596 0 CA-C-N 115.596 -0.729 . . . . 61.21 111.706 177.505 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -61.95 -53.56 53.97 Favored 'General case' 0 N--CA 1.497 1.921 0 N-CA-C 112.3 0.481 . . . . 73.5 112.3 177.169 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 44.1 t -61.15 -49.48 77.07 Favored 'General case' 0 N--CA 1.483 1.186 0 C-N-CA 122.855 0.462 . . . . 52.53 111.282 179.466 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 64.4 m -66.4 -27.67 68.03 Favored 'General case' 0 N--CA 1.483 1.189 0 C-N-CA 123.312 0.645 . . . . 72.2 112.681 -178.621 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 32.1 t70 -63.17 -47.2 83.68 Favored 'General case' 0 N--CA 1.483 1.221 0 CA-C-O 121.336 0.589 . . . . 74.24 110.815 170.027 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 90.9 mt -74.28 -22.48 59.27 Favored 'General case' 0 N--CA 1.481 1.106 0 CA-C-N 115.274 -0.875 . . . . 74.23 112.188 -178.042 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 61.6 mtp180 -83.99 -60.8 1.99 Allowed 'General case' 0 N--CA 1.479 1.006 0 C-N-CA 123.457 0.703 . . . . 74.3 111.488 177.194 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 7.3 t30 -61.16 -38.46 86.54 Favored 'General case' 0 N--CA 1.483 1.223 0 C-N-CA 123.916 0.886 . . . . 75.3 112.988 -171.038 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 83.9 mt -78.22 -31.95 49.63 Favored 'General case' 0 N--CA 1.486 1.336 0 N-CA-C 111.654 0.242 . . . . 74.24 111.654 -178.99 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 40.6 ttmt -76.05 -44.96 36.68 Favored 'General case' 0 N--CA 1.474 0.76 0 C-N-CA 122.844 0.457 . . . . 45.43 110.519 -177.286 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 5.8 t -66.77 -32.84 74.4 Favored 'General case' 0 N--CA 1.478 0.951 0 CA-C-N 115.305 -0.861 . . . . 73.32 110.853 -179.736 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -67.2 -40.19 86.45 Favored 'General case' 0 N--CA 1.475 0.819 0 CA-C-N 114.98 -1.009 . . . . 74.03 111.557 172.964 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 8.0 tt -64.58 -47.01 80.27 Favored 'General case' 0 N--CA 1.482 1.14 0 C-N-CA 123.724 0.81 . . . . 75.02 110.465 176.218 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 40.3 mt-10 -65.55 -30.58 71.35 Favored 'General case' 0 N--CA 1.479 1.02 0 C-N-CA 123.54 0.736 . . . . 73.42 111.523 -179.444 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 23.5 t -81.01 -39.15 26.33 Favored 'General case' 0 N--CA 1.479 0.975 0 C-N-CA 123.012 0.525 . . . . 73.42 111.591 179.122 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -74.44 -36.72 63.39 Favored 'General case' 0 N--CA 1.486 1.344 0 C-N-CA 123.33 0.652 . . . . 71.02 111.724 -175.272 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 51' ' ' PHE . . . . . . . . . . . . . 88.4 m-85 -94.19 -10.48 32.96 Favored 'General case' 0 N--CA 1.479 1.015 0 C-N-CA 124.044 0.938 . . . . 72.45 110.671 177.983 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . 64.04 30.66 13.92 Favored 'General case' 0 C--N 1.362 1.145 0 C-N-CA 124.476 1.11 . . . . 74.25 111.911 178.025 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 38.2 t70 -45.3 -38.18 5.43 Favored 'General case' 0 N--CA 1.489 1.482 0 C-N-CA 126.932 2.093 . . . . 64.02 115.392 -168.31 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 5.3 m-20 -55.21 -19.8 8.98 Favored 'General case' 0 N--CA 1.495 1.78 0 C-N-CA 124.464 1.106 . . . . 64.42 113.797 -179.408 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 28.4 pt20 -54.9 -32.91 61.51 Favored 'General case' 0 N--CA 1.489 1.504 0 C-N-CA 124.99 1.316 . . . . 65.32 113.648 177.054 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 4.8 m -95.83 -0.67 50.86 Favored 'General case' 0 N--CA 1.488 1.436 0 C-N-CA 123.398 0.679 . . . . 72.51 111.871 -174.305 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 88.0 m-85 -116.12 149.71 43.91 Favored Pre-proline 0 N--CA 1.491 1.588 0 C-N-CA 123.193 0.597 . . . . 74.01 111.435 -178.134 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 87.4 Cg_endo -77.04 160.5 33.37 Favored 'Trans proline' 0 C--N 1.375 1.963 0 C-N-CA 122.822 2.348 . . . . 72.02 112.77 175.499 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 47.5 Cg_exo -57.85 126.36 21.49 Favored 'Trans proline' 0 C--N 1.38 2.197 0 C-N-CA 122.651 2.234 . . . . 54.11 112.798 178.173 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 11.6 pt-20 41.73 76.91 0.06 Allowed 'General case' 0 N--CA 1.492 1.631 0 C-N-CA 125.692 1.597 . . . . 70.22 113.035 -174.488 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 62.0 p . . . . . 0 N--CA 1.486 1.328 0 CA-C-N 115.416 -0.811 . . . . 72.53 111.828 -176.658 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 1' ' ' PHE . . . . . 0.417 ' HB3' HD12 ' A' ' 6' ' ' LEU . 90.2 m-85 . . . . . 0 N--CA 1.495 1.802 0 N-CA-C 110.304 -0.258 . . . . 61.2 110.304 . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 2.7 t -117.41 137.64 52.35 Favored 'General case' 0 N--CA 1.48 1.068 0 C-N-CA 123.082 0.553 . . . . 74.02 110.207 175.666 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 83.1 mt -55.57 -25.24 37.05 Favored 'General case' 0 N--CA 1.482 1.173 0 C-N-CA 124.11 0.964 . . . . 73.34 112.168 -179.173 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 49.0 mm -64.72 -58.42 7.22 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.767 0 O-C-N 124.007 0.817 . . . . 75.02 110.798 178.733 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 18.3 mm-40 -67.95 -37.9 82.15 Favored 'General case' 0 N--CA 1.478 0.951 0 N-CA-C 111.912 0.338 . . . . 60.11 111.912 -176.359 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . 0.417 HD12 ' HB3' ' A' ' 1' ' ' PHE . 70.6 mt -62.42 -41.6 98.81 Favored 'General case' 0 N--CA 1.485 1.296 0 C-N-CA 123.152 0.581 . . . . 73.52 111.973 176.249 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 37.6 tp -66.35 -39.45 89.2 Favored 'General case' 0 CA--C 1.549 0.939 0 C-N-CA 123.252 0.621 . . . . 62.11 111.82 178.165 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 83.4 mt -67.85 -44.03 85.66 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.873 0 C-N-CA 122.843 0.457 . . . . 75.01 111.789 176.957 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 53.6 t -60.44 -47.84 90.9 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.974 0 C-N-CA 123.157 0.583 . . . . 55.41 111.76 177.028 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 4.0 p -66.9 -29.24 45.64 Favored 'Isoleucine or valine' 0 CA--C 1.561 1.383 0 N-CA-C 111.636 0.235 . . . . 63.11 111.636 178.021 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -71.93 -51.8 20.34 Favored 'General case' 0 N--CA 1.483 1.177 0 C-N-CA 123.074 0.55 . . . . 65.34 111.899 178.515 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' ILE . . . . . 0.556 ' HA ' HD11 ' A' ' 15' ' ' ILE . 27.3 pt -64.69 -46.26 92.81 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.921 0 C-N-CA 123.141 0.577 . . . . 71.43 111.273 -175.805 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 81.9 mt -64.67 -29.31 47.0 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.093 0 C-N-CA 123.72 0.808 . . . . 75.2 110.642 176.405 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -61.26 -39.68 97.54 Favored Glycine 0 C--N 1.354 1.553 0 CA-C-N 116.0 -0.546 . . . . 44.32 112.843 172.515 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . 0.556 HD11 ' HA ' ' A' ' 12' ' ' ILE . 16.3 mt -73.38 -44.94 53.8 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.914 0 C-N-CA 123.618 0.767 . . . . 72.24 110.807 176.644 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . 0.505 ' HG ' ' O ' ' A' ' 12' ' ' ILE . 24.9 mt -59.06 -36.81 75.69 Favored 'General case' 0 N--CA 1.485 1.309 0 C-N-CA 123.4 0.68 . . . . 75.03 111.249 -177.315 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -70.53 -54.3 12.72 Favored 'General case' 0 CA--C 1.548 0.883 0 C-N-CA 123.131 0.572 . . . . 74.23 110.253 174.518 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -57.92 -21.35 43.26 Favored 'General case' 0 N--CA 1.48 1.035 0 N-CA-C 114.066 1.136 . . . . 51.34 114.066 -177.46 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 2.7 pp -97.54 -36.23 5.88 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.06 0 N-CA-C 112.283 0.475 . . . . 73.0 112.283 174.202 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -69.65 -45.87 67.44 Favored 'General case' 0 N--CA 1.49 1.538 0 N-CA-C 112.639 0.607 . . . . 74.01 112.639 -172.519 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 2.3 mp -57.93 -55.02 49.49 Favored Pre-proline 0 CA--C 1.571 1.759 0 CA-C-O 118.619 -0.705 . . . . 72.22 112.298 -179.177 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 55.6 Cg_endo -68.51 -34.98 18.68 Favored 'Trans proline' 0 C--N 1.383 2.382 0 C-N-CA 122.277 1.984 . . . . 74.1 114.025 177.538 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 26.5 tt0 -64.75 -36.93 85.89 Favored 'General case' 0 N--CA 1.49 1.568 0 CA-C-O 121.455 0.645 . . . . 71.15 110.274 -179.143 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 24' ' ' PHE . . . . . . . . . . . . . 58.4 t80 -86.55 -35.22 19.65 Favored 'General case' 0 N--CA 1.484 1.245 0 CA-C-N 114.636 -1.165 . . . . 75.13 110.763 -175.477 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 25' ' ' SER . . . . . 0.429 ' O ' HG22 ' A' ' 29' ' ' VAL . 44.5 t -56.89 -55.28 36.52 Favored 'General case' 0 N--CA 1.478 0.93 0 C-N-CA 123.225 0.61 . . . . 74.42 110.319 169.985 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -61.65 -30.46 70.73 Favored 'General case' 0 N--CA 1.484 1.249 0 C-N-CA 124.26 1.024 . . . . 64.42 112.483 177.252 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 69.0 t80 -64.15 -51.69 62.66 Favored 'General case' 0 N--CA 1.478 0.926 0 C-N-CA 122.816 0.446 . . . . 73.44 110.154 175.342 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . 0.402 ' O ' ' HB2' ' A' ' 32' ' ' TYR . 80.7 mtp180 -67.49 -25.25 65.77 Favored 'General case' 0 N--CA 1.476 0.861 0 CA-C-N 115.429 -0.805 . . . . 74.53 111.796 179.709 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . 0.429 HG22 ' O ' ' A' ' 25' ' ' SER . 41.9 t -68.19 -54.49 21.71 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.393 0 O-C-N 123.43 0.456 . . . . 72.05 110.459 176.55 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . 0.554 ' HB2' ' HZ1' ' A' ' 30' ' ' LYS . 0.0 OUTLIER -69.17 -24.38 64.06 Favored 'General case' 0 N--CA 1.478 0.926 0 CA-C-N 115.725 -0.671 . . . . 74.41 111.097 179.099 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -80.8 -31.39 35.68 Favored 'General case' 0 N--CA 1.484 1.24 0 C-N-CA 122.925 0.49 . . . . 70.24 110.783 -179.884 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 32' ' ' TYR . . . . . 0.402 ' HB2' ' O ' ' A' ' 28' ' ' ARG . 4.9 t80 -74.27 -19.19 60.58 Favored 'General case' 0 N--CA 1.484 1.268 0 C-N-CA 123.181 0.592 . . . . 71.44 110.372 177.897 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 17.9 m120 -91.94 -52.76 4.57 Favored 'General case' 0 N--CA 1.473 0.707 0 C-N-CA 123.721 0.808 . . . . 63.23 110.86 175.063 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 44.0 t -65.43 -59.37 4.08 Favored 'General case' 0 N--CA 1.484 1.259 0 C-N-CA 123.313 0.645 . . . . 65.34 111.683 -174.096 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -61.58 -40.54 95.14 Favored 'General case' 0 N--CA 1.479 0.977 0 N-CA-C 112.135 0.42 . . . . 74.42 112.135 -179.09 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -64.18 -46.42 84.06 Favored 'General case' 0 N--CA 1.485 1.294 0 C-N-CA 122.427 0.291 . . . . 62.24 111.015 -178.201 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 73.0 m -65.14 -44.01 90.01 Favored 'General case' 0 N--CA 1.476 0.839 0 CA-C-N 116.184 -0.462 . . . . 73.44 111.663 175.659 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 64.1 m -72.23 -35.36 68.84 Favored 'General case' 0 N--CA 1.484 1.256 0 N-CA-C 113.06 0.763 . . . . 72.24 113.06 -171.535 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 17.4 m-20 -64.1 -51.42 64.1 Favored 'General case' 0 N--CA 1.476 0.86 0 O-C-N 123.474 0.484 . . . . 63.45 110.339 170.53 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -64.24 -32.47 74.07 Favored 'General case' 0 N--CA 1.483 1.21 0 C-N-CA 123.021 0.529 . . . . 72.33 111.95 -176.115 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 88.6 mtm180 -79.78 -38.12 33.82 Favored 'General case' 0 N--CA 1.486 1.366 0 C-N-CA 122.787 0.435 . . . . 72.31 110.787 178.712 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 62.4 t30 -64.55 -35.91 82.51 Favored 'General case' 0 N--CA 1.49 1.536 0 C-N-CA 122.967 0.507 . . . . 72.52 111.192 175.425 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 96.2 mt -78.02 -35.99 49.22 Favored 'General case' 0 N--CA 1.48 1.043 0 C-N-CA 123.402 0.681 . . . . 74.45 110.985 179.058 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 6.2 tmmm? -72.02 -43.77 64.47 Favored 'General case' 0 N--CA 1.478 0.962 0 C-N-CA 122.74 0.416 . . . . 74.11 110.177 -177.955 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 2.0 t -67.22 -30.92 70.97 Favored 'General case' 0 N--CA 1.479 0.984 0 C-N-CA 123.781 0.832 . . . . 73.45 111.569 -179.892 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -63.59 -53.18 55.68 Favored 'General case' 0 N--CA 1.478 0.969 0 CA-C-N 115.37 -0.832 . . . . 64.43 111.038 173.817 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 10.8 mp -68.61 -27.02 65.66 Favored 'General case' 0 N--CA 1.487 1.418 0 C-N-CA 123.432 0.693 . . . . 74.23 112.111 177.297 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 9.5 tp10 -69.89 -51.44 33.13 Favored 'General case' 0 C--N 1.35 0.624 0 C-N-CA 124.348 1.059 . . . . 75.12 110.365 179.142 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 47.1 t -62.83 -36.58 83.67 Favored 'General case' 0 N--CA 1.481 1.092 0 C-N-CA 124.091 0.956 . . . . 65.35 111.756 177.207 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -61.97 -50.56 71.61 Favored 'General case' 0 N--CA 1.479 1.006 0 C-N-CA 123.638 0.775 . . . . 64.12 111.798 177.919 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 51' ' ' PHE . . . . . . . . . . . . . 32.5 t80 -75.32 -23.3 57.27 Favored 'General case' 0 CA--C 1.56 1.331 0 C-N-CA 122.819 0.447 . . . . 73.41 111.348 178.552 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -71.91 -24.67 61.68 Favored 'General case' 0 N--CA 1.487 1.405 0 C-N-CA 123.464 0.705 . . . . 64.1 112.095 175.148 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 23.6 t70 -63.48 -33.45 75.6 Favored 'General case' 0 N--CA 1.482 1.169 0 C-N-CA 123.349 0.66 . . . . 72.25 110.922 174.769 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 36.2 t70 -72.21 -25.23 61.57 Favored 'General case' 0 CA--C 1.557 1.242 0 C-N-CA 123.643 0.777 . . . . 74.3 111.908 176.526 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 12.0 pt20 -127.16 39.47 3.9 Favored 'General case' 0 N--CA 1.49 1.56 0 C-N-CA 123.465 0.706 . . . . 72.33 111.93 -173.708 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 82.7 p -55.66 -41.33 73.49 Favored 'General case' 0 N--CA 1.501 2.088 0 C-N-CA 123.018 0.527 . . . . 64.24 112.352 -179.063 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 45.9 t80 -145.22 96.09 4.98 Favored Pre-proline 0 N--CA 1.481 1.105 0 C-N-CA 123.31 0.644 . . . . 74.51 110.032 168.831 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 15.0 Cg_exo -71.55 168.79 22.62 Favored 'Trans proline' 0 CA--C 1.565 2.039 0 C-N-CA 123.182 2.588 . . . . 74.01 112.265 171.596 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 31.7 Cg_exo -60.06 97.33 0.11 Allowed 'Trans proline' 0 C--N 1.381 2.282 0 C-N-CA 122.403 2.069 . . . . 55.41 112.053 173.527 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 1.2 tm-20 -67.53 103.66 1.39 Allowed 'General case' 0 CA--C 1.551 1.013 0 C-N-CA 123.567 0.747 . . . . 51.24 111.198 -176.024 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 62.2 m . . . . . 0 N--CA 1.484 1.261 0 C-N-CA 124.261 1.025 . . . . 72.21 109.926 179.638 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 1' ' ' PHE . . . . . . . . . . . . . 97.5 m-85 . . . . . 0 N--CA 1.488 1.43 0 N-CA-C 110.549 -0.167 . . . . 73.32 110.549 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 2' ' ' THR . . . . . 0.501 HG23 ' H ' ' A' ' 5' ' ' GLU . 6.7 t -152.63 150.11 29.16 Favored 'General case' 0 N--CA 1.482 1.16 0 C-N-CA 123.66 0.784 . . . . 70.23 110.696 178.002 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . 0.444 ' HA ' HD11 ' A' ' 6' ' ' LEU . 9.2 mp -65.84 -17.43 64.64 Favored 'General case' 0 N--CA 1.478 0.958 0 CA-C-N 115.331 -0.849 . . . . 65.33 111.247 176.858 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 45.8 mm -67.86 -43.86 85.76 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.141 0 C-N-CA 123.136 0.574 . . . . 64.42 110.894 175.398 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . 0.501 ' H ' HG23 ' A' ' 2' ' ' THR . 25.6 mm-40 -58.86 -41.26 86.62 Favored 'General case' 0 N--CA 1.49 1.545 0 C-N-CA 123.089 0.555 . . . . 62.33 111.372 174.308 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . 0.444 HD11 ' HA ' ' A' ' 3' ' ' LEU . 71.5 mt -61.2 -47.48 85.95 Favored 'General case' 0 N--CA 1.482 1.134 0 C-N-CA 123.368 0.667 . . . . 72.52 111.223 175.13 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 60.4 tp -54.93 -42.94 72.88 Favored 'General case' 0 CA--C 1.554 1.104 0 C-N-CA 124.59 1.156 . . . . 74.24 112.238 176.305 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 94.8 mt -70.69 -40.54 77.07 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.091 0 C-N-CA 124.308 1.043 . . . . 73.31 111.993 178.88 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 46.1 t -62.52 -45.7 98.16 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.959 0 C-N-CA 123.325 0.65 . . . . 72.41 111.095 175.718 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 69.1 t -62.07 -36.79 76.16 Favored 'Isoleucine or valine' 0 CA--C 1.561 1.387 0 C-N-CA 123.281 0.633 . . . . 74.15 111.379 174.664 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -65.95 -51.6 57.12 Favored 'General case' 0 CA--C 1.553 1.081 0 C-N-CA 123.099 0.559 . . . . 73.33 112.276 178.688 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' ILE . . . . . 0.606 ' HA ' HD11 ' A' ' 15' ' ' ILE . 23.5 pt -68.41 -42.42 84.04 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.089 0 C-N-CA 123.159 0.584 . . . . 71.43 111.978 -175.199 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 79.3 mt -65.14 -32.68 59.34 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.028 0 C-N-CA 123.307 0.643 . . . . 75.03 110.51 174.807 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -60.82 -38.25 94.99 Favored Glycine 0 C--N 1.354 1.573 0 CA-C-N 115.831 -0.622 . . . . 71.44 112.833 174.992 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . 0.606 HD11 ' HA ' ' A' ' 12' ' ' ILE . 24.7 mt -69.87 -43.05 79.96 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.975 0 C-N-CA 123.877 0.871 . . . . 64.0 111.173 175.569 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . 0.483 ' HG ' ' O ' ' A' ' 12' ' ' ILE . 20.7 mt -63.95 -35.73 81.65 Favored 'General case' 0 N--CA 1.486 1.37 0 C-N-CA 122.969 0.508 . . . . 74.25 111.366 -178.766 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -73.24 -44.58 59.22 Favored 'General case' 0 N--CA 1.479 1.014 0 C-N-CA 123.216 0.606 . . . . 75.21 110.673 175.564 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -60.38 -28.56 68.31 Favored 'General case' 0 N--CA 1.483 1.209 0 C-N-CA 124.166 0.986 . . . . 55.3 113.267 -179.843 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 2.8 pp -89.75 -38.38 11.03 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.327 0 CA-C-N 118.101 0.41 . . . . 63.45 111.607 173.656 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -67.8 -54.42 19.22 Favored 'General case' 0 N--CA 1.487 1.386 0 N-CA-C 112.724 0.639 . . . . 63.43 112.724 -172.779 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 21.7 mt -53.07 -54.19 47.06 Favored Pre-proline 0 CA--C 1.566 1.576 0 N-CA-C 113.902 1.075 . . . . 73.15 113.902 -176.587 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 38.2 Cg_endo -65.66 -38.83 22.97 Favored 'Trans proline' 0 C--N 1.381 2.24 0 CA-C-N 121.636 1.62 . . . . 73.12 113.166 175.118 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 20.1 tt0 -62.98 -38.16 90.03 Favored 'General case' 0 N--CA 1.489 1.525 0 C-N-CA 123.462 0.705 . . . . 75.31 110.95 -177.102 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 24' ' ' PHE . . . . . . . . . . . . . 32.8 m-85 -91.9 -36.99 13.15 Favored 'General case' 0 N--CA 1.486 1.348 0 CA-C-N 115.046 -0.979 . . . . 72.41 111.746 -174.663 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 47.3 t -63.59 -46.75 84.41 Favored 'General case' 0 N--CA 1.492 1.639 0 CA-C-N 117.774 0.261 . . . . 70.14 111.189 173.777 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -67.14 -26.44 66.67 Favored 'General case' 0 N--CA 1.483 1.207 0 C-N-CA 122.909 0.484 . . . . 62.33 111.834 174.796 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 68.8 t80 -66.42 -55.15 17.14 Favored 'General case' 0 N--CA 1.485 1.284 0 C-N-CA 122.995 0.518 . . . . 74.44 111.131 178.897 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 35.6 ptt180 -65.45 -28.93 69.57 Favored 'General case' 0 N--CA 1.475 0.817 0 C-N-CA 123.473 0.709 . . . . 74.33 111.488 -175.841 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 78.6 t -77.35 -48.32 24.79 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.843 0 CA-C-N 115.976 -0.556 . . . . 74.01 110.422 179.085 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 15.1 pttp -67.79 -27.52 66.81 Favored 'General case' 0 N--CA 1.476 0.848 0 CA-C-N 116.171 -0.468 . . . . 72.4 110.557 178.709 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -81.28 -30.01 34.13 Favored 'General case' 0 C--N 1.366 1.292 0 N-CA-C 110.086 -0.339 . . . . 74.44 110.086 -179.798 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 62.2 t80 -62.75 -54.29 41.41 Favored 'General case' 0 C--N 1.352 0.7 0 CA-C-N 115.957 -0.565 . . . . 74.34 109.724 174.72 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 52.1 m-80 -69.35 -37.7 77.78 Favored 'General case' 0 N--CA 1.479 0.993 0 C-N-CA 123.637 0.775 . . . . 75.31 113.064 179.512 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 33.7 t -63.42 -55.89 20.65 Favored 'General case' 0 N--CA 1.498 1.953 0 CA-C-O 120.964 0.411 . . . . 37.68 111.502 178.734 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -68.12 -38.01 81.78 Favored 'General case' 0 CA--C 1.542 0.637 0 CA-C-N 115.435 -0.802 . . . . 74.13 112.027 -179.205 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -66.35 -52.79 43.42 Favored 'General case' 0 N--CA 1.499 1.983 0 N-CA-C 112.242 0.46 . . . . 62.44 112.242 179.735 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 50.7 m -58.16 -43.45 87.4 Favored 'General case' 0 N--CA 1.488 1.431 0 C-N-CA 123.1 0.56 . . . . 75.54 111.465 179.689 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 41.7 t -74.37 -32.08 62.62 Favored 'General case' 0 N--CA 1.481 1.121 0 CA-C-N 116.022 -0.535 . . . . 73.23 112.038 -179.275 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 24.1 t70 -59.09 -54.92 41.59 Favored 'General case' 0 N--CA 1.48 1.062 0 C-N-CA 122.926 0.49 . . . . 73.31 111.21 175.44 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 4.0 pp -75.4 -26.46 58.43 Favored 'General case' 0 N--CA 1.49 1.567 0 CA-C-N 116.125 -0.488 . . . . 74.13 111.455 -172.119 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 59.1 ttp180 -75.76 -40.99 54.41 Favored 'General case' 0 CA--C 1.545 0.785 0 C-N-CA 123.554 0.742 . . . . 75.03 110.87 175.788 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 64.1 t30 -67.62 -36.93 81.73 Favored 'General case' 0 N--CA 1.487 1.409 0 C-N-CA 123.301 0.641 . . . . 60.15 111.11 178.945 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 81.0 mt -73.3 -27.97 61.84 Favored 'General case' 0 N--CA 1.482 1.168 0 C-N-CA 122.891 0.476 . . . . 75.2 111.33 178.443 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . 0.451 ' HE3' ' HA ' ' A' ' 44' ' ' LYS . 0.1 OUTLIER -79.34 -44.72 21.01 Favored 'General case' 0 N--CA 1.469 0.506 0 C-N-CA 122.723 0.409 . . . . 61.34 110.215 -179.887 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 4.9 t -69.53 -34.43 74.24 Favored 'General case' 0 N--CA 1.48 1.033 0 O-C-N 123.715 0.634 . . . . 72.41 111.17 -177.637 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -69.1 -41.79 76.98 Favored 'General case' 0 N--CA 1.477 0.887 0 C-N-CA 123.718 0.807 . . . . 62.44 111.304 174.06 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 42.9 tp -66.32 -43.98 84.67 Favored 'General case' 0 N--CA 1.477 0.899 0 C-N-CA 123.481 0.712 . . . . 74.2 112.165 -179.78 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 12.9 pt-20 -74.05 -34.05 63.93 Favored 'General case' 0 N--CA 1.484 1.254 0 C-N-CA 122.798 0.439 . . . . 73.34 111.624 -177.199 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 79.4 p -72.32 -33.95 67.74 Favored 'General case' 0 N--CA 1.489 1.484 0 C-N-CA 122.725 0.41 . . . . 71.22 110.896 175.561 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -70.38 -41.91 72.44 Favored 'General case' 0 N--CA 1.479 0.986 0 CA-C-N 115.646 -0.706 . . . . 72.32 111.074 177.696 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 51' ' ' PHE . . . . . . . . . . . . . 69.7 t80 -79.6 -15.85 56.9 Favored 'General case' 0 CA--C 1.553 1.059 0 C-N-CA 123.256 0.622 . . . . 74.44 110.67 179.998 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -67.54 -40.76 85.02 Favored 'General case' 0 N--CA 1.478 0.929 0 C-N-CA 123.25 0.62 . . . . 71.11 110.515 179.688 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 3.0 p30 -78.01 -26.8 48.73 Favored 'General case' 0 CA--C 1.555 1.155 0 CA-C-N 116.039 -0.528 . . . . 63.12 111.595 178.857 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -62.95 -53.83 47.94 Favored 'General case' 0 N--CA 1.488 1.447 0 C-N-CA 123.181 0.592 . . . . 73.12 111.451 171.265 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 10.5 pt20 -68.92 -33.96 74.6 Favored 'General case' 0 N--CA 1.481 1.124 0 C-N-CA 122.58 0.352 . . . . 72.35 111.948 -176.572 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 81.7 p -92.98 73.17 4.76 Favored 'General case' 0 N--CA 1.485 1.319 0 CA-C-O 122.153 0.978 . . . . 73.14 109.936 172.627 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 36.6 p90 -101.21 151.38 37.7 Favored Pre-proline 0 CA--C 1.557 1.215 0 CA-C-N 114.725 -1.125 . . . . 73.51 110.34 179.129 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 45.3 Cg_exo -57.58 134.17 61.47 Favored 'Trans proline' 0 C--N 1.379 2.148 0 C-N-CA 122.319 2.013 . . . . 71.32 112.062 175.157 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 50.0 Cg_exo -56.7 140.76 91.36 Favored 'Trans proline' 0 C--N 1.378 2.08 0 C-N-CA 123.128 2.552 . . . . 43.3 113.664 179.167 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 11.5 pt-20 -56.22 -43.4 78.54 Favored 'General case' 0 CA--C 1.561 1.38 0 C-N-CA 124.175 0.99 . . . . 62.22 112.776 -178.772 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 63.5 m . . . . . 0 N--CA 1.488 1.456 0 C-N-CA 124.78 1.232 . . . . 73.25 109.434 179.26 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 1' ' ' PHE . . . . . . . . . . . . . 86.3 m-85 . . . . . 0 N--CA 1.487 1.411 0 N-CA-C 110.295 -0.261 . . . . 61.45 110.295 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 55.1 m -78.45 123.01 26.57 Favored 'General case' 0 N--CA 1.476 0.845 0 N-CA-C 109.023 -0.732 . . . . 64.2 109.023 179.339 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . 0.489 HD13 HD11 ' A' ' 6' ' ' LEU . 3.3 mm? -62.27 -23.04 66.47 Favored 'General case' 0 N--CA 1.487 1.391 0 C-N-CA 123.192 0.597 . . . . 75.42 111.755 -177.594 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 47.8 mm -69.75 -49.37 58.42 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.118 0 C-N-CA 123.165 0.586 . . . . 72.32 110.475 171.397 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 40.8 mm-40 -59.35 -38.32 80.08 Favored 'General case' 0 N--CA 1.491 1.614 0 C-N-CA 123.337 0.655 . . . . 74.45 112.166 176.062 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . 0.489 HD11 HD13 ' A' ' 3' ' ' LEU . 78.6 mt -69.95 -39.75 75.84 Favored 'General case' 0 N--CA 1.48 1.033 0 C-N-CA 123.001 0.521 . . . . 72.45 111.31 176.883 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 2.1 tm? -60.01 -48.46 81.62 Favored 'General case' 0 CA--C 1.552 1.028 0 C-N-CA 123.632 0.773 . . . . 75.53 110.432 176.958 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 77.6 mt -68.84 -48.29 71.57 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.732 0 C-N-CA 123.997 0.919 . . . . 75.52 112.227 -177.568 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 7.1 p -60.57 -40.62 85.07 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.158 0 CA-C-N 118.22 0.463 . . . . 64.31 111.823 -178.29 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 54.0 t -67.16 -41.52 87.02 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.027 0 C-N-CA 123.328 0.651 . . . . 74.35 110.903 173.572 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -64.03 -52.43 59.5 Favored 'General case' 0 N--CA 1.484 1.242 0 C-N-CA 122.946 0.498 . . . . 63.35 111.987 -178.581 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' ILE . . . . . 0.497 ' O ' ' HG ' ' A' ' 16' ' ' LEU . 28.6 pt -64.09 -47.21 91.23 Favored 'Isoleucine or valine' 0 C--N 1.355 0.815 0 C-N-CA 123.362 0.665 . . . . 70.03 111.474 -175.817 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 79.0 mt -64.21 -31.04 51.8 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.054 0 C-N-CA 123.322 0.649 . . . . 63.04 110.443 177.929 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -65.26 -40.52 96.69 Favored Glycine 0 C--N 1.352 1.445 0 CA-C-N 115.714 -0.675 . . . . 74.14 112.9 174.084 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 22.4 mt -69.05 -44.77 80.91 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.052 0 C-N-CA 123.63 0.772 . . . . 61.03 110.833 175.382 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . 0.497 ' HG ' ' O ' ' A' ' 12' ' ' ILE . 16.3 mt -60.99 -37.14 81.44 Favored 'General case' 0 N--CA 1.48 1.047 0 C-N-CA 123.345 0.658 . . . . 72.34 111.043 -178.314 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -74.24 -49.33 23.73 Favored 'General case' 0 CA--C 1.551 1.002 0 C-N-CA 122.959 0.504 . . . . 74.33 110.944 176.352 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -55.82 -29.94 60.6 Favored 'General case' 0 N--CA 1.491 1.594 0 C-N-CA 124.017 0.927 . . . . 74.31 113.248 -178.787 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 2.8 pp -86.97 -37.66 11.44 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.833 0 CA-C-O 119.601 -0.237 . . . . 74.5 111.472 172.432 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -61.95 -53.98 48.06 Favored 'General case' 0 N--CA 1.487 1.411 0 C-N-CA 124.009 0.924 . . . . 75.12 113.274 -172.098 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 3.0 mp -56.46 -54.62 51.35 Favored Pre-proline 0 CA--C 1.572 1.817 0 CA-C-O 118.444 -0.789 . . . . 71.4 112.614 -175.094 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 36.7 Cg_endo -64.85 -39.33 26.0 Favored 'Trans proline' 0 C--N 1.381 2.268 0 C-N-CA 122.166 1.911 . . . . 75.22 113.305 176.385 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 5.1 tt0 -60.05 -43.55 95.3 Favored 'General case' 0 N--CA 1.489 1.512 0 C-N-CA 123.944 0.898 . . . . 65.51 110.523 -179.075 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 24' ' ' PHE . . . . . . . . . . . . . 16.0 m-85 -87.67 -28.28 21.92 Favored 'General case' 0 N--CA 1.485 1.324 0 CA-C-N 114.819 -1.082 . . . . 74.32 111.319 -172.281 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 74.3 m -59.62 -59.41 5.48 Favored 'General case' 0 N--CA 1.481 1.122 0 N-CA-C 109.549 -0.537 . . . . 74.22 109.549 167.264 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -62.0 -26.95 68.52 Favored 'General case' 0 N--CA 1.485 1.289 0 C-N-CA 124.02 0.928 . . . . 51.31 112.715 -179.714 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 27' ' ' TYR . . . . . 0.416 ' O ' ' HG2' ' A' ' 30' ' ' LYS . 57.3 t80 -70.03 -52.92 20.2 Favored 'General case' 0 N--CA 1.484 1.252 0 C-N-CA 123.476 0.71 . . . . 65.41 110.885 176.21 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 82.4 mtp180 -71.84 -20.68 61.79 Favored 'General case' 0 N--CA 1.475 0.81 0 CA-C-N 115.812 -0.631 . . . . 73.1 111.524 179.505 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 38.9 t -76.82 -44.51 32.68 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.445 0 C-N-CA 122.744 0.418 . . . . 64.53 110.397 174.996 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . 0.416 ' HG2' ' O ' ' A' ' 27' ' ' TYR . 17.1 ptmt -71.15 -26.79 63.14 Favored 'General case' 0 N--CA 1.479 1.001 0 O-C-N 123.391 0.432 . . . . 73.51 110.34 178.57 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -81.81 -32.88 31.07 Favored 'General case' 0 C--N 1.362 1.111 0 C-N-CA 123.059 0.544 . . . . 54.25 110.453 178.176 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 41.5 t80 -65.39 -46.23 80.89 Favored 'General case' 0 C--O 1.21 -0.996 0 N-CA-C 108.888 -0.782 . . . . 75.42 108.888 174.772 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 8.2 t30 -66.64 -45.07 80.22 Favored 'General case' 0 CA--C 1.547 0.832 0 C-N-CA 125.034 1.334 . . . . 74.4 111.982 177.294 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 42.4 t -63.99 -56.7 13.17 Favored 'General case' 0 N--CA 1.491 1.618 0 C-N-CA 123.27 0.628 . . . . 63.32 111.877 -179.094 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -65.91 -36.42 83.34 Favored 'General case' 0 N--CA 1.475 0.779 0 C-N-CA 123.139 0.576 . . . . 51.24 111.992 -179.248 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -69.47 -40.75 76.91 Favored 'General case' 0 N--CA 1.496 1.83 0 CA-C-N 117.764 0.256 . . . . 71.11 111.639 177.954 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 47.2 t -62.59 -44.58 95.96 Favored 'General case' 0 N--CA 1.484 1.242 0 C-N-CA 123.155 0.582 . . . . 72.22 110.816 175.375 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 70.9 m -71.04 -26.4 63.07 Favored 'General case' 0 N--CA 1.483 1.207 0 C-N-CA 122.942 0.497 . . . . 72.2 111.853 178.303 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 28.2 t70 -66.31 -51.17 60.05 Favored 'General case' 0 CA--C 1.551 0.993 0 C-N-CA 123.252 0.621 . . . . 73.14 110.416 172.929 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 4.0 pp -78.25 -18.34 55.48 Favored 'General case' 0 N--CA 1.49 1.569 0 N-CA-C 112.082 0.401 . . . . 63.44 112.082 -174.853 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 41' ' ' ARG . . . . . 0.401 ' HA ' ' HD3' ' A' ' 41' ' ' ARG . 26.9 mmt180 -84.13 -59.49 2.39 Favored 'General case' 0 N--CA 1.48 1.06 0 CA-C-O 118.93 -0.557 . . . . 74.53 112.113 172.695 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 49.5 t-20 -60.56 -42.6 96.95 Favored 'General case' 0 N--CA 1.497 1.887 0 C-N-CA 123.034 0.534 . . . . 62.35 111.824 -174.432 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . 0.435 ' O ' HD22 ' A' ' 47' ' ' LEU . 96.7 mt -75.08 -28.25 60.24 Favored 'General case' 0 N--CA 1.486 1.335 0 C-N-CA 122.43 0.292 . . . . 73.51 111.471 -175.312 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 29.4 ttpp -79.42 -48.1 14.56 Favored 'General case' 0 N--CA 1.474 0.765 0 N-CA-C 109.664 -0.495 . . . . 74.34 109.664 178.613 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 3.9 t -70.22 -27.21 64.29 Favored 'General case' 0 N--CA 1.487 1.424 0 C-N-CA 124.174 0.99 . . . . 71.11 112.071 -174.455 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -60.92 -50.77 72.08 Favored 'General case' 0 N--CA 1.478 0.97 0 O-C-N 123.74 0.65 . . . . 72.24 110.914 173.146 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 47' ' ' LEU . . . . . 0.435 HD22 ' O ' ' A' ' 43' ' ' LEU . 4.2 mm? -65.68 -36.16 82.84 Favored 'General case' 0 N--CA 1.487 1.41 0 C-N-CA 123.609 0.763 . . . . 73.51 111.569 175.98 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 48.7 mt-10 -68.04 -33.75 75.16 Favored 'General case' 0 N--CA 1.483 1.211 0 C-N-CA 122.968 0.507 . . . . 74.11 111.499 176.579 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 44.1 t -83.08 -23.16 33.22 Favored 'General case' 0 N--CA 1.485 1.302 0 C-N-CA 123.313 0.645 . . . . 43.33 111.84 177.736 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -79.0 -30.13 44.09 Favored 'General case' 0 N--CA 1.486 1.331 0 C-N-CA 123.6 0.76 . . . . 51.51 112.551 -175.268 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 51' ' ' PHE . . . . . . . . . . . . . 78.1 t80 -115.83 -22.36 9.13 Favored 'General case' 0 N--CA 1.477 0.898 0 C-N-CA 123.434 0.694 . . . . 70.05 110.135 -177.966 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . 70.81 89.95 0.1 Allowed 'General case' 0 CA--C 1.55 0.965 0 C-N-CA 125.008 1.323 . . . . 72.13 109.575 -165.058 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 18.7 t70 -40.14 -52.52 2.56 Favored 'General case' 0 N--CA 1.499 1.991 0 C-N-CA 125.497 1.519 . . . . 74.24 113.569 -174.653 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 15.0 t70 -114.28 126.42 55.01 Favored 'General case' 0 N--CA 1.48 1.026 0 N-CA-C 108.918 -0.771 . . . . 65.34 108.918 171.512 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 77.1 mm-40 -81.89 -14.52 56.07 Favored 'General case' 0 N--CA 1.486 1.353 0 N-CA-C 112.849 0.685 . . . . 64.22 112.849 -174.639 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 40.9 p -119.0 5.44 11.35 Favored 'General case' 0 N--CA 1.493 1.703 0 N-CA-C 113.3 0.852 . . . . 73.23 113.3 -171.687 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 71.5 t80 -53.85 110.16 1.92 Allowed Pre-proline 0 N--CA 1.489 1.494 0 C-N-CA 124.112 0.965 . . . . 62.04 112.925 -173.638 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 37.7 Cg_endo -87.89 167.84 6.93 Favored 'Trans proline' 0 CA--C 1.563 1.941 0 C-N-CA 122.713 2.275 . . . . 72.25 112.796 176.373 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 24.5 Cg_exo -66.7 153.06 79.27 Favored 'Trans proline' 0 C--N 1.373 1.841 0 C-N-CA 122.491 2.128 . . . . 74.44 111.883 163.876 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 2.6 mp0 -68.91 111.38 4.91 Favored 'General case' 0 N--CA 1.481 1.116 0 C-N-CA 123.074 0.55 . . . . 74.34 110.087 178.791 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 38.3 t . . . . . 0 CA--C 1.563 1.448 0 C-N-CA 123.571 0.748 . . . . 64.44 111.822 -178.726 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 1' ' ' PHE . . . . . . . . . . . . . 98.9 m-85 . . . . . 0 N--CA 1.487 1.393 0 CA-C-O 120.877 0.37 . . . . 75.02 110.697 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 31.4 p -75.43 156.14 35.62 Favored 'General case' 0 N--CA 1.483 1.201 0 C-N-CA 123.22 0.608 . . . . 74.13 111.822 -179.586 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 3.3 mm? -64.63 -19.29 65.6 Favored 'General case' 0 N--CA 1.484 1.255 0 CA-C-N 115.574 -0.739 . . . . 62.4 111.05 171.931 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 49.6 mm -73.64 -48.57 39.93 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.026 0 C-N-CA 123.163 0.585 . . . . 64.41 110.668 178.878 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 47.1 mt-10 -56.64 -44.35 81.18 Favored 'General case' 0 N--CA 1.489 1.49 0 C-N-CA 123.396 0.679 . . . . 74.31 111.267 175.971 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 82.3 mt -59.18 -47.0 86.94 Favored 'General case' 0 N--CA 1.481 1.106 0 C-N-CA 123.439 0.696 . . . . 72.4 111.579 174.213 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 37.1 tp -56.7 -40.37 75.49 Favored 'General case' 0 CA--C 1.549 0.926 0 C-N-CA 123.454 0.701 . . . . 73.14 112.138 178.706 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 82.4 mt -66.52 -50.43 66.9 Favored 'Isoleucine or valine' 0 C--N 1.355 0.825 0 C-N-CA 123.972 0.909 . . . . 72.52 111.275 178.458 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 86.8 t -58.25 -44.11 87.31 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.974 0 C-N-CA 123.583 0.753 . . . . 75.03 111.343 179.18 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 70.0 t -67.07 -36.15 76.28 Favored 'Isoleucine or valine' 0 CA--C 1.554 1.121 0 C-N-CA 122.896 0.478 . . . . 75.24 111.695 176.429 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -67.18 -53.55 29.35 Favored 'General case' 0 N--CA 1.483 1.188 0 C-N-CA 122.607 0.363 . . . . 75.52 111.325 179.991 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' ILE . . . . . 0.585 HG13 HD13 ' A' ' 13' ' ' ILE . 33.4 pt -64.1 -48.4 86.0 Favored 'Isoleucine or valine' 0 CA--C 1.554 1.107 0 C-N-CA 123.439 0.696 . . . . 63.45 111.651 -175.829 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' ILE . . . . . 0.585 HD13 HG13 ' A' ' 12' ' ' ILE . 1.8 mp -64.84 -32.97 60.41 Favored 'Isoleucine or valine' 0 C--N 1.372 1.566 0 C-N-CA 123.066 0.546 . . . . 75.11 109.986 175.479 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -59.53 -37.63 92.44 Favored Glycine 0 C--N 1.352 1.424 0 O-C-N 123.578 0.549 . . . . 63.43 113.328 177.641 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 18.5 mt -72.12 -44.65 64.93 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.989 0 C-N-CA 123.372 0.669 . . . . 65.31 110.784 176.043 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . 0.507 ' HG ' ' O ' ' A' ' 12' ' ' ILE . 22.7 mt -59.63 -37.89 79.87 Favored 'General case' 0 N--CA 1.488 1.442 0 C-N-CA 123.428 0.691 . . . . 72.33 111.136 179.41 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -74.1 -48.7 27.9 Favored 'General case' 0 N--CA 1.474 0.754 0 C-N-CA 123.603 0.761 . . . . 54.42 110.918 178.498 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -56.41 -27.76 57.45 Favored 'General case' 0 N--CA 1.486 1.33 0 C-N-CA 123.91 0.884 . . . . 71.2 112.803 -178.176 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 2.8 pp -91.39 -37.92 9.82 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.175 0 N-CA-C 112.035 0.383 . . . . 64.23 112.035 172.89 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -66.93 -50.1 63.45 Favored 'General case' 0 N--CA 1.489 1.498 0 N-CA-C 113.141 0.793 . . . . 75.31 113.141 -171.089 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 2.5 mp -59.35 -54.24 58.11 Favored Pre-proline 0 CA--C 1.567 1.623 0 CA-C-O 118.534 -0.746 . . . . 74.24 112.509 -175.392 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 30.2 Cg_endo -63.44 -39.74 35.05 Favored 'Trans proline' 0 C--N 1.384 2.43 0 C-N-CA 121.921 1.747 . . . . 64.44 113.43 176.514 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 8.9 tt0 -64.88 -37.29 87.13 Favored 'General case' 0 N--CA 1.483 1.199 0 CA-C-N 115.366 -0.834 . . . . 75.3 110.566 -177.04 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 24' ' ' PHE . . . . . . . . . . . . . 71.6 t80 -83.05 -36.86 24.6 Favored 'General case' 0 N--CA 1.484 1.234 0 CA-C-N 114.701 -1.136 . . . . 74.23 110.898 -176.243 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 40.6 t -57.39 -44.69 84.71 Favored 'General case' 0 N--CA 1.48 1.053 0 C-N-CA 123.139 0.575 . . . . 61.11 110.941 172.108 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -72.57 -32.8 66.3 Favored 'General case' 0 N--CA 1.477 0.907 0 CA-C-N 115.878 -0.601 . . . . 64.34 111.873 176.077 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 76.5 t80 -68.48 -47.44 67.06 Favored 'General case' 0 N--CA 1.493 1.684 0 C-N-CA 124.135 0.974 . . . . 75.54 112.223 -176.437 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 10.4 ptm180 -75.2 -24.72 57.82 Favored 'General case' 0 N--CA 1.475 0.802 0 CA-C-N 115.303 -0.862 . . . . 72.23 110.914 -175.274 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 86.2 t -84.01 -34.14 9.84 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.555 0 CA-C-O 121.143 0.497 . . . . 51.45 109.966 175.851 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 30.0 tttt -61.77 -35.28 77.67 Favored 'General case' 0 CA--C 1.546 0.823 0 C-N-CA 123.703 0.801 . . . . 74.12 110.172 167.301 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -68.72 -39.45 80.4 Favored 'General case' 0 N--CA 1.48 1.07 0 C-N-CA 123.239 0.616 . . . . 64.11 110.724 178.111 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 76.0 t80 -59.16 -59.7 5.04 Favored 'General case' 0 C--O 1.212 -0.871 0 CA-C-N 115.714 -0.675 . . . . 75.53 110.084 173.908 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 3.9 m-20 -56.8 -44.15 81.66 Favored 'General case' 0 N--CA 1.486 1.325 0 C-N-CA 124.06 0.944 . . . . 73.44 113.128 -179.512 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 46.9 t -68.04 -57.16 6.59 Favored 'General case' 0 N--CA 1.487 1.401 0 C-N-CA 123.289 0.635 . . . . 64.4 110.842 -177.151 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -65.9 -36.14 82.57 Favored 'General case' 0 N--CA 1.48 1.037 0 N-CA-C 112.3 0.482 . . . . 74.0 112.3 -178.758 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -69.08 -47.83 64.26 Favored 'General case' 0 N--CA 1.495 1.803 0 N-CA-C 111.921 0.341 . . . . 51.32 111.921 179.175 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 67.3 m -69.23 -33.26 73.0 Favored 'General case' 0 N--CA 1.486 1.372 0 C-N-CA 122.62 0.368 . . . . 63.13 111.762 179.179 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 32.2 t -78.96 -26.14 43.51 Favored 'General case' 0 N--CA 1.486 1.342 0 C-N-CA 123.071 0.549 . . . . 43.34 111.339 178.284 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 27.1 t70 -67.63 -48.27 67.21 Favored 'General case' 0 N--CA 1.476 0.865 0 C-N-CA 123.146 0.578 . . . . 74.01 110.123 169.165 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 92.2 mt -67.13 -30.97 71.11 Favored 'General case' 0 N--CA 1.483 1.193 0 C-N-CA 123.144 0.578 . . . . 64.33 110.974 -179.497 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 50.1 ttm-85 -71.78 -45.79 60.45 Favored 'General case' 0 CA--C 1.541 0.626 0 C-N-CA 123.269 0.628 . . . . 74.41 110.266 175.178 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 63.3 t30 -64.28 -39.76 94.58 Favored 'General case' 0 N--CA 1.482 1.139 0 C-N-CA 123.605 0.762 . . . . 75.44 111.863 -179.047 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 93.9 mt -75.91 -30.93 58.93 Favored 'General case' 0 N--CA 1.479 1.009 0 C-N-CA 123.247 0.619 . . . . 74.31 111.292 179.889 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 23.8 ttmm -73.55 -47.52 40.13 Favored 'General case' 0 N--CA 1.477 0.918 0 C-N-CA 123.039 0.536 . . . . 75.02 110.21 -178.483 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 3.6 t -68.69 -32.83 72.92 Favored 'General case' 0 N--CA 1.475 0.811 0 CA-C-N 114.592 -1.185 . . . . 75.41 111.362 -178.436 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -70.68 -43.6 68.74 Favored 'General case' 0 N--CA 1.474 0.727 0 CA-C-N 115.356 -0.838 . . . . 74.11 111.236 173.791 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 47' ' ' LEU . . . . . 0.476 HD22 HG22 ' A' ' 56' ' ' THR . 14.4 tp -70.52 -37.23 74.1 Favored 'General case' 0 N--CA 1.487 1.377 0 C-N-CA 123.108 0.563 . . . . 54.04 111.611 -175.77 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 12.2 pt-20 -74.16 -30.85 62.46 Favored 'General case' 0 N--CA 1.482 1.137 0 CA-C-N 116.187 -0.461 . . . . 75.2 111.071 178.217 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 24.9 t -82.28 -14.9 54.7 Favored 'General case' 0 N--CA 1.487 1.414 0 C-N-CA 123.027 0.531 . . . . 74.31 112.103 174.296 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -83.2 -49.37 9.52 Favored 'General case' 0 N--CA 1.485 1.305 0 C-N-CA 123.568 0.747 . . . . 74.25 111.159 -179.12 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 51' ' ' PHE . . . . . . . . . . . . . 25.6 m-85 -87.59 -42.01 13.03 Favored 'General case' 0 N--CA 1.47 0.539 0 CA-C-N 115.845 -0.616 . . . . 71.44 110.498 179.713 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . 60.11 20.23 9.47 Favored 'General case' 0 N--CA 1.49 1.568 0 C-N-CA 124.425 1.09 . . . . 73.33 112.501 -177.321 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 31.5 t70 -130.42 14.71 5.54 Favored 'General case' 0 N--CA 1.491 1.604 0 C-N-CA 123.829 0.852 . . . . 72.42 111.022 -174.004 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 26.7 m-20 61.75 24.64 14.71 Favored 'General case' 0 N--CA 1.493 1.708 0 C-N-CA 124.596 1.158 . . . . 71.5 113.604 179.652 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 20.8 mt-30 -74.9 -6.1 47.3 Favored 'General case' 0 N--CA 1.485 1.29 0 C-N-CA 123.615 0.766 . . . . 75.31 111.505 174.972 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 56' ' ' THR . . . . . 0.476 HG22 HD22 ' A' ' 47' ' ' LEU . 80.6 m -55.62 -38.43 69.47 Favored 'General case' 0 N--CA 1.484 1.269 0 C-N-CA 124.599 1.16 . . . . 64.22 111.623 171.209 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 92.9 m-85 -112.26 101.49 52.21 Favored Pre-proline 0 CA--C 1.556 1.206 0 C-N-CA 123.366 0.666 . . . . 73.03 110.188 178.003 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 16.4 Cg_exo -71.48 157.34 56.57 Favored 'Trans proline' 0 CA--C 1.564 2.02 0 C-N-CA 122.754 2.303 . . . . 74.22 112.644 173.692 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 42.1 Cg_exo -58.68 90.54 0.06 OUTLIER 'Trans proline' 0 C--N 1.387 2.563 0 C-N-CA 122.926 2.417 . . . . 72.32 112.295 172.732 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 39.0 tt0 -82.33 -29.98 30.72 Favored 'General case' 0 N--CA 1.479 0.983 0 C-N-CA 123.933 0.893 . . . . 73.52 112.326 -174.441 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 35.2 t . . . . . 0 N--CA 1.493 1.682 0 C-N-CA 123.104 0.562 . . . . 73.2 112.031 -176.283 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 1' ' ' PHE . . . . . . . . . . . . . 87.8 m-85 . . . . . 0 N--CA 1.485 1.301 0 N-CA-C 111.46 0.17 . . . . 74.14 111.46 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 2' ' ' THR . . . . . 0.472 HG23 ' H ' ' A' ' 5' ' ' GLU . 6.7 t -128.93 150.51 50.34 Favored 'General case' 0 N--CA 1.487 1.417 0 C-N-CA 122.72 0.408 . . . . 73.23 111.745 -175.458 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . 0.478 HD13 HD11 ' A' ' 6' ' ' LEU . 3.4 mm? -63.22 -24.2 67.77 Favored 'General case' 0 N--CA 1.483 1.212 0 CA-C-N 115.538 -0.756 . . . . 61.1 110.63 174.317 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 41.3 mm -59.24 -49.69 82.54 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.297 0 C-N-CA 123.725 0.81 . . . . 54.22 111.22 179.301 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . 0.472 ' H ' HG23 ' A' ' 2' ' ' THR . 43.8 mm-40 -65.5 -35.55 81.2 Favored 'General case' 0 N--CA 1.479 1.02 0 CA-C-N 116.079 -0.509 . . . . 71.41 111.854 177.639 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . 0.478 HD11 HD13 ' A' ' 3' ' ' LEU . 82.4 mt -64.31 -38.63 91.72 Favored 'General case' 0 N--CA 1.483 1.206 0 C-N-CA 122.617 0.367 . . . . 63.04 111.571 176.258 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . 0.419 ' HG ' ' O ' ' A' ' 3' ' ' LEU . 91.8 mt -60.77 -44.24 97.02 Favored 'General case' 0 N--CA 1.485 1.28 0 C-N-CA 123.327 0.651 . . . . 74.05 111.213 174.321 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 96.7 mt -68.66 -53.22 28.67 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.78 0 C-N-CA 124.087 0.955 . . . . 63.23 112.565 -179.163 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 71.0 t -57.63 -43.45 83.5 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.027 0 C-N-CA 123.705 0.802 . . . . 74.44 112.005 -177.209 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 72.9 t -68.42 -33.77 62.06 Favored 'Isoleucine or valine' 0 CA--C 1.559 1.32 0 C-N-CA 122.627 0.371 . . . . 74.43 111.952 176.919 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -73.46 -49.72 25.38 Favored 'General case' 0 N--CA 1.485 1.283 0 CA-C-N 118.091 0.405 . . . . 74.11 111.841 -179.52 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' ILE . . . . . 0.424 ' O ' ' HG ' ' A' ' 16' ' ' LEU . 25.8 pt -64.93 -43.11 96.28 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.151 0 C-N-CA 123.744 0.818 . . . . 75.15 112.064 -175.488 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 78.8 mt -73.38 -30.1 29.47 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.882 0 C-N-CA 123.881 0.873 . . . . 54.23 109.893 176.305 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -62.01 -36.24 92.59 Favored Glycine 0 C--N 1.355 1.624 0 CA-C-N 115.604 -0.725 . . . . 71.41 113.046 174.858 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . 0.418 HD11 ' HA ' ' A' ' 12' ' ' ILE . 21.5 mt -69.51 -47.21 73.37 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.892 0 C-N-CA 123.407 0.683 . . . . 70.03 110.549 173.544 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . 0.424 ' HG ' ' O ' ' A' ' 12' ' ' ILE . 14.6 mt -59.94 -35.73 75.54 Favored 'General case' 0 N--CA 1.484 1.241 0 O-C-N 123.562 0.539 . . . . 72.32 112.172 -176.073 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -72.2 -52.16 17.79 Favored 'General case' 0 N--CA 1.478 0.939 0 CA-C-O 121.289 0.566 . . . . 63.24 110.662 174.87 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -64.51 -19.55 65.66 Favored 'General case' 0 N--CA 1.479 1.005 0 N-CA-C 114.175 1.176 . . . . 72.32 114.175 -176.837 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 2.7 pp -94.57 -43.33 13.09 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.178 0 CA-C-N 118.458 0.572 . . . . 65.21 111.441 173.441 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -72.39 -46.9 53.17 Favored 'General case' 0 N--CA 1.491 1.577 0 N-CA-C 112.542 0.571 . . . . 64.54 112.542 -170.483 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 23.4 mt -59.35 -54.41 56.43 Favored Pre-proline 0 CA--C 1.561 1.379 0 CA-C-O 118.091 -0.957 . . . . 74.43 113.063 -177.988 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 39.2 Cg_endo -65.43 -37.87 28.39 Favored 'Trans proline' 0 C--N 1.38 2.221 0 C-N-CA 121.821 1.681 . . . . 74.34 112.773 176.554 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 27.4 tt0 -66.07 -35.63 81.03 Favored 'General case' 0 N--CA 1.485 1.284 0 C-N-CA 123.349 0.66 . . . . 74.31 110.291 -178.124 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 24' ' ' PHE . . . . . . . . . . . . . 66.8 t80 -87.37 -38.03 16.55 Favored 'General case' 0 N--CA 1.489 1.49 0 CA-C-N 115.563 -0.744 . . . . 74.31 111.082 -176.959 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 74.7 m -56.15 -49.21 74.61 Favored 'General case' 0 N--CA 1.488 1.453 0 C-N-CA 122.358 0.263 . . . . 74.21 110.721 171.008 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -67.3 -30.76 70.7 Favored 'General case' 0 N--CA 1.483 1.216 0 C-N-CA 123.264 0.626 . . . . 54.42 112.19 175.932 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 61.2 t80 -68.38 -53.36 24.41 Favored 'General case' 0 N--CA 1.479 1.007 0 C-N-CA 123.16 0.584 . . . . 71.4 110.906 -179.044 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 1.8 ptm180 -69.59 -18.24 63.6 Favored 'General case' 0 N--CA 1.475 0.815 0 C-N-CA 123.317 0.647 . . . . 73.42 111.443 -175.415 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 52.9 t -76.5 -51.43 19.51 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.183 0 CA-C-O 120.906 0.384 . . . . 75.03 110.45 171.436 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 21.2 ptmt -73.41 -18.7 61.12 Favored 'General case' 0 N--CA 1.482 1.154 0 CA-C-N 115.819 -0.628 . . . . 64.44 111.882 -178.572 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -87.15 -33.2 19.49 Favored 'General case' 0 N--CA 1.486 1.375 0 C-N-CA 123.459 0.704 . . . . 72.44 109.822 179.09 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 69.8 t80 -69.77 -22.32 63.36 Favored 'General case' 0 N--CA 1.483 1.211 0 CA-C-N 115.566 -0.743 . . . . 71.12 109.967 171.58 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 7.6 t30 -84.33 -51.23 7.14 Favored 'General case' 0 N--CA 1.475 0.785 0 C-N-CA 124.221 1.008 . . . . 61.42 111.218 173.106 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 46.5 t -67.67 -54.95 15.4 Favored 'General case' 0 N--CA 1.492 1.631 0 C-N-CA 123.247 0.619 . . . . 64.4 112.181 -172.427 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -61.41 -39.25 90.06 Favored 'General case' 0 N--CA 1.474 0.762 0 CA-C-N 115.981 -0.554 . . . . 72.12 111.296 178.572 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -70.36 -43.3 70.46 Favored 'General case' 0 N--CA 1.483 1.176 0 O-C-N 123.359 0.412 . . . . 75.44 111.808 -178.424 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 40.2 t -59.11 -43.91 91.94 Favored 'General case' 0 N--CA 1.491 1.6 0 C-N-CA 123.53 0.732 . . . . 74.35 111.514 178.249 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 44.6 t -79.08 -27.54 43.03 Favored 'General case' 0 N--CA 1.475 0.823 0 CA-C-N 115.411 -0.813 . . . . 72.25 112.059 -179.211 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 26.6 t70 -66.6 -47.17 73.55 Favored 'General case' 0 N--CA 1.481 1.083 0 C-N-CA 122.82 0.448 . . . . 75.45 110.809 172.414 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 97.2 mt -71.82 -31.73 66.85 Favored 'General case' 0 N--CA 1.481 1.091 0 C-N-CA 123.423 0.689 . . . . 74.53 110.829 -177.288 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 50.4 ttp180 -74.08 -31.99 63.07 Favored 'General case' 0 CA--C 1.548 0.882 0 CA-C-N 115.842 -0.617 . . . . 73.42 110.3 173.347 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 42' ' ' ASN . . . . . 0.426 ' HA ' HG22 ' A' ' 45' ' ' THR . 18.0 t-20 -68.63 -31.38 70.48 Favored 'General case' 0 N--CA 1.485 1.285 0 C-N-CA 122.802 0.441 . . . . 70.33 111.14 173.916 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 96.3 mt -66.67 -37.33 84.54 Favored 'General case' 0 N--CA 1.486 1.358 0 C-N-CA 123.022 0.529 . . . . 75.25 110.391 172.719 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 17.8 tppt? -72.61 -47.66 46.06 Favored 'General case' 0 N--CA 1.473 0.677 0 C-N-CA 123.682 0.793 . . . . 61.01 110.258 -176.761 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 45' ' ' THR . . . . . 0.426 HG22 ' HA ' ' A' ' 42' ' ' ASN . 2.9 t -68.3 -31.16 70.39 Favored 'General case' 0 N--CA 1.485 1.285 0 C-N-CA 123.872 0.869 . . . . 74.45 111.489 -177.52 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -65.51 -52.43 52.76 Favored 'General case' 0 N--CA 1.473 0.687 0 CA-C-N 115.18 -0.918 . . . . 74.31 110.569 173.929 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 91.7 mt -66.36 -27.75 68.12 Favored 'General case' 0 N--CA 1.485 1.301 0 C-N-CA 123.643 0.777 . . . . 70.2 112.494 176.535 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 13.1 tp10 -71.78 -53.36 13.63 Favored 'General case' 0 C--N 1.349 0.571 0 C-N-CA 124.304 1.042 . . . . 72.32 111.108 -179.577 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 46.8 t -67.46 -34.76 77.83 Favored 'General case' 0 N--CA 1.48 1.075 0 CA-C-N 115.542 -0.754 . . . . 74.15 111.569 178.897 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -65.94 -52.14 52.39 Favored 'General case' 0 N--CA 1.482 1.126 0 C-N-CA 123.347 0.659 . . . . 63.2 111.555 177.263 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 51' ' ' PHE . . . . . . . . . . . . . 73.9 t80 -72.1 -22.12 61.39 Favored 'General case' 0 N--CA 1.492 1.635 0 C-N-CA 123.334 0.654 . . . . 72.21 111.231 -178.923 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -65.58 -43.34 90.07 Favored 'General case' 0 N--CA 1.487 1.387 0 C-N-CA 122.928 0.491 . . . . 73.35 110.709 170.654 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 34.6 t70 -73.85 -27.31 61.02 Favored 'General case' 0 CA--C 1.564 1.503 0 C-N-CA 123.799 0.84 . . . . 75.34 110.701 171.984 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 35.9 t70 67.51 123.38 0.02 OUTLIER 'General case' 0 N--CA 1.484 1.245 0 C-N-CA 126.81 2.044 . . . . 72.2 114.817 177.689 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -132.46 17.14 4.41 Favored 'General case' 0 N--CA 1.483 1.205 0 C-N-CA 124.409 1.084 . . . . 74.54 109.599 170.047 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 85.7 m -96.36 -54.06 3.4 Favored 'General case' 0 N--CA 1.489 1.479 0 C-N-CA 123.907 0.883 . . . . 54.4 110.563 -179.708 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 48.3 m-85 -85.93 149.46 50.67 Favored Pre-proline 0 N--CA 1.489 1.519 0 C-N-CA 123.412 0.685 . . . . 73.34 110.11 179.994 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 82.3 Cg_exo -50.75 132.94 38.12 Favored 'Trans proline' 0 C--N 1.382 2.315 0 C-N-CA 122.937 2.425 . . . . 70.2 113.145 173.548 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 26.9 Cg_exo -61.71 106.59 0.44 Allowed 'Trans proline' 0 C--N 1.381 2.248 0 C-N-CA 122.799 2.333 . . . . 73.44 112.801 -173.987 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 45.2 tt0 -60.14 -37.32 79.73 Favored 'General case' 0 CA--C 1.555 1.171 0 C-N-CA 123.059 0.544 . . . . 74.42 111.623 -179.401 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 73.1 p . . . . . 0 N--CA 1.487 1.41 0 C-N-CA 123.204 0.602 . . . . 64.13 110.544 173.636 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 1' ' ' PHE . . . . . . . . . . . . . 43.6 p90 . . . . . 0 N--CA 1.491 1.619 0 CA-C-O 120.719 0.295 . . . . 75.25 111.719 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 2' ' ' THR . . . . . 0.651 ' HB ' ' HG2' ' A' ' 5' ' ' GLU . 25.8 m -90.28 136.94 32.74 Favored 'General case' 0 N--CA 1.479 0.979 0 C-N-CA 123.666 0.786 . . . . 71.3 109.908 174.374 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 7.7 tt -57.15 -33.31 67.27 Favored 'General case' 0 N--CA 1.488 1.473 0 C-N-CA 123.53 0.732 . . . . 64.23 110.745 176.594 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . 0.528 ' H ' HG22 ' A' ' 2' ' ' THR . 48.7 mm -65.95 -37.34 79.61 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.251 0 C-N-CA 123.093 0.557 . . . . 73.33 111.461 -178.223 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . 0.651 ' HG2' ' HB ' ' A' ' 2' ' ' THR . 11.2 mm-40 -56.68 -45.55 81.67 Favored 'General case' 0 N--CA 1.491 1.577 0 C-N-CA 123.296 0.639 . . . . 70.51 110.726 173.586 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 53.8 mt -65.43 -42.6 92.27 Favored 'General case' 0 N--CA 1.479 1.004 0 C-N-CA 123.625 0.77 . . . . 64.03 111.385 177.887 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -56.73 -48.91 76.7 Favored 'General case' 0 CA--C 1.552 1.041 0 C-N-CA 124.364 1.066 . . . . 73.31 110.294 178.089 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 95.2 mt -65.88 -43.77 92.92 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.791 0 C-N-CA 124.254 1.022 . . . . 63.32 112.143 -179.249 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 49.6 t -62.91 -45.45 98.84 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.061 0 C-N-CA 122.868 0.467 . . . . 73.04 111.396 178.383 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 71.6 t -66.58 -32.8 59.66 Favored 'Isoleucine or valine' 0 CA--C 1.562 1.431 0 C-N-CA 122.7 0.4 . . . . 73.1 111.016 175.36 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -67.23 -55.63 13.22 Favored 'General case' 0 CA--C 1.552 1.031 0 C-N-CA 123.065 0.546 . . . . 53.34 111.584 179.219 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' ILE . . . . . 0.464 ' O ' ' HG ' ' A' ' 16' ' ' LEU . 23.7 pt -61.28 -46.03 97.43 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.125 0 C-N-CA 123.461 0.705 . . . . 72.44 111.45 -176.869 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 77.1 mt -65.76 -32.16 56.95 Favored 'Isoleucine or valine' 0 CA--C 1.551 1.002 0 C-N-CA 124.138 0.975 . . . . 74.11 110.598 176.853 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -60.35 -39.69 96.49 Favored Glycine 0 C--N 1.349 1.293 0 CA-C-N 115.685 -0.689 . . . . 72.32 112.882 172.911 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 1.8 mp -72.99 -40.32 58.98 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.06 0 N-CA-C 109.757 -0.46 . . . . 73.54 109.757 176.869 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . 0.464 ' HG ' ' O ' ' A' ' 12' ' ' ILE . 28.2 mt -58.83 -40.28 83.72 Favored 'General case' 0 N--CA 1.491 1.59 0 C-N-CA 123.113 0.565 . . . . 74.42 111.681 179.973 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -74.32 -45.77 45.19 Favored 'General case' 0 N--CA 1.479 1.009 0 C-N-CA 123.287 0.635 . . . . 72.23 110.864 176.833 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -59.18 -32.39 69.87 Favored 'General case' 0 N--CA 1.482 1.171 0 C-N-CA 123.99 0.916 . . . . 72.25 113.275 -178.871 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 2.8 pp -86.01 -37.71 12.02 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.153 0 C-N-CA 122.327 0.251 . . . . 75.4 111.324 175.628 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -63.44 -55.18 26.31 Favored 'General case' 0 N--CA 1.486 1.342 0 C-N-CA 123.792 0.837 . . . . 72.14 112.954 -174.799 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 21.5 mt -54.09 -54.51 46.6 Favored Pre-proline 0 CA--C 1.563 1.444 0 N-CA-C 113.66 0.985 . . . . 64.34 113.66 -174.956 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 37.7 Cg_endo -66.08 -40.42 15.87 Favored 'Trans proline' 0 C--N 1.378 2.103 0 CA-C-N 121.619 1.614 . . . . 72.5 112.894 176.107 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 5.7 tt0 -59.58 -41.75 90.94 Favored 'General case' 0 N--CA 1.485 1.314 0 C-N-CA 123.565 0.746 . . . . 65.33 110.829 -177.566 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 24' ' ' PHE . . . . . . . . . . . . . 19.1 m-85 -92.59 -33.9 14.24 Favored 'General case' 0 N--CA 1.484 1.234 0 CA-C-N 114.65 -1.159 . . . . 64.24 112.005 -172.068 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 25' ' ' SER . . . . . 0.41 ' O ' HG22 ' A' ' 29' ' ' VAL . 43.3 t -61.82 -53.34 57.26 Favored 'General case' 0 N--CA 1.49 1.545 0 N-CA-C 110.284 -0.265 . . . . 62.42 110.284 170.764 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -63.58 -27.38 69.21 Favored 'General case' 0 N--CA 1.48 1.037 0 C-N-CA 123.384 0.673 . . . . 73.44 112.333 176.308 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 66.6 t80 -66.22 -48.48 70.44 Favored 'General case' 0 N--CA 1.482 1.171 0 C-N-CA 122.975 0.51 . . . . 70.34 111.386 176.904 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 13.7 mmt180 -67.65 -29.72 69.1 Favored 'General case' 0 N--CA 1.476 0.853 0 O-C-N 124.067 0.854 . . . . 73.33 111.548 -179.212 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . 0.41 HG22 ' O ' ' A' ' 25' ' ' SER . 87.8 t -72.7 -48.69 44.95 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.382 0 N-CA-C 109.359 -0.608 . . . . 60.35 109.359 176.486 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 8.1 tttp -55.14 -40.41 70.53 Favored 'General case' 0 CA--C 1.549 0.931 0 C-N-CA 124.722 1.209 . . . . 74.51 111.213 172.986 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -73.83 -45.22 52.59 Favored 'General case' 0 N--CA 1.476 0.845 0 C-N-CA 122.918 0.487 . . . . 72.04 110.78 -174.045 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 53.7 t80 -64.18 -37.44 87.48 Favored 'General case' 0 CA--C 1.544 0.737 0 O-C-N 123.829 0.706 . . . . 72.11 110.676 179.636 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 93.1 m-20 -72.99 -41.68 64.06 Favored 'General case' 0 N--CA 1.485 1.287 0 C-N-CA 123.774 0.83 . . . . 71.32 112.192 178.905 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 64.7 m -68.85 -49.81 55.18 Favored 'General case' 0 N--CA 1.496 1.843 0 C-N-CA 123.184 0.594 . . . . 75.12 110.935 -179.28 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -62.61 -40.11 95.92 Favored 'General case' 0 N--CA 1.476 0.842 0 CA-C-N 115.564 -0.744 . . . . 74.13 111.333 176.345 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -61.89 -46.33 89.87 Favored 'General case' 0 N--CA 1.496 1.832 0 O-C-N 123.465 0.478 . . . . 71.52 112.219 174.793 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 67.8 m -60.34 -43.44 96.45 Favored 'General case' 0 N--CA 1.494 1.727 0 C-N-CA 123.563 0.745 . . . . 73.24 111.329 179.206 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 37.6 m -73.36 -33.72 65.23 Favored 'General case' 0 N--CA 1.476 0.834 0 CA-C-N 115.362 -0.835 . . . . 73.43 111.607 179.248 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 29.5 t70 -60.49 -52.93 63.09 Favored 'General case' 0 N--CA 1.48 1.029 0 C-N-CA 123.52 0.728 . . . . 72.02 111.338 175.872 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 4.2 pp -71.22 -31.51 67.67 Favored 'General case' 0 N--CA 1.486 1.347 0 CA-C-N 116.194 -0.457 . . . . 65.44 111.143 -172.063 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 36.2 ttm180 -80.67 -40.74 24.94 Favored 'General case' 0 CA--C 1.548 0.891 0 C-N-CA 123.131 0.572 . . . . 64.42 110.92 -179.275 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 42' ' ' ASN . . . . . 0.427 ' HA ' HG21 ' A' ' 45' ' ' THR . 19.9 t-20 -68.04 -38.07 82.09 Favored 'General case' 0 N--CA 1.489 1.501 0 N-CA-C 112.183 0.438 . . . . 71.01 112.183 -178.738 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 86.9 mt -69.99 -29.07 66.07 Favored 'General case' 0 N--CA 1.484 1.23 0 C-N-CA 122.48 0.312 . . . . 54.22 111.369 179.005 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . 0.425 ' O ' ' HG2' ' A' ' 48' ' ' GLU . 86.4 tttt -78.15 -45.08 24.2 Favored 'General case' 0 CA--C 1.542 0.655 0 CA-C-N 115.906 -0.588 . . . . 72.32 110.423 176.394 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 45' ' ' THR . . . . . 0.427 HG21 ' HA ' ' A' ' 42' ' ' ASN . 1.5 t -68.23 -30.11 69.1 Favored 'General case' 0 N--CA 1.487 1.399 0 C-N-CA 123.374 0.669 . . . . 62.02 110.832 -176.65 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -58.27 -43.91 88.15 Favored 'General case' 0 N--CA 1.474 0.762 0 CA-C-N 115.02 -0.991 . . . . 63.14 110.582 169.5 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -68.09 -39.67 82.81 Favored 'General case' 0 CA--C 1.567 1.606 0 C-N-CA 123.608 0.763 . . . . 71.41 110.832 175.016 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . 0.425 ' HG2' ' O ' ' A' ' 44' ' ' LYS . 25.0 mm-40 -65.49 -33.74 76.64 Favored 'General case' 0 N--CA 1.487 1.404 0 C-N-CA 123.498 0.719 . . . . 74.51 111.662 -178.309 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 43.3 t -84.15 -55.81 4.0 Favored 'General case' 0 N--CA 1.478 0.94 0 C-N-CA 122.803 0.441 . . . . 71.43 111.952 176.408 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -60.5 -53.21 60.26 Favored 'General case' 0 N--CA 1.479 1.017 0 C-N-CA 123.414 0.686 . . . . 36.86 112.408 -175.457 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 51' ' ' PHE . . . . . . . . . . . . . 80.1 t80 -94.31 -40.19 10.1 Favored 'General case' 0 N--CA 1.481 1.09 0 CA-C-O 120.665 0.269 . . . . 72.23 111.607 -173.72 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -98.51 1.78 46.96 Favored 'General case' 0 N--CA 1.489 1.478 0 N-CA-C 114.038 1.125 . . . . 52.42 114.038 -168.868 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 30.5 t70 -125.8 -46.36 1.71 Allowed 'General case' 0 N--CA 1.485 1.294 0 CA-C-N 117.968 0.349 . . . . 73.34 110.776 177.088 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 24.2 t70 -165.64 110.65 0.87 Allowed 'General case' 0 N--CA 1.492 1.628 0 C-N-CA 122.924 0.49 . . . . 73.25 111.87 179.686 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 9.5 tp-100 -112.37 13.45 20.29 Favored 'General case' 0 N--CA 1.493 1.678 0 C-N-CA 123.705 0.802 . . . . 62.51 111.318 176.586 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 62.7 p -63.24 -51.61 65.53 Favored 'General case' 0 N--CA 1.496 1.853 0 O-C-N 121.711 -0.618 . . . . 73.44 110.902 179.179 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 76.8 m-85 -92.97 137.06 23.99 Favored Pre-proline 0 CA--C 1.548 0.878 0 CA-C-N 115.714 -0.675 . . . . 74.11 109.504 171.157 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 69.8 Cg_endo -71.41 136.69 29.27 Favored 'Trans proline' 0 CA--C 1.564 2.022 0 C-N-CA 122.291 1.994 . . . . 73.14 112.169 -178.876 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 5.4 Cg_exo -74.58 -154.83 0.04 OUTLIER 'Trans proline' 0 C--N 1.375 1.942 0 C-N-CA 123.403 2.736 . . . . 74.43 112.712 179.29 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 3.3 mp0 -70.16 -10.62 59.38 Favored 'General case' 0 CA--C 1.564 1.497 0 C-N-CA 123.19 0.596 . . . . 64.1 111.484 174.106 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 36.0 m . . . . . 0 CA--C 1.569 1.681 0 C-N-CA 125.637 1.575 . . . . 64.32 113.441 -179.062 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 1' ' ' PHE . . . . . . . . . . . . . 16.7 p90 . . . . . 0 N--CA 1.493 1.713 0 N-CA-C 112.918 0.711 . . . . 73.41 112.918 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 2' ' ' THR . . . . . 0.643 HG21 ' H ' ' A' ' 4' ' ' ILE . 19.7 m -86.3 134.02 33.77 Favored 'General case' 0 N--CA 1.484 1.275 0 C-N-CA 122.933 0.493 . . . . 73.33 111.455 -176.775 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . 0.406 ' O ' ' HG ' ' A' ' 7' ' ' LEU . 2.5 pt? -57.41 -27.87 62.76 Favored 'General case' 0 N--CA 1.484 1.225 0 C-N-CA 123.603 0.761 . . . . 70.4 112.449 175.218 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . 0.643 ' H ' HG21 ' A' ' 2' ' ' THR . 51.8 mm -84.42 -44.94 17.97 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.109 0 C-N-CA 123.37 0.668 . . . . 75.43 110.996 -176.708 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . 0.424 ' O ' HG23 ' A' ' 9' ' ' VAL . 22.4 mm-40 -58.69 -39.66 81.38 Favored 'General case' 0 N--CA 1.481 1.093 0 O-C-N 123.432 0.457 . . . . 72.2 111.357 176.126 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 2.4 pp -69.34 -31.61 70.16 Favored 'General case' 0 N--CA 1.484 1.226 0 C-N-CA 122.351 0.26 . . . . 73.54 111.33 178.923 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . 0.406 ' HG ' ' O ' ' A' ' 3' ' ' LEU . 90.5 mt -64.15 -37.34 87.12 Favored 'General case' 0 N--CA 1.484 1.241 0 C-N-CA 122.464 0.305 . . . . 64.21 111.579 172.035 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 84.0 mt -68.7 -43.48 83.04 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.078 0 C-N-CA 123.252 0.621 . . . . 73.45 111.645 175.446 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . 0.424 HG23 ' O ' ' A' ' 5' ' ' GLU . 95.9 t -59.53 -48.34 87.64 Favored 'Isoleucine or valine' 0 CA--C 1.556 1.196 0 C-N-CA 123.657 0.783 . . . . 74.02 111.928 175.323 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 5.5 p -69.77 -25.13 27.71 Favored 'Isoleucine or valine' 0 CA--C 1.557 1.215 0 C-N-CA 122.77 0.428 . . . . 75.03 111.374 179.281 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -68.66 -55.61 10.88 Favored 'General case' 0 C--N 1.36 1.038 0 C-N-CA 122.766 0.426 . . . . 63.2 111.366 175.196 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' ILE . . . . . 0.558 ' HA ' HD11 ' A' ' 15' ' ' ILE . 23.1 pt -65.15 -45.46 93.97 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.966 0 C-N-CA 123.3 0.64 . . . . 72.22 111.819 -177.703 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 72.5 mt -68.15 -28.84 42.43 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.918 0 C-N-CA 123.562 0.745 . . . . 51.04 110.479 174.712 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -61.71 -38.75 96.42 Favored Glycine 0 C--N 1.346 1.109 0 CA-C-N 116.046 -0.525 . . . . 62.55 112.822 173.057 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . 0.558 HD11 ' HA ' ' A' ' 12' ' ' ILE . 14.4 mt -70.71 -44.32 76.55 Favored 'Isoleucine or valine' 0 C--N 1.352 0.682 0 C-N-CA 123.064 0.545 . . . . 75.05 109.929 175.387 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . 0.479 ' HG ' ' O ' ' A' ' 12' ' ' ILE . 22.0 mt -58.57 -40.42 83.05 Favored 'General case' 0 N--CA 1.482 1.165 0 O-C-N 123.791 0.682 . . . . 65.32 111.501 179.669 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -72.01 -51.92 19.5 Favored 'General case' 0 N--CA 1.476 0.843 0 C-N-CA 123.053 0.541 . . . . 71.21 110.754 179.171 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -55.09 -30.79 60.43 Favored 'General case' 0 N--CA 1.482 1.152 0 C-N-CA 123.981 0.913 . . . . 72.23 112.879 -179.132 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 2.7 pp -88.26 -34.51 7.19 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.256 0 N-CA-C 112.551 0.575 . . . . 71.13 112.551 174.529 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -65.79 -52.32 51.78 Favored 'General case' 0 N--CA 1.484 1.251 0 C-N-CA 123.074 0.55 . . . . 41.44 112.264 -173.268 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 2.1 mp -54.61 -54.12 52.52 Favored Pre-proline 0 CA--C 1.574 1.894 0 N-CA-C 112.851 0.686 . . . . 63.12 112.851 -174.733 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 36.7 Cg_endo -65.13 -42.25 14.35 Favored 'Trans proline' 0 C--N 1.38 2.221 0 CA-C-N 121.065 1.416 . . . . 74.24 113.115 175.113 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 28.8 tt0 -62.76 -34.41 77.16 Favored 'General case' 0 N--CA 1.486 1.357 0 C-N-CA 123.358 0.663 . . . . 74.14 111.001 -177.859 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 24' ' ' PHE . . . . . . . . . . . . . 84.3 t80 -84.42 -42.06 16.04 Favored 'General case' 0 N--CA 1.484 1.229 0 C-N-CA 123.912 0.885 . . . . 71.24 110.49 -174.137 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 26.4 t -67.16 -28.34 68.04 Favored 'General case' 0 N--CA 1.479 1.004 0 CA-C-N 116.402 -0.363 . . . . 71.35 110.582 175.253 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -79.94 -29.81 39.79 Favored 'General case' 0 C--O 1.214 -0.808 0 C-N-CA 123.109 0.564 . . . . 55.54 111.717 172.737 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 78.7 t80 -71.97 -45.8 59.72 Favored 'General case' 0 N--CA 1.487 1.408 0 C-N-CA 123.89 0.876 . . . . 72.34 111.722 -175.539 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 39.3 ptt180 -68.23 -29.32 68.12 Favored 'General case' 0 N--CA 1.477 0.92 0 CA-C-N 115.181 -0.918 . . . . 52.22 111.309 179.74 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 79.3 t -83.3 -34.89 11.38 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.375 0 CA-C-N 115.699 -0.682 . . . . 73.11 110.136 178.896 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 10.8 tttp -61.25 -42.87 99.37 Favored 'General case' 0 C--O 1.214 -0.769 0 C-N-CA 124.061 0.944 . . . . 54.22 109.783 168.69 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -71.04 -42.46 69.46 Favored 'General case' 0 N--CA 1.476 0.842 0 N-CA-C 109.935 -0.395 . . . . 74.35 109.935 -176.686 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 74.9 t80 -62.53 -62.48 1.71 Allowed 'General case' 0 C--O 1.215 -0.715 0 CA-C-N 115.57 -0.741 . . . . 74.14 110.977 178.828 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 85.4 m-20 -66.95 -44.46 80.51 Favored 'General case' 0 N--CA 1.485 1.275 0 N-CA-C 113.664 0.987 . . . . 73.24 113.664 -174.535 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 47.0 t -68.01 -52.85 30.9 Favored 'General case' 0 N--CA 1.497 1.918 0 CA-C-N 117.636 0.198 . . . . 75.33 111.09 -176.321 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -62.8 -41.36 99.25 Favored 'General case' 0 C--O 1.212 -0.882 0 O-C-N 123.446 0.466 . . . . 41.0 111.27 177.765 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -59.82 -50.44 73.78 Favored 'General case' 0 N--CA 1.498 1.937 0 N-CA-C 112.24 0.459 . . . . 72.12 112.24 178.379 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 66.8 m -63.81 -37.55 87.8 Favored 'General case' 0 N--CA 1.486 1.356 0 C-N-CA 123.331 0.652 . . . . 73.12 111.891 -179.277 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 79.9 p -80.97 -25.52 37.26 Favored 'General case' 0 N--CA 1.482 1.135 0 C-N-CA 122.844 0.458 . . . . 72.14 111.997 -178.626 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 39' ' ' ASP . . . . . 0.427 ' O ' ' HG ' ' A' ' 43' ' ' LEU . 94.6 m-20 -65.69 -52.65 49.75 Favored 'General case' 0 C--O 1.211 -0.958 0 N-CA-C 109.336 -0.616 . . . . 72.34 109.336 167.254 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 98.5 mt -64.37 -29.83 70.89 Favored 'General case' 0 N--CA 1.481 1.11 0 C-N-CA 123.483 0.713 . . . . 75.32 111.63 -176.516 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 47.4 ttp180 -75.29 -43.21 52.34 Favored 'General case' 0 CA--C 1.546 0.809 0 C-N-CA 123.536 0.734 . . . . 73.4 110.663 175.213 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 62.4 t30 -69.68 -34.49 74.03 Favored 'General case' 0 N--CA 1.488 1.471 0 C-N-CA 123.467 0.707 . . . . 54.53 112.221 -179.78 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . 0.427 ' HG ' ' O ' ' A' ' 39' ' ' ASP . 89.8 mt -77.21 -32.01 55.61 Favored 'General case' 0 N--CA 1.478 0.949 0 C-N-CA 123.007 0.523 . . . . 75.22 110.12 179.37 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . 0.413 ' O ' ' HG2' ' A' ' 48' ' ' GLU . 38.8 ttpt -77.55 -36.87 51.82 Favored 'General case' 0 N--CA 1.477 0.885 0 C-N-CA 122.913 0.485 . . . . 53.2 110.602 179.091 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 1.7 t -70.57 -30.93 67.77 Favored 'General case' 0 N--CA 1.485 1.298 0 CA-C-O 121.369 0.604 . . . . 74.31 110.753 179.438 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -66.42 -43.86 84.55 Favored 'General case' 0 N--CA 1.479 1.003 0 CA-C-N 114.86 -1.064 . . . . 64.54 111.101 168.915 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 36.5 tp -63.71 -34.52 78.07 Favored 'General case' 0 CA--C 1.554 1.13 0 C-N-CA 123.648 0.779 . . . . 72.13 111.308 177.132 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . 0.413 ' HG2' ' O ' ' A' ' 44' ' ' LYS . 80.9 mm-40 -67.32 -47.84 69.34 Favored 'General case' 0 N--CA 1.474 0.762 0 C-N-CA 123.582 0.753 . . . . 71.05 110.115 173.356 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 40.5 t -57.63 -44.13 85.33 Favored 'General case' 0 N--CA 1.483 1.215 0 C-N-CA 123.681 0.792 . . . . 60.45 112.852 -176.435 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -72.41 -52.28 16.66 Favored 'General case' 0 N--CA 1.481 1.091 0 C-N-CA 123.407 0.683 . . . . 50.03 112.66 178.863 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 51' ' ' PHE . . . . . . . . . . . . . 41.5 t80 -71.91 -33.63 68.44 Favored 'General case' 0 N--CA 1.486 1.357 0 CA-C-N 115.635 -0.712 . . . . 71.33 111.45 -170.344 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -79.92 -30.13 39.95 Favored 'General case' 0 N--CA 1.482 1.134 0 C-N-CA 123.293 0.637 . . . . 63.33 111.936 178.939 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 19.6 t70 -55.1 -46.23 75.51 Favored 'General case' 0 N--CA 1.488 1.47 0 C-N-CA 123.339 0.655 . . . . 75.1 111.658 177.647 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 23.9 t70 -66.21 -51.05 61.45 Favored 'General case' 0 CA--C 1.554 1.126 0 CA-C-O 121.033 0.444 . . . . 64.05 110.87 178.482 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 29.8 pt20 -89.59 20.22 4.12 Favored 'General case' 0 N--CA 1.488 1.45 0 N-CA-C 113.085 0.772 . . . . 72.1 113.085 -174.571 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 95.1 m -48.1 -42.37 28.81 Favored 'General case' 0 N--CA 1.497 1.916 0 C-N-CA 123.943 0.897 . . . . 75.54 111.721 177.433 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 36.6 p90 -116.32 129.46 25.22 Favored Pre-proline 0 CA--C 1.558 1.264 0 C-N-CA 123.932 0.893 . . . . 73.32 110.036 173.504 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 69.3 Cg_exo -58.02 153.65 43.76 Favored 'Trans proline' 0 CA--C 1.564 2.017 0 C-N-CA 122.796 2.33 . . . . 51.11 112.983 167.043 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 50.8 Cg_exo -57.19 85.94 0.04 OUTLIER 'Trans proline' 0 C--N 1.382 2.324 0 C-N-CA 123.177 2.585 . . . . 74.53 113.938 175.881 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 25.0 tt0 44.68 69.19 0.45 Allowed 'General case' 0 CA--C 1.559 1.291 0 C-N-CA 126.082 1.753 . . . . 75.12 113.197 -178.692 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 66.6 m . . . . . 0 N--CA 1.489 1.492 0 C-N-CA 124.009 0.924 . . . . 71.34 110.048 -178.172 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 1' ' ' PHE . . . . . . . . . . . . . 59.0 m-85 . . . . . 0 N--CA 1.487 1.407 0 N-CA-C 109.929 -0.397 . . . . 74.22 109.929 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 4.7 t -74.17 154.67 38.98 Favored 'General case' 0 N--CA 1.481 1.078 0 CA-C-N 117.702 0.228 . . . . 70.52 110.605 170.082 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 9.3 mp -59.95 -18.97 49.4 Favored 'General case' 0 N--CA 1.481 1.1 0 C-N-CA 123.272 0.629 . . . . 73.22 111.01 176.244 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 50.3 mm -64.07 -49.79 79.91 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.102 0 C-N-CA 123.505 0.722 . . . . 73.54 110.822 174.962 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 40.8 mm-40 -57.95 -47.71 82.1 Favored 'General case' 0 N--CA 1.49 1.544 0 C-N-CA 123.376 0.67 . . . . 45.51 111.512 -179.753 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 46.9 mt -68.88 -32.7 72.55 Favored 'General case' 0 CA--C 1.547 0.853 0 CA-C-N 115.576 -0.738 . . . . 71.12 111.382 -178.108 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 42.3 tp -66.77 -37.15 84.02 Favored 'General case' 0 CA--C 1.549 0.906 0 C-N-CA 123.976 0.911 . . . . 73.2 111.659 173.855 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 96.2 mt -68.95 -50.11 56.97 Favored 'Isoleucine or valine' 0 C--N 1.35 0.606 0 C-N-CA 123.636 0.775 . . . . 71.44 111.245 176.946 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 88.3 t -60.07 -43.03 91.85 Favored 'Isoleucine or valine' 0 CA--C 1.554 1.107 0 C-N-CA 123.119 0.568 . . . . 71.21 111.482 179.345 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 2.7 p -69.24 -31.45 49.87 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.093 0 O-C-N 122.328 -0.233 . . . . 73.32 111.595 177.482 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -68.24 -57.52 5.85 Favored 'General case' 0 C--N 1.363 1.162 0 C-N-CA 123.141 0.576 . . . . 53.32 111.193 179.308 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' ILE . . . . . 0.496 ' O ' ' HG ' ' A' ' 16' ' ' LEU . 21.9 pt -60.33 -46.99 94.18 Favored 'Isoleucine or valine' 0 CA--C 1.554 1.101 0 C-N-CA 123.776 0.83 . . . . 73.12 112.055 -177.943 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 1.7 mp -62.03 -35.48 68.72 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.558 0 C-N-CA 123.721 0.808 . . . . 75.43 110.345 174.887 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -62.07 -39.64 97.88 Favored Glycine 0 C--N 1.352 1.418 0 CA-C-N 115.554 -0.748 . . . . 71.31 113.067 176.241 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . 0.47 HD11 ' HA ' ' A' ' 12' ' ' ILE . 21.7 mt -69.59 -40.49 79.59 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.917 0 C-N-CA 123.507 0.723 . . . . 62.34 111.088 176.686 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . 0.496 ' HG ' ' O ' ' A' ' 12' ' ' ILE . 21.8 mt -57.75 -40.06 78.84 Favored 'General case' 0 N--CA 1.489 1.491 0 C-N-CA 123.207 0.603 . . . . 74.14 111.192 178.647 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -76.84 -49.18 16.38 Favored 'General case' 0 N--CA 1.48 1.026 0 C-N-CA 123.391 0.676 . . . . 65.01 111.478 179.067 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -59.43 -26.18 64.96 Favored 'General case' 0 N--CA 1.483 1.2 0 C-N-CA 124.182 0.993 . . . . 71.14 113.263 -176.485 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 2.8 pp -87.22 -38.51 12.2 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.382 0 CA-C-N 117.915 0.325 . . . . 74.11 111.741 170.556 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -65.19 -56.85 10.47 Favored 'General case' 0 N--CA 1.478 0.934 0 C-N-CA 123.568 0.747 . . . . 72.2 112.807 -170.276 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 2.6 mp -58.9 -50.99 85.0 Favored Pre-proline 0 CA--C 1.571 1.777 0 N-CA-C 113.228 0.825 . . . . 71.15 113.228 -173.503 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 37.7 Cg_endo -65.99 -36.51 30.04 Favored 'Trans proline' 0 C--N 1.382 2.338 0 C-N-CA 121.72 1.613 . . . . 63.05 113.354 176.395 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 22.0 tt0 -65.31 -36.88 85.42 Favored 'General case' 0 N--CA 1.489 1.504 0 CA-C-O 121.489 0.661 . . . . 74.02 109.788 178.851 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 24' ' ' PHE . . . . . . . . . . . . . 64.3 t80 -76.04 -39.92 54.56 Favored 'General case' 0 N--CA 1.484 1.261 0 CA-C-N 113.994 -1.457 . . . . 74.32 110.689 -177.951 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 44.4 t -58.3 -52.25 66.38 Favored 'General case' 0 N--CA 1.478 0.947 0 C-N-CA 123.769 0.828 . . . . 75.05 110.582 173.9 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -64.11 -28.56 69.85 Favored 'General case' 0 N--CA 1.484 1.232 0 C-N-CA 123.683 0.793 . . . . 72.23 112.269 176.636 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 47.8 t80 -75.69 -46.01 33.67 Favored 'General case' 0 N--CA 1.484 1.271 0 C-N-CA 123.085 0.554 . . . . 74.13 111.442 -176.503 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 14.3 ptm180 -73.78 -23.69 59.74 Favored 'General case' 0 N--CA 1.474 0.749 0 CA-C-N 115.42 -0.809 . . . . 62.3 111.082 -179.499 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 28.3 t -69.32 -58.79 4.64 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.781 0 N-CA-C 109.389 -0.597 . . . . 54.54 109.389 171.328 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . 0.421 ' O ' ' HB3' ' A' ' 34' ' ' SER . 21.1 ptmt -65.98 -17.24 64.55 Favored 'General case' 0 N--CA 1.486 1.366 0 N-CA-C 112.253 0.464 . . . . 63.52 112.253 -179.223 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -72.95 -46.17 53.96 Favored 'General case' 0 N--CA 1.479 0.99 0 CA-C-O 121.334 0.588 . . . . 73.22 109.696 172.633 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 12.5 t80 -89.36 -9.99 48.31 Favored 'General case' 0 N--CA 1.488 1.447 0 CA-C-N 115.244 -0.889 . . . . 75.02 112.195 -173.59 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 29.6 m-80 -101.5 -58.8 1.81 Allowed 'General case' 0 N--CA 1.47 0.574 0 CA-C-N 115.552 -0.749 . . . . 71.35 110.479 172.93 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 34' ' ' SER . . . . . 0.421 ' HB3' ' O ' ' A' ' 30' ' ' LYS . 47.2 t -83.54 -52.03 6.82 Favored 'General case' 0 N--CA 1.496 1.849 0 CA-C-N 116.745 -0.207 . . . . 71.24 111.552 -168.405 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -69.15 -32.28 71.53 Favored 'General case' 0 N--CA 1.486 1.348 0 C-N-CA 122.165 0.186 . . . . 60.31 111.148 179.546 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -72.12 -38.52 69.26 Favored 'General case' 0 N--CA 1.478 0.97 0 C-N-CA 122.745 0.418 . . . . 62.2 111.25 176.028 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 36.4 t -66.11 -32.39 73.82 Favored 'General case' 0 N--CA 1.494 1.773 0 C-N-CA 122.526 0.331 . . . . 53.24 111.443 174.355 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 38' ' ' SER . . . . . 0.499 ' HA ' ' HB3' ' A' ' 41' ' ' ARG . 52.7 m -80.37 -23.52 40.44 Favored 'General case' 0 N--CA 1.48 1.062 0 C-N-CA 123.489 0.716 . . . . 74.2 111.323 177.798 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 39' ' ' ASP . . . . . 0.427 ' O ' ' HG ' ' A' ' 43' ' ' LEU . 24.0 t70 -68.79 -46.94 67.39 Favored 'General case' 0 CA--C 1.553 1.072 0 C-N-CA 122.985 0.514 . . . . 74.45 110.597 168.718 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 11.1 mp -69.68 -27.76 65.29 Favored 'General case' 0 N--CA 1.482 1.152 0 C-N-CA 123.378 0.671 . . . . 71.43 111.481 176.634 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 41' ' ' ARG . . . . . 0.499 ' HB3' ' HA ' ' A' ' 38' ' ' SER . 51.5 ttt180 -69.78 -41.02 75.68 Favored 'General case' 0 N--CA 1.478 0.975 0 C-N-CA 123.701 0.8 . . . . 75.35 110.033 171.738 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 52.9 t30 -60.15 -36.04 76.67 Favored 'General case' 0 CA--C 1.554 1.108 0 C-N-CA 123.793 0.837 . . . . 65.24 111.2 175.33 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . 0.427 ' HG ' ' O ' ' A' ' 39' ' ' ASP . 77.4 mt -79.76 -35.76 38.25 Favored 'General case' 0 N--CA 1.478 0.974 0 C-N-CA 123.272 0.629 . . . . 64.21 111.38 178.171 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 22.5 tptm -70.24 -45.31 66.73 Favored 'General case' 0 N--CA 1.481 1.087 0 N-CA-C 109.912 -0.403 . . . . 73.22 109.912 -177.343 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 45' ' ' THR . . . . . 0.485 ' HA ' ' HG2' ' A' ' 48' ' ' GLU . 3.2 t -67.44 -33.63 75.55 Favored 'General case' 0 N--CA 1.473 0.71 0 CA-C-N 114.864 -1.062 . . . . 72.03 111.158 179.622 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -63.39 -52.24 62.48 Favored 'General case' 0 N--CA 1.477 0.882 0 C-N-CA 123.461 0.705 . . . . 73.4 111.356 176.388 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 10.8 mp -67.08 -46.33 74.59 Favored 'General case' 0 N--CA 1.478 0.964 0 C-N-CA 123.01 0.524 . . . . 73.03 112.156 -179.887 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . 0.485 ' HG2' ' HA ' ' A' ' 45' ' ' THR . 11.1 pt-20 -67.51 -33.55 75.32 Favored 'General case' 0 N--CA 1.487 1.398 0 CA-C-N 117.935 0.334 . . . . 72.23 111.22 -176.407 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 48.2 t -74.86 -32.97 62.03 Favored 'General case' 0 N--CA 1.478 0.961 0 C-N-CA 123.242 0.617 . . . . 73.44 111.031 175.951 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -70.63 -44.36 67.33 Favored 'General case' 0 N--CA 1.489 1.512 0 CA-C-O 121.207 0.527 . . . . 72.23 110.722 -178.674 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 51' ' ' PHE . . . . . . . . . . . . . 58.1 m-85 -74.96 -20.98 59.44 Favored 'General case' 0 CA--C 1.549 0.93 0 CA-C-N 115.238 -0.892 . . . . 73.41 111.614 175.703 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -71.01 -40.54 71.74 Favored 'General case' 0 N--CA 1.484 1.27 0 C-N-CA 122.688 0.395 . . . . 64.13 110.497 171.141 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 82.9 m-20 -66.34 -49.82 65.67 Favored 'General case' 0 CA--C 1.547 0.848 0 C-N-CA 123.508 0.723 . . . . 73.41 111.252 175.768 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 38.8 t70 -140.24 146.15 38.26 Favored 'General case' 0 N--CA 1.48 1.057 0 CA-C-O 121.371 0.605 . . . . 61.44 112.47 -171.808 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 20.0 mm-40 -131.94 24.39 4.62 Favored 'General case' 0 N--CA 1.483 1.183 0 C-N-CA 124.521 1.128 . . . . 73.05 111.419 -179.404 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 67.3 p -101.0 75.0 1.64 Allowed 'General case' 0 N--CA 1.495 1.776 0 CA-C-O 122.039 0.924 . . . . 75.43 110.787 178.343 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 94.8 m-85 -129.9 84.4 60.9 Favored Pre-proline 0 N--CA 1.488 1.433 0 C-N-CA 124.056 0.942 . . . . 73.14 109.829 -179.392 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 86.7 Cg_endo -75.3 133.99 16.79 Favored 'Trans proline' 0 C--N 1.38 2.191 0 C-N-CA 122.664 2.243 . . . . 65.42 113.243 -174.617 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 74.8 Cg_endo -75.19 88.94 1.21 Allowed 'Trans proline' 0 C--N 1.382 2.322 0 C-N-CA 122.819 2.346 . . . . 70.24 111.873 177.021 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 33.2 mt-10 -73.58 -45.73 51.53 Favored 'General case' 0 N--CA 1.487 1.419 0 C-N-CA 123.665 0.786 . . . . 75.02 112.7 -172.225 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 58.2 m . . . . . 0 N--CA 1.492 1.648 0 C-N-CA 123.342 0.657 . . . . 63.3 110.56 179.168 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 1' ' ' PHE . . . . . . . . . . . . . 93.4 m-85 . . . . . 0 N--CA 1.486 1.343 0 N-CA-C 110.477 -0.194 . . . . 73.34 110.477 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 57.5 p -73.88 170.79 14.63 Favored 'General case' 0 N--CA 1.487 1.377 0 C-N-CA 123.055 0.542 . . . . 51.24 111.206 173.413 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 9.3 tt -61.07 -23.45 65.48 Favored 'General case' 0 N--CA 1.486 1.369 0 C-N-CA 123.347 0.659 . . . . 73.13 110.32 171.603 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 51.4 mm -83.0 -43.42 18.47 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.692 0 CA-C-N 115.586 -0.734 . . . . 72.31 110.001 -178.542 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 70.7 mm-40 -56.76 -42.83 80.03 Favored 'General case' 0 N--CA 1.483 1.203 0 C-N-CA 123.55 0.74 . . . . 65.12 111.658 173.943 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 2.4 pp -71.19 -37.91 72.13 Favored 'General case' 0 N--CA 1.476 0.869 0 O-C-N 123.31 0.382 . . . . 74.31 110.924 178.651 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -61.48 -46.66 89.1 Favored 'General case' 0 CA--C 1.551 1.011 0 C-N-CA 122.941 0.496 . . . . 74.54 110.765 177.978 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 95.2 mt -67.65 -49.88 66.08 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.721 0 C-N-CA 123.857 0.863 . . . . 70.43 112.341 -177.938 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 7.2 p -60.38 -41.13 86.21 Favored 'Isoleucine or valine' 0 CA--C 1.555 1.137 0 CA-C-N 118.194 0.452 . . . . 52.1 111.852 -177.05 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 74.1 t -68.81 -39.83 80.57 Favored 'Isoleucine or valine' 0 CA--C 1.555 1.16 0 C-N-CA 122.909 0.484 . . . . 72.33 111.307 174.858 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -64.27 -51.57 62.91 Favored 'General case' 0 N--CA 1.487 1.379 0 C-N-CA 122.835 0.454 . . . . 64.23 111.855 -178.733 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 12' ' ' ILE . . . . . 0.536 ' O ' ' HG ' ' A' ' 16' ' ' LEU . 22.9 pt -62.28 -48.14 89.76 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.776 0 C-N-CA 123.533 0.733 . . . . 74.42 111.471 -176.464 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 86.2 mt -63.69 -31.72 54.13 Favored 'Isoleucine or valine' 0 C--N 1.361 1.097 0 C-N-CA 123.306 0.642 . . . . 63.12 110.925 177.99 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -60.92 -40.66 98.68 Favored Glycine 0 C--N 1.35 1.341 0 CA-C-N 115.562 -0.745 . . . . 74.04 112.961 174.134 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . 0.535 HD12 ' HA ' ' A' ' 12' ' ' ILE . 14.5 mt -71.35 -43.78 73.09 Favored 'Isoleucine or valine' 0 C--N 1.355 0.811 0 C-N-CA 123.282 0.633 . . . . 73.11 110.465 177.061 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . 0.536 ' HG ' ' O ' ' A' ' 12' ' ' ILE . 34.5 mt -58.23 -39.62 79.59 Favored 'General case' 0 N--CA 1.486 1.356 0 C-N-CA 123.54 0.736 . . . . 73.22 111.283 -177.578 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -73.49 -48.68 31.49 Favored 'General case' 0 N--CA 1.478 0.97 0 C-N-CA 123.016 0.526 . . . . 74.52 110.913 177.559 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -63.96 -23.9 67.52 Favored 'General case' 0 N--CA 1.482 1.149 0 N-CA-C 113.53 0.937 . . . . 62.14 113.53 -176.756 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 2.8 pp -89.76 -38.26 10.86 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.28 0 CA-C-N 118.213 0.461 . . . . 70.31 111.359 172.362 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -63.6 -47.63 80.67 Favored 'General case' 0 N--CA 1.486 1.373 0 C-N-CA 123.429 0.692 . . . . 65.22 112.789 -175.177 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 27.5 mt -57.43 -54.62 53.03 Favored Pre-proline 0 CA--C 1.563 1.462 0 CA-C-O 118.097 -0.954 . . . . 74.44 113.281 -176.692 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 39.4 Cg_endo -66.13 -37.42 25.41 Favored 'Trans proline' 0 C--N 1.378 2.09 0 CA-C-N 121.504 1.573 . . . . 64.42 113.093 174.149 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 23.8 tt0 -63.34 -37.1 85.95 Favored 'General case' 0 N--CA 1.49 1.573 0 C-N-CA 123.519 0.728 . . . . 71.52 110.802 -177.671 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 24' ' ' PHE . . . . . . . . . . . . . 70.1 t80 -93.8 -36.46 12.25 Favored 'General case' 0 N--CA 1.487 1.407 0 CA-C-N 114.685 -1.143 . . . . 71.54 111.315 -173.055 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 25' ' ' SER . . . . . 0.487 ' O ' HG22 ' A' ' 29' ' ' VAL . 39.5 t -59.55 -53.26 60.1 Favored 'General case' 0 N--CA 1.486 1.334 0 N-CA-C 110.05 -0.352 . . . . 72.03 110.05 170.983 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -65.13 -28.15 69.23 Favored 'General case' 0 N--CA 1.488 1.474 0 C-N-CA 123.668 0.787 . . . . 63.12 112.518 176.866 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 84.6 t80 -63.25 -51.07 67.68 Favored 'General case' 0 N--CA 1.487 1.38 0 CA-C-O 120.835 0.35 . . . . 75.41 110.209 172.697 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 57.0 mtp180 -65.82 -24.63 66.95 Favored 'General case' 0 N--CA 1.47 0.571 0 CA-C-N 115.465 -0.789 . . . . 74.23 111.721 179.475 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . 0.487 HG22 ' O ' ' A' ' 25' ' ' SER . 79.6 t -68.98 -56.29 12.52 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.09 0 N-CA-C 109.871 -0.418 . . . . 74.45 109.871 174.341 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 48.4 pttt -67.6 -24.68 65.51 Favored 'General case' 0 CA--C 1.546 0.814 0 CA-C-N 115.491 -0.777 . . . . 73.44 111.545 -176.85 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -81.65 -37.64 27.17 Favored 'General case' 0 N--CA 1.485 1.305 0 CA-C-O 121.313 0.578 . . . . 71.41 110.002 -178.522 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 21.4 t80 -76.94 -16.03 59.49 Favored 'General case' 0 N--CA 1.483 1.178 0 CA-C-N 115.048 -0.978 . . . . 74.4 111.079 -179.85 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 85.6 m-20 -94.89 -50.76 4.98 Favored 'General case' 0 N--CA 1.478 0.95 0 C-N-CA 123.798 0.839 . . . . 71.42 111.857 173.957 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 46.9 t -70.54 -52.8 19.23 Favored 'General case' 0 N--CA 1.501 2.085 0 N-CA-C 111.864 0.32 . . . . 70.33 111.864 -172.16 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -66.44 -29.78 70.0 Favored 'General case' 0 N--CA 1.479 0.99 0 C-N-CA 122.998 0.519 . . . . 54.44 111.706 179.089 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -65.99 -59.02 4.23 Favored 'General case' 0 N--CA 1.482 1.161 0 C-N-CA 122.848 0.459 . . . . 61.35 111.136 174.144 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 66.2 m -53.65 -40.55 65.96 Favored 'General case' 0 N--CA 1.482 1.143 0 C-N-CA 123.846 0.858 . . . . 74.12 111.984 179.174 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 47.7 t -76.0 -38.31 57.5 Favored 'General case' 0 N--CA 1.48 1.072 0 C-N-CA 123.105 0.562 . . . . 74.32 112.446 -176.945 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 38.5 t70 -63.72 -47.02 82.77 Favored 'General case' 0 N--CA 1.483 1.183 0 CA-C-O 121.266 0.555 . . . . 72.44 111.435 176.981 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 70.0 mt -78.66 -32.63 47.26 Favored 'General case' 0 N--CA 1.476 0.849 0 CA-C-N 115.113 -0.948 . . . . 73.33 110.78 -172.658 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 17.3 ttp180 -71.68 -35.28 70.25 Favored 'General case' 0 N--CA 1.479 1.002 0 C-N-CA 122.602 0.361 . . . . 71.13 110.244 174.643 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 28.6 t-20 -61.23 -39.76 91.49 Favored 'General case' 0 N--CA 1.485 1.316 0 C-N-CA 123.232 0.613 . . . . 71.11 111.258 171.903 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 87.2 mt -69.58 -34.12 73.69 Favored 'General case' 0 N--CA 1.48 1.026 0 C-N-CA 122.757 0.423 . . . . 52.0 111.072 177.849 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 55.8 tptt -80.58 -35.41 34.27 Favored 'General case' 0 CA--C 1.548 0.866 0 C-N-CA 123.574 0.749 . . . . 74.43 111.214 -176.636 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 3.2 t -74.35 -38.57 63.2 Favored 'General case' 0 N--CA 1.482 1.129 0 CA-C-O 121.226 0.536 . . . . 64.21 110.389 -178.022 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -71.69 -35.66 70.33 Favored 'General case' 0 N--CA 1.478 0.961 0 CA-C-N 115.193 -0.912 . . . . 61.42 111.21 174.012 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 69.8 tp -57.77 -62.65 1.65 Allowed 'General case' 0 C--N 1.359 1.021 0 O-C-N 123.89 0.744 . . . . 73.52 110.705 175.118 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 33.4 mm-40 -59.89 -32.92 71.18 Favored 'General case' 0 N--CA 1.489 1.502 0 C-N-CA 123.661 0.784 . . . . 71.34 112.583 -173.435 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 25.3 t -61.63 -52.23 65.22 Favored 'General case' 0 CA--C 1.551 1.004 0 CA-C-N 115.439 -0.8 . . . . 70.14 111.18 178.267 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -78.38 -34.1 48.42 Favored 'General case' 0 N--CA 1.486 1.36 0 C-N-CA 123.43 0.692 . . . . 72.21 112.33 -179.018 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 51' ' ' PHE . . . . . . . . . . . . . 75.1 t80 -65.09 -32.94 74.9 Favored 'General case' 0 N--CA 1.488 1.456 0 C-N-CA 125.25 1.42 . . . . 72.44 110.572 -176.146 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -79.22 -35.44 41.62 Favored 'General case' 0 CA--C 1.545 0.767 0 CA-C-N 115.592 -0.731 . . . . 73.22 110.797 176.57 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 32.8 t70 -62.44 -50.94 69.48 Favored 'General case' 0 N--CA 1.481 1.076 0 C-N-CA 123.797 0.839 . . . . 65.31 112.788 -174.817 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 6.7 p-10 -64.82 -33.12 75.23 Favored 'General case' 0 N--CA 1.49 1.525 0 C-N-CA 122.599 0.36 . . . . 74.33 111.845 -177.518 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 76.2 mt-30 -69.19 -45.02 70.97 Favored 'General case' 0 N--CA 1.484 1.245 0 C-N-CA 123.573 0.749 . . . . 73.55 111.345 176.361 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 69.4 p -97.55 76.65 2.54 Favored 'General case' 0 N--CA 1.48 1.053 0 CA-C-O 122.326 1.06 . . . . 72.31 110.157 -179.108 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 47.2 p90 -100.14 153.99 37.46 Favored Pre-proline 0 N--CA 1.485 1.276 0 CA-C-N 114.94 -1.027 . . . . 75.52 111.546 -176.72 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 52.5 Cg_endo -67.03 145.19 72.81 Favored 'Trans proline' 0 C--N 1.379 2.157 0 C-N-CA 122.069 1.846 . . . . 63.44 111.419 171.326 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 24.5 Cg_endo -58.53 102.41 0.14 Allowed 'Trans proline' 0 C--N 1.379 2.178 0 C-N-CA 123.066 2.511 . . . . 62.12 112.98 -178.137 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -66.48 96.42 0.37 Allowed 'General case' 0 CA--C 1.552 1.044 0 C-N-CA 123.42 0.688 . . . . 64.22 110.148 -177.878 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 49.0 m . . . . . 0 CA--C 1.555 1.158 0 C-N-CA 124.028 0.931 . . . . 63.34 110.986 179.617 . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 1' ' ' PHE . . . . . . . . . . . . . 93.0 m-85 . . . . . 0 N--CA 1.48 1.064 0 N-CA-C 110.142 -0.318 . . . . 74.54 110.142 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 72.4 p -131.0 154.41 48.2 Favored 'General case' 0 N--CA 1.491 1.598 0 C-N-CA 123.781 0.832 . . . . 74.51 110.851 177.403 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 2.4 pt? -60.72 -21.33 62.83 Favored 'General case' 0 N--CA 1.489 1.494 0 C-N-CA 123.567 0.747 . . . . 75.3 111.348 171.179 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 49.2 mm -69.33 -47.57 72.56 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.087 0 C-N-CA 123.821 0.848 . . . . 73.31 110.316 176.353 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 22.9 mm-40 -59.94 -42.22 93.55 Favored 'General case' 0 N--CA 1.484 1.229 0 C-N-CA 123.441 0.696 . . . . 74.14 111.355 175.41 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 83.4 mt -63.75 -37.34 86.98 Favored 'General case' 0 N--CA 1.487 1.408 0 C-N-CA 123.19 0.596 . . . . 72.44 111.835 176.508 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 6.7 tt -64.51 -43.09 95.16 Favored 'General case' 0 CA--C 1.548 0.883 0 C-N-CA 124.026 0.931 . . . . 72.44 110.108 176.416 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 96.0 mt -67.95 -42.1 85.26 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.943 0 C-N-CA 123.546 0.738 . . . . 74.54 111.762 179.193 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 79.1 t -63.48 -45.72 97.1 Favored 'Isoleucine or valine' 0 CA--C 1.556 1.177 0 C-N-CA 123.325 0.65 . . . . 73.33 111.601 176.764 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 3.1 p -69.36 -26.48 31.58 Favored 'Isoleucine or valine' 0 CA--C 1.56 1.338 0 C-N-CA 122.368 0.267 . . . . 74.22 111.603 177.864 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -73.89 -55.35 6.29 Favored 'General case' 0 N--CA 1.48 1.046 0 C-N-CA 123.242 0.617 . . . . 73.23 111.272 178.673 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 12' ' ' ILE . . . . . 0.517 ' O ' ' HG ' ' A' ' 16' ' ' LEU . 16.3 pt -57.3 -53.28 45.81 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.039 0 C-N-CA 122.943 0.497 . . . . 72.3 111.435 -179.853 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 80.1 mt -66.6 -32.81 59.71 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.967 0 C-N-CA 123.777 0.831 . . . . 71.52 110.869 -179.56 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -60.81 -42.37 99.49 Favored Glycine 0 C--N 1.353 1.481 0 O-C-N 123.628 0.58 . . . . 74.44 113.651 176.796 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 1.8 mp -75.74 -34.93 29.57 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.255 0 C-N-CA 122.856 0.462 . . . . 72.44 110.408 177.249 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . 0.517 ' HG ' ' O ' ' A' ' 12' ' ' ILE . 19.3 mt -62.31 -39.06 91.79 Favored 'General case' 0 N--CA 1.489 1.523 0 C-N-CA 122.377 0.271 . . . . 73.55 111.089 176.409 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -74.28 -39.9 62.66 Favored 'General case' 0 N--CA 1.477 0.888 0 C-N-CA 123.529 0.732 . . . . 72.34 110.944 177.501 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -62.48 -24.06 67.25 Favored 'General case' 0 N--CA 1.483 1.176 0 C-N-CA 123.894 0.878 . . . . 74.3 112.947 178.835 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 2.8 pp -96.85 -37.63 7.25 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.208 0 N-CA-C 111.846 0.313 . . . . 72.54 111.846 171.723 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -67.62 -48.47 66.67 Favored 'General case' 0 N--CA 1.493 1.713 0 N-CA-C 112.891 0.701 . . . . 73.14 112.891 -173.011 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 27.9 mt -58.79 -52.56 73.85 Favored Pre-proline 0 CA--C 1.556 1.199 0 CA-C-O 118.059 -0.972 . . . . 74.21 113.18 -178.565 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 42.9 Cg_endo -67.09 -36.96 20.16 Favored 'Trans proline' 0 C--N 1.378 2.101 0 CA-C-N 121.77 1.668 . . . . 54.44 113.123 174.115 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 28.6 tt0 -66.64 -32.45 73.78 Favored 'General case' 0 N--CA 1.491 1.599 0 C-N-CA 122.854 0.462 . . . . 64.32 110.52 -177.627 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 24' ' ' PHE . . . . . . . . . . . . . 85.5 t80 -90.09 -40.06 12.51 Favored 'General case' 0 N--CA 1.487 1.396 0 CA-C-N 115.366 -0.833 . . . . 70.33 111.406 -178.5 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 34.8 t -56.91 -55.24 37.08 Favored 'General case' 0 N--CA 1.488 1.449 0 C-N-CA 122.849 0.459 . . . . 55.3 110.837 172.645 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -61.89 -26.32 68.08 Favored 'General case' 0 N--CA 1.487 1.399 0 C-N-CA 123.357 0.663 . . . . 74.53 112.571 175.336 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 57.5 t80 -70.81 -51.74 24.89 Favored 'General case' 0 N--CA 1.48 1.052 0 C-N-CA 123.119 0.568 . . . . 72.43 111.104 178.534 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 13.6 ptm180 -70.53 -21.57 62.71 Favored 'General case' 0 N--CA 1.475 0.824 0 C-N-CA 123.184 0.593 . . . . 74.32 111.108 -177.707 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 49.1 t -73.96 -52.79 19.39 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.969 0 CA-C-N 115.989 -0.551 . . . . 72.42 109.884 172.939 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 21.1 ptmt -70.74 -15.92 62.73 Favored 'General case' 0 N--CA 1.489 1.485 0 C-N-CA 122.773 0.429 . . . . 74.43 111.379 179.17 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -76.64 -36.46 57.39 Favored 'General case' 0 N--CA 1.481 1.1 0 CA-C-O 121.547 0.689 . . . . 64.01 109.737 172.964 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 33.4 t80 -83.61 -19.04 36.2 Favored 'General case' 0 N--CA 1.48 1.036 0 CA-C-N 115.133 -0.94 . . . . 74.31 111.87 -179.735 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -92.63 -56.46 3.01 Favored 'General case' 0 N--CA 1.473 0.722 0 CA-C-N 115.556 -0.747 . . . . 75.2 111.069 175.97 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 46.0 t -88.97 -51.71 5.47 Favored 'General case' 0 N--CA 1.497 1.882 0 CA-C-N 116.247 -0.433 . . . . 72.34 111.585 -168.802 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -71.7 -24.8 61.88 Favored 'General case' 0 N--CA 1.484 1.275 0 C-N-CA 122.656 0.382 . . . . 64.43 111.966 -178.148 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -79.43 -37.25 37.5 Favored 'General case' 0 N--CA 1.481 1.1 0 C-N-CA 122.478 0.311 . . . . 71.04 110.805 174.246 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 37.9 t -61.62 -43.47 98.8 Favored 'General case' 0 N--CA 1.494 1.748 0 C-N-CA 123.075 0.55 . . . . 75.15 111.507 173.245 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 80.1 p -75.83 -27.51 57.89 Favored 'General case' 0 N--CA 1.481 1.107 0 C-N-CA 124.127 0.971 . . . . 54.15 111.637 -177.909 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 16.8 t70 -63.08 -48.03 80.35 Favored 'General case' 0 CA--C 1.553 1.071 0 O-C-N 123.419 0.449 . . . . 64.35 110.712 169.159 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . 0.459 HD22 HD11 ' A' ' 43' ' ' LEU . 96.2 mt -71.04 -26.94 63.31 Favored 'General case' 0 N--CA 1.484 1.253 0 C-N-CA 123.199 0.6 . . . . 64.44 111.244 179.317 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 27.9 tpt180 -72.22 -37.84 69.09 Favored 'General case' 0 CA--C 1.548 0.883 0 C-N-CA 123.894 0.878 . . . . 64.11 110.136 174.845 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 44.7 t-20 -65.95 -38.89 89.77 Favored 'General case' 0 CA--C 1.56 1.329 0 C-N-CA 124.197 0.999 . . . . 55.35 110.36 174.447 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . 0.459 HD11 HD22 ' A' ' 40' ' ' LEU . 96.0 mt -69.5 -33.08 72.33 Favored 'General case' 0 N--CA 1.482 1.125 0 C-N-CA 123.167 0.587 . . . . 71.52 110.979 175.97 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . 0.447 ' O ' ' HG2' ' A' ' 48' ' ' GLU . 60.7 tttp -73.78 -46.42 45.71 Favored 'General case' 0 N--CA 1.474 0.767 0 CA-C-N 116.102 -0.499 . . . . 65.33 110.51 179.93 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 3.7 t -64.01 -32.27 73.75 Favored 'General case' 0 N--CA 1.487 1.389 0 C-N-CA 123.573 0.749 . . . . 70.3 111.168 -174.58 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -68.88 -43.46 75.28 Favored 'General case' 0 N--CA 1.478 0.945 0 CA-C-N 115.035 -0.984 . . . . 74.3 111.679 171.521 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 9.7 tt -60.7 -39.89 90.21 Favored 'General case' 0 N--CA 1.483 1.179 0 C-N-CA 123.976 0.911 . . . . 70.32 110.609 176.514 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . 0.447 ' HG2' ' O ' ' A' ' 44' ' ' LYS . 60.8 mm-40 -65.31 -47.87 75.06 Favored 'General case' 0 N--CA 1.476 0.85 0 C-N-CA 123.244 0.618 . . . . 74.53 110.499 179.988 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 59.5 m -61.33 -31.92 71.79 Favored 'General case' 0 N--CA 1.483 1.186 0 C-N-CA 123.356 0.663 . . . . 74.45 112.08 179.543 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -78.5 -52.1 9.01 Favored 'General case' 0 N--CA 1.482 1.156 0 C-N-CA 123.205 0.602 . . . . 72.52 111.965 -178.507 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 51' ' ' PHE . . . . . . . . . . . . . 70.6 m-85 -85.68 -13.7 47.73 Favored 'General case' 0 N--CA 1.482 1.138 0 N-CA-C 113.482 0.919 . . . . 65.03 113.482 -170.207 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -79.16 -15.12 58.56 Favored 'General case' 0 N--CA 1.491 1.595 0 N-CA-C 111.774 0.287 . . . . 72.25 111.774 175.036 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 20.0 t70 -117.32 -36.49 3.74 Favored 'General case' 0 N--CA 1.481 1.086 0 C-N-CA 122.574 0.35 . . . . 73.33 111.137 178.832 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 8.6 m-20 -122.77 120.21 32.91 Favored 'General case' 0 N--CA 1.491 1.587 0 CA-C-O 121.7 0.762 . . . . 63.05 112.885 -177.051 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 26.2 mp0 -97.61 12.46 33.48 Favored 'General case' 0 N--CA 1.484 1.243 0 C-N-CA 124.379 1.072 . . . . 71.15 110.073 163.48 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 22.2 m -53.8 -38.51 64.61 Favored 'General case' 0 N--CA 1.492 1.652 0 C-N-CA 125.26 1.424 . . . . 72.3 112.321 -179.671 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 49.9 t80 -108.12 93.59 11.38 Favored Pre-proline 0 CA--C 1.555 1.158 0 C-N-CA 124.237 1.015 . . . . 73.31 108.68 172.057 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 95.3 Cg_endo -84.41 131.52 4.84 Favored 'Trans proline' 0 CA--C 1.565 2.049 0 C-N-CA 121.889 1.726 . . . . 75.14 112.463 175.82 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 87.7 Cg_endo -91.07 110.36 0.33 Allowed 'Trans proline' 0 C--N 1.374 1.884 0 C-N-CA 122.736 2.291 . . . . 54.32 112.241 174.571 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 11.1 pt-20 -75.29 119.37 19.31 Favored 'General case' 0 N--CA 1.482 1.163 0 CA-C-O 121.242 0.544 . . . . 71.41 111.163 179.69 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 35.2 t . . . . . 0 N--CA 1.486 1.354 0 C-N-CA 123.376 0.67 . . . . 75.11 110.849 -177.186 . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 1' ' ' PHE . . . . . . . . . . . . . 53.2 m-85 . . . . . 0 N--CA 1.484 1.253 0 N-CA-C 109.741 -0.466 . . . . 74.53 109.741 . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 38.8 p -126.32 152.08 46.69 Favored 'General case' 0 N--CA 1.495 1.775 0 C-N-CA 123.384 0.674 . . . . 75.44 111.229 -179.481 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 44.4 mt -67.84 -19.04 65.01 Favored 'General case' 0 N--CA 1.484 1.271 0 C-N-CA 124.112 0.965 . . . . 75.51 111.846 178.64 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 46.6 mm -87.65 -48.96 14.96 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.167 0 CA-C-N 115.437 -0.801 . . . . 74.14 111.083 -175.362 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 9.0 tp10 -54.12 -47.66 71.61 Favored 'General case' 0 N--CA 1.475 0.78 0 C-N-CA 124.046 0.938 . . . . 70.11 110.959 175.941 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 3.0 pp -64.7 -37.08 86.37 Favored 'General case' 0 N--CA 1.48 1.069 0 C-N-CA 122.843 0.457 . . . . 74.34 111.951 -178.539 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 61.2 tp -59.31 -45.66 90.69 Favored 'General case' 0 CA--C 1.547 0.864 0 C-N-CA 123.495 0.718 . . . . 74.2 111.36 175.093 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 94.1 mt -68.4 -39.74 81.26 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.039 0 C-N-CA 124.272 1.029 . . . . 74.31 111.967 178.779 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 48.5 t -60.82 -47.9 91.23 Favored 'Isoleucine or valine' 0 CA--C 1.554 1.13 0 C-N-CA 123.645 0.778 . . . . 73.32 111.454 175.485 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 76.7 t -64.39 -32.16 56.49 Favored 'Isoleucine or valine' 0 CA--C 1.558 1.269 0 C-N-CA 123.323 0.649 . . . . 74.43 111.571 176.086 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -65.73 -57.22 8.54 Favored 'General case' 0 N--CA 1.482 1.156 0 C-N-CA 122.983 0.513 . . . . 72.14 111.584 176.181 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 12' ' ' ILE . . . . . 0.55 ' HA ' HD11 ' A' ' 15' ' ' ILE . 22.5 pt -66.14 -42.39 91.17 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.011 0 C-N-CA 123.548 0.739 . . . . 62.42 112.054 -175.122 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 58.2 mt -65.2 -34.88 73.57 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.13 0 C-N-CA 123.764 0.825 . . . . 71.12 110.57 174.149 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -60.67 -37.33 93.31 Favored Glycine 0 C--N 1.353 1.525 0 CA-C-N 115.674 -0.694 . . . . 42.11 112.67 174.402 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . 0.55 HD11 ' HA ' ' A' ' 12' ' ' ILE . 21.8 mt -71.31 -46.96 62.45 Favored 'Isoleucine or valine' 0 C--N 1.353 0.742 0 C-N-CA 123.577 0.751 . . . . 72.42 110.976 175.872 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . 0.465 ' HG ' ' O ' ' A' ' 12' ' ' ILE . 21.4 mt -56.2 -43.47 78.51 Favored 'General case' 0 N--CA 1.488 1.472 0 C-N-CA 123.378 0.671 . . . . 74.03 111.35 -178.554 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -74.78 -47.53 30.4 Favored 'General case' 0 CA--C 1.544 0.749 0 C-N-CA 123.36 0.664 . . . . 40.3 111.209 -178.078 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -63.91 -23.01 67.18 Favored 'General case' 0 N--CA 1.484 1.253 0 N-CA-C 113.037 0.755 . . . . 70.44 113.037 -177.926 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 2.7 pp -90.3 -38.19 10.58 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.195 0 CA-C-N 118.151 0.432 . . . . 72.34 111.502 171.973 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -63.96 -50.31 69.1 Favored 'General case' 0 N--CA 1.487 1.401 0 C-N-CA 123.549 0.74 . . . . 70.34 112.704 -175.309 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 28.5 mt -55.44 -55.51 39.21 Favored Pre-proline 0 CA--C 1.558 1.271 0 CA-C-O 118.149 -0.929 . . . . 61.43 113.308 -175.621 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 40.4 Cg_endo -66.31 -40.77 13.91 Favored 'Trans proline' 0 C--N 1.379 2.171 0 CA-C-N 121.323 1.508 . . . . 63.12 112.991 175.979 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 21.3 tt0 -62.56 -38.03 88.44 Favored 'General case' 0 N--CA 1.486 1.366 0 C-N-CA 123.273 0.629 . . . . 74.05 111.034 -175.595 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 24' ' ' PHE . . . . . . . . . . . . . 26.7 m-85 -96.28 -32.39 12.44 Favored 'General case' 0 N--CA 1.485 1.316 0 CA-C-N 115.082 -0.963 . . . . 64.14 112.104 -173.348 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 47.0 t -62.96 -55.11 28.72 Favored 'General case' 0 N--CA 1.49 1.567 0 N-CA-C 109.853 -0.425 . . . . 74.11 109.853 171.181 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -62.18 -27.06 68.71 Favored 'General case' 0 N--CA 1.483 1.204 0 C-N-CA 123.913 0.885 . . . . 64.24 112.495 177.749 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 87.9 t80 -65.42 -54.07 33.95 Favored 'General case' 0 N--CA 1.484 1.275 0 C-N-CA 122.745 0.418 . . . . 72.23 110.726 175.053 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 49.8 mtp180 -69.99 -24.3 63.29 Favored 'General case' 0 N--CA 1.481 1.121 0 C-N-CA 123.485 0.714 . . . . 73.21 111.8 -178.578 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 24.7 t -72.48 -46.17 56.72 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.266 0 CA-C-N 116.02 -0.537 . . . . 75.32 110.6 175.471 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 18.8 ptmt -79.02 -16.9 56.23 Favored 'General case' 0 N--CA 1.48 1.029 0 CA-C-N 115.715 -0.675 . . . . 72.31 111.114 178.178 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -81.9 -29.18 32.49 Favored 'General case' 0 N--CA 1.486 1.364 0 C-N-CA 123.233 0.613 . . . . 61.11 110.129 174.013 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 62.5 t80 -62.79 -53.77 49.14 Favored 'General case' 0 C--O 1.21 -1.013 0 N-CA-C 108.945 -0.761 . . . . 74.32 108.945 168.559 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 3.4 m-20 -57.23 -43.24 82.69 Favored 'General case' 0 N--CA 1.487 1.384 0 C-N-CA 123.898 0.879 . . . . 73.41 112.334 175.477 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 35.5 t -62.54 -65.94 0.61 Allowed 'General case' 0 N--CA 1.484 1.258 0 C-N-CA 123.17 0.588 . . . . 74.33 111.11 -179.86 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -65.09 -31.36 72.54 Favored 'General case' 0 N--CA 1.481 1.081 0 N-CA-C 113.016 0.747 . . . . 73.21 113.016 -176.165 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -69.46 -60.57 2.25 Favored 'General case' 0 N--CA 1.492 1.668 0 CA-C-N 117.608 0.186 . . . . 65.14 111.248 177.29 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 48.7 m -66.37 -25.06 66.62 Favored 'General case' 0 N--CA 1.484 1.257 0 C-N-CA 123.023 0.529 . . . . 72.33 112.401 -177.909 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 42.4 t -75.98 -39.26 56.28 Favored 'General case' 0 N--CA 1.491 1.603 0 C-N-CA 123.021 0.528 . . . . 64.03 111.088 176.163 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 28.2 t70 -58.01 -50.73 72.4 Favored 'General case' 0 N--CA 1.481 1.116 0 C-N-CA 123.059 0.544 . . . . 74.14 110.369 170.186 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 95.1 mt -65.01 -38.81 92.15 Favored 'General case' 0 N--CA 1.478 0.943 0 CA-C-N 115.066 -0.97 . . . . 71.44 110.937 -176.155 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 36.4 ttt180 -71.37 -54.49 10.58 Favored 'General case' 0 CA--C 1.542 0.644 0 C-N-CA 123.385 0.674 . . . . 64.22 110.678 -179.134 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 2.8 t-20 -57.55 -41.64 81.37 Favored 'General case' 0 N--CA 1.488 1.473 0 C-N-CA 124.059 0.943 . . . . 70.0 112.348 -175.06 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 98.1 mt -72.44 -47.14 51.35 Favored 'General case' 0 N--CA 1.48 1.069 0 C-N-CA 122.924 0.49 . . . . 70.23 111.083 -179.675 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 36.4 ttpt -67.27 -46.33 73.97 Favored 'General case' 0 N--CA 1.481 1.09 0 C-N-CA 123.525 0.73 . . . . 73.43 110.967 -173.893 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 45' ' ' THR . . . . . 0.506 ' HA ' ' HG2' ' A' ' 48' ' ' GLU . 1.8 t -71.76 -33.86 68.99 Favored 'General case' 0 N--CA 1.472 0.655 0 CA-C-N 115.056 -0.974 . . . . 72.24 111.357 -173.936 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -68.81 -43.06 76.38 Favored 'General case' 0 N--CA 1.475 0.791 0 CA-C-N 115.885 -0.598 . . . . 71.52 110.492 176.513 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 1.8 pp -75.96 -32.99 59.78 Favored 'General case' 0 N--CA 1.481 1.104 0 C-N-CA 122.653 0.381 . . . . 74.4 111.61 -177.073 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . 0.506 ' HG2' ' HA ' ' A' ' 45' ' ' THR . 11.0 pt-20 -78.6 -36.07 44.81 Favored 'General case' 0 N--CA 1.489 1.513 0 CA-C-N 117.756 0.253 . . . . 53.05 111.314 -178.208 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 67.8 m -68.59 -35.0 76.75 Favored 'General case' 0 N--CA 1.485 1.315 0 C-N-CA 123.083 0.553 . . . . 74.53 110.326 173.334 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . 0.438 ' HB3' ' HG3' ' A' ' 55' ' ' GLN . . . -65.83 -42.9 89.99 Favored 'General case' 0 N--CA 1.474 0.739 0 CA-C-N 115.397 -0.819 . . . . 73.52 110.657 172.825 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 51' ' ' PHE . . . . . . . . . . . . . 61.0 t80 -71.31 -26.38 62.83 Favored 'General case' 0 N--CA 1.483 1.182 0 C-N-CA 123.783 0.833 . . . . 74.31 111.468 178.994 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -69.95 -38.31 76.08 Favored 'General case' 0 N--CA 1.485 1.313 0 C-N-CA 123.605 0.762 . . . . 72.45 110.942 178.28 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 16.3 t70 -95.77 -8.5 34.22 Favored 'General case' 0 CA--C 1.56 1.364 0 C-N-CA 123.383 0.673 . . . . 62.4 111.215 177.751 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 14.5 t70 75.97 130.68 0.05 OUTLIER 'General case' 0 CA--C 1.568 1.67 0 C-N-CA 126.463 1.905 . . . . 73.21 110.989 -173.625 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . 0.438 ' HG3' ' HB3' ' A' ' 50' ' ' ALA . 22.1 mp0 -70.68 -1.58 11.79 Favored 'General case' 0 N--CA 1.493 1.678 0 N-CA-C 114.283 1.216 . . . . 62.22 114.283 -171.393 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 93.8 m -65.51 -38.14 88.83 Favored 'General case' 0 N--CA 1.49 1.541 0 CA-C-N 118.282 0.492 . . . . 74.14 110.997 173.69 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 59.1 t80 -91.81 120.62 67.93 Favored Pre-proline 0 CA--C 1.558 1.267 0 C-N-CA 122.561 0.344 . . . . 74.13 110.68 175.718 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 69.1 Cg_endo -85.19 148.39 10.38 Favored 'Trans proline' 0 CA--C 1.567 2.128 0 C-N-CA 122.575 2.183 . . . . 53.54 113.098 169.736 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 43.9 Cg_exo -60.3 154.35 53.26 Favored 'Trans proline' 0 C--N 1.38 2.218 0 C-N-CA 122.971 2.447 . . . . 65.22 112.479 168.673 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 44.0 tt0 -61.09 108.15 0.84 Allowed 'General case' 0 N--CA 1.485 1.289 0 C-N-CA 123.195 0.598 . . . . 74.0 111.98 -176.37 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 36.8 t . . . . . 0 N--CA 1.487 1.414 0 C-N-CA 123.706 0.802 . . . . 72.33 110.27 176.811 . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 1' ' ' PHE . . . . . . . . . . . . . 67.5 m-85 . . . . . 0 N--CA 1.486 1.354 0 CA-C-O 121.107 0.48 . . . . 72.02 110.492 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 2' ' ' THR . . . . . 0.544 HG21 ' H ' ' A' ' 4' ' ' ILE . 22.1 m -92.05 141.81 28.21 Favored 'General case' 0 N--CA 1.482 1.165 0 C-N-CA 123.947 0.899 . . . . 73.34 111.3 -179.686 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 2.8 mm? -64.63 -18.16 64.68 Favored 'General case' 0 N--CA 1.49 1.563 0 C-N-CA 123.923 0.889 . . . . 73.43 111.908 178.859 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . 0.544 ' H ' HG21 ' A' ' 2' ' ' THR . 50.6 mm -71.18 -39.68 73.78 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.267 0 C-N-CA 123.599 0.76 . . . . 72.31 110.276 175.223 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 43.3 mt-10 -54.82 -48.26 73.04 Favored 'General case' 0 N--CA 1.485 1.275 0 C-N-CA 123.044 0.538 . . . . 65.23 111.407 175.671 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -60.96 -37.29 81.86 Favored 'General case' 0 N--CA 1.488 1.454 0 O-C-N 123.567 0.542 . . . . 73.5 110.733 -179.311 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 34.0 tp -68.6 -34.06 75.12 Favored 'General case' 0 CA--C 1.551 1.016 0 C-N-CA 123.455 0.702 . . . . 73.45 112.222 179.77 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 89.1 mt -73.62 -45.69 50.25 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.639 0 C-N-CA 123.355 0.662 . . . . 72.05 110.943 175.392 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 73.3 t -62.1 -42.93 96.93 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.868 0 C-N-CA 123.624 0.77 . . . . 52.21 111.618 179.493 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 6.1 p -68.93 -31.45 50.59 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.074 0 O-C-N 122.205 -0.309 . . . . 74.14 111.519 177.321 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -69.07 -53.49 20.07 Favored 'General case' 0 C--N 1.361 1.087 0 C-N-CA 122.775 0.43 . . . . 73.1 111.437 178.661 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 12' ' ' ILE . . . . . 0.579 ' HA ' HD13 ' A' ' 15' ' ' ILE . 29.6 pt -65.17 -45.57 93.58 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.953 0 C-N-CA 123.306 0.643 . . . . 63.25 111.636 -178.346 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 1.7 mp -61.93 -32.89 55.6 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.532 0 C-N-CA 123.717 0.807 . . . . 74.4 110.457 174.253 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -58.91 -40.3 95.11 Favored Glycine 0 C--N 1.355 1.614 0 O-C-N 123.5 0.5 . . . . 53.11 112.618 174.146 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . 0.579 HD13 ' HA ' ' A' ' 12' ' ' ILE . 19.2 mt -72.13 -46.81 57.09 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.748 0 C-N-CA 124.049 0.94 . . . . 71.14 110.902 175.843 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . 0.515 ' HG ' ' O ' ' A' ' 12' ' ' ILE . 25.6 mt -59.74 -37.77 79.89 Favored 'General case' 0 N--CA 1.482 1.137 0 C-N-CA 123.549 0.739 . . . . 65.23 111.6 -176.749 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -75.97 -48.03 22.7 Favored 'General case' 0 N--CA 1.474 0.756 0 C-N-CA 123.103 0.561 . . . . 63.21 110.381 178.344 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -56.92 -26.85 60.09 Favored 'General case' 0 N--CA 1.481 1.087 0 N-CA-C 113.249 0.833 . . . . 70.44 113.249 -179.139 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 2.8 pp -91.18 -38.27 10.37 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.982 0 N-CA-C 111.758 0.281 . . . . 72.15 111.758 172.117 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -64.72 -50.41 67.04 Favored 'General case' 0 N--CA 1.489 1.483 0 N-CA-C 113.204 0.816 . . . . 71.13 113.204 -171.374 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 2.4 mp -63.78 -53.06 53.21 Favored Pre-proline 0 CA--C 1.563 1.451 0 CA-C-O 118.544 -0.741 . . . . 71.22 112.461 -174.035 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 36.7 Cg_endo -63.7 -35.49 57.68 Favored 'Trans proline' 0 C--N 1.38 2.194 0 C-N-CA 121.895 1.73 . . . . 70.03 113.374 175.025 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 29.9 tt0 -66.14 -38.78 88.96 Favored 'General case' 0 N--CA 1.487 1.382 0 C-N-CA 123.034 0.533 . . . . 71.32 110.259 179.899 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 24' ' ' PHE . . . . . . . . . . . . . 79.9 t80 -79.69 -38.79 32.75 Favored 'General case' 0 N--CA 1.487 1.423 0 CA-C-N 114.742 -1.117 . . . . 71.13 110.67 -176.241 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 47.8 t -56.44 -59.19 5.33 Favored 'General case' 0 N--CA 1.475 0.798 0 C-N-CA 123.696 0.798 . . . . 75.02 109.244 172.25 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -57.56 -29.31 64.32 Favored 'General case' 0 N--CA 1.48 1.057 0 C-N-CA 124.141 0.976 . . . . 54.1 112.652 177.444 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 64.3 t80 -75.19 -47.92 26.04 Favored 'General case' 0 N--CA 1.483 1.196 0 C-N-CA 123.173 0.589 . . . . 62.32 111.361 -177.145 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 40.6 ptt180 -78.28 -21.38 49.84 Favored 'General case' 0 N--CA 1.48 1.044 0 CA-C-N 115.589 -0.732 . . . . 72.05 110.935 -178.92 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 42.9 t -72.99 -54.42 15.83 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.027 0 N-CA-C 109.485 -0.561 . . . . 72.33 109.485 172.797 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 14.3 ptmm? -65.29 -20.27 66.33 Favored 'General case' 0 N--CA 1.489 1.519 0 C-N-CA 122.49 0.316 . . . . 64.43 111.235 178.541 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -68.62 -44.86 73.34 Favored 'General case' 0 N--CA 1.476 0.859 0 CA-C-O 121.404 0.621 . . . . 64.23 109.94 170.531 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 30.9 t80 -83.8 -12.02 56.24 Favored 'General case' 0 N--CA 1.481 1.108 0 CA-C-N 114.97 -1.013 . . . . 73.31 112.543 -177.066 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -96.57 -54.11 3.35 Favored 'General case' 0 N--CA 1.478 0.971 0 C-N-CA 123.441 0.696 . . . . 73.34 110.432 176.874 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 46.6 t -77.7 -51.24 10.89 Favored 'General case' 0 N--CA 1.494 1.754 0 CA-C-N 115.98 -0.555 . . . . 72.02 111.658 -171.139 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -68.72 -28.73 67.09 Favored 'General case' 0 N--CA 1.483 1.182 0 C-N-CA 122.602 0.361 . . . . 53.33 111.567 179.647 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -69.98 -42.82 72.62 Favored 'General case' 0 N--CA 1.482 1.14 0 C-N-CA 122.49 0.316 . . . . 62.42 111.024 175.122 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 37' ' ' SER . . . . . 0.414 ' O ' ' HG2' ' A' ' 41' ' ' ARG . 71.1 m -59.86 -46.84 88.02 Favored 'General case' 0 N--CA 1.482 1.169 0 C-N-CA 122.807 0.443 . . . . 71.24 110.797 173.406 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 50.6 m -66.69 -31.55 72.29 Favored 'General case' 0 N--CA 1.481 1.113 0 C-N-CA 123.664 0.785 . . . . 72.43 112.031 -178.354 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 28.8 t70 -60.21 -51.03 71.29 Favored 'General case' 0 N--CA 1.477 0.882 0 C-N-CA 123.24 0.616 . . . . 75.44 110.454 171.052 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 85.7 mt -70.89 -30.93 67.42 Favored 'General case' 0 N--CA 1.481 1.119 0 C-N-CA 123.388 0.675 . . . . 70.01 111.585 -175.769 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 41' ' ' ARG . . . . . 0.414 ' HG2' ' O ' ' A' ' 37' ' ' SER . 14.7 mmt180 -78.32 -32.74 49.41 Favored 'General case' 0 N--CA 1.48 1.067 0 CA-C-N 115.777 -0.647 . . . . 72.31 110.408 177.853 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 64.1 t30 -64.93 -38.87 92.4 Favored 'General case' 0 N--CA 1.484 1.248 0 C-N-CA 123.14 0.576 . . . . 74.3 110.432 172.56 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . 0.458 ' O ' HD13 ' A' ' 47' ' ' LEU . 94.3 mt -70.42 -42.69 71.29 Favored 'General case' 0 N--CA 1.479 1.0 0 C-N-CA 123.304 0.641 . . . . 64.14 110.407 178.607 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . 0.481 ' O ' ' HG2' ' A' ' 48' ' ' GLU . 3.7 tppp? -68.84 -51.06 44.55 Favored 'General case' 0 N--CA 1.466 0.353 0 CA-C-N 115.934 -0.576 . . . . 72.32 110.074 -175.487 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 1.7 t -61.84 -33.6 74.46 Favored 'General case' 0 N--CA 1.486 1.328 0 C-N-CA 123.933 0.893 . . . . 63.11 111.786 -178.392 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -63.62 -47.69 80.35 Favored 'General case' 0 N--CA 1.482 1.165 0 C-N-CA 123.757 0.823 . . . . 72.12 111.41 174.926 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 47' ' ' LEU . . . . . 0.458 HD13 ' O ' ' A' ' 43' ' ' LEU . 9.2 mp -65.49 -41.22 93.49 Favored 'General case' 0 CA--C 1.554 1.118 0 CA-C-N 115.51 -0.768 . . . . 75.13 111.791 176.559 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . 0.481 ' HG2' ' O ' ' A' ' 44' ' ' LYS . 11.2 mm-40 -65.48 -41.96 92.73 Favored 'General case' 0 N--CA 1.482 1.161 0 C-N-CA 122.553 0.341 . . . . 75.24 110.839 -178.346 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 68.1 m -69.79 -28.01 65.38 Favored 'General case' 0 N--CA 1.485 1.315 0 C-N-CA 123.191 0.596 . . . . 63.32 112.037 177.725 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -75.66 -53.15 9.02 Favored 'General case' 0 N--CA 1.48 1.036 0 C-N-CA 122.891 0.476 . . . . 72.32 110.765 -178.15 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 51' ' ' PHE . . . . . . . . . . . . . 44.9 m-85 -77.55 -19.7 55.31 Favored 'General case' 0 N--CA 1.482 1.15 0 CA-C-N 115.176 -0.92 . . . . 73.42 112.569 -174.868 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -81.73 -26.66 34.37 Favored 'General case' 0 N--CA 1.489 1.516 0 C-N-CA 122.668 0.387 . . . . 63.13 111.654 176.223 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 4.5 t70 -85.43 -52.42 5.87 Favored 'General case' 0 CA--C 1.549 0.94 0 CA-C-O 121.268 0.556 . . . . 75.2 109.643 177.826 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 16.6 m-20 -135.49 102.94 5.29 Favored 'General case' 0 N--CA 1.48 1.056 0 C-N-CA 124.916 1.286 . . . . 71.35 109.575 177.176 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 6.6 tp-100 -69.04 -20.36 64.12 Favored 'General case' 0 CA--C 1.559 1.299 0 CA-C-O 121.283 0.563 . . . . 71.52 110.853 173.939 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 82.5 p -72.61 -29.37 63.43 Favored 'General case' 0 N--CA 1.482 1.129 0 C-N-CA 124.33 1.052 . . . . 74.21 112.55 174.9 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 17.9 m-85 -93.16 151.47 40.47 Favored Pre-proline 0 N--CA 1.489 1.504 0 C-N-CA 123.232 0.613 . . . . 75.41 112.648 -176.169 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 51.3 Cg_endo -80.95 174.64 10.72 Favored 'Trans proline' 0 C--N 1.384 2.441 0 C-N-CA 123.459 2.773 . . . . 72.52 112.224 173.976 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 74.4 Cg_endo -73.04 164.24 36.06 Favored 'Trans proline' 0 C--N 1.382 2.296 0 C-N-CA 121.924 1.749 . . . . 74.33 112.95 173.694 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 37.3 mt-10 -74.7 -27.4 60.37 Favored 'General case' 0 N--CA 1.488 1.468 0 C-N-CA 123.456 0.702 . . . . 74.04 111.681 -177.584 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 70.6 p . . . . . 0 C--O 1.251 1.166 0 C-N-CA 124.065 0.946 . . . . 50.31 110.203 179.879 . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 1' ' ' PHE . . . . . . . . . . . . . 74.8 t80 . . . . . 0 N--CA 1.491 1.603 0 N-CA-C 111.533 0.197 . . . . 73.31 111.533 . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 66.2 p -57.49 149.63 20.6 Favored 'General case' 0 N--CA 1.494 1.751 0 N-CA-C 112.066 0.395 . . . . 72.24 112.066 -179.173 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . 0.403 HD22 HD11 ' A' ' 6' ' ' LEU . 63.0 mt -57.33 -23.41 48.64 Favored 'General case' 0 N--CA 1.487 1.396 0 C-N-CA 123.828 0.851 . . . . 64.1 111.54 174.285 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 50.7 mm -66.79 -53.29 36.08 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.873 0 CA-C-N 115.155 -0.929 . . . . 72.33 110.339 172.83 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 48.2 mm-40 -64.45 -31.76 73.11 Favored 'General case' 0 N--CA 1.485 1.318 0 C-N-CA 123.546 0.738 . . . . 65.42 112.366 179.654 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . 0.403 HD11 HD22 ' A' ' 3' ' ' LEU . 92.9 mt -66.59 -45.33 79.57 Favored 'General case' 0 N--CA 1.481 1.085 0 C-N-CA 123.242 0.617 . . . . 72.12 110.923 173.935 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 40.9 tp -58.85 -43.28 90.75 Favored 'General case' 0 CA--C 1.551 1.004 0 C-N-CA 123.411 0.685 . . . . 72.11 111.488 175.378 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 96.6 mt -67.99 -47.36 79.26 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.866 0 C-N-CA 124.227 1.011 . . . . 71.34 112.927 179.626 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 8.3 p -64.67 -40.24 88.39 Favored 'Isoleucine or valine' 0 C--N 1.357 0.901 0 CA-C-N 118.44 0.563 . . . . 37.84 111.481 -177.812 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 76.6 t -66.67 -39.14 83.07 Favored 'Isoleucine or valine' 0 CA--C 1.555 1.141 0 C-N-CA 123.13 0.572 . . . . 73.11 111.026 173.827 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -64.91 -47.42 77.84 Favored 'General case' 0 N--CA 1.482 1.133 0 C-N-CA 122.941 0.497 . . . . 74.2 111.853 -179.84 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 12' ' ' ILE . . . . . 0.62 ' HA ' HD11 ' A' ' 15' ' ' ILE . 2.7 pp -68.89 -40.16 80.81 Favored 'Isoleucine or valine' 0 C--N 1.355 0.81 0 CA-C-O 119.042 -0.504 . . . . 72.32 111.416 -177.261 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 58.5 mt -60.92 -33.32 55.11 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.253 0 C-N-CA 123.564 0.746 . . . . 75.32 110.95 173.289 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -59.87 -43.44 98.01 Favored Glycine 0 C--N 1.352 1.444 0 CA-C-N 115.882 -0.599 . . . . 74.43 112.548 173.111 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . 0.62 HD11 ' HA ' ' A' ' 12' ' ' ILE . 18.7 mt -70.33 -43.94 77.97 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.738 0 C-N-CA 123.528 0.731 . . . . 74.02 111.066 178.455 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . 0.497 ' HG ' ' O ' ' A' ' 12' ' ' ILE . 23.8 mt -57.62 -41.67 81.8 Favored 'General case' 0 N--CA 1.483 1.18 0 C-N-CA 123.346 0.658 . . . . 64.44 111.121 -177.996 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -70.72 -51.16 29.22 Favored 'General case' 0 N--CA 1.474 0.757 0 CA-C-O 121.239 0.543 . . . . 60.33 110.8 178.592 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -61.35 -21.59 64.15 Favored 'General case' 0 CA--C 1.55 0.979 0 N-CA-C 113.372 0.878 . . . . 73.22 113.372 -177.266 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 2.7 pp -94.2 -39.18 10.19 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.09 0 CA-C-N 118.004 0.366 . . . . 72.01 111.782 172.387 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -69.56 -52.78 23.03 Favored 'General case' 0 N--CA 1.485 1.295 0 N-CA-C 112.42 0.526 . . . . 62.51 112.42 -171.415 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 2.4 mp -54.51 -54.97 42.72 Favored Pre-proline 0 CA--C 1.568 1.641 0 CA-C-O 118.119 -0.943 . . . . 73.44 112.272 -176.722 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 29.0 Cg_endo -63.2 -42.75 21.44 Favored 'Trans proline' 0 C--N 1.381 2.282 0 C-N-CA 121.963 1.775 . . . . 74.15 113.64 176.823 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 6.3 tt0 -62.76 -42.29 99.61 Favored 'General case' 0 N--CA 1.486 1.366 0 C-N-CA 124.061 0.944 . . . . 75.51 110.996 -175.333 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 24' ' ' PHE . . . . . . . . . . . . . 44.4 m-85 -90.62 -25.68 20.02 Favored 'General case' 0 N--CA 1.482 1.128 0 CA-C-N 114.27 -1.332 . . . . 75.42 111.136 -174.764 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 43.9 t -63.62 -59.23 4.87 Favored 'General case' 0 N--CA 1.48 1.04 0 N-CA-C 108.644 -0.872 . . . . 63.34 108.644 170.069 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -55.84 -32.65 63.81 Favored 'General case' 0 N--CA 1.479 1.019 0 C-N-CA 123.841 0.856 . . . . 72.13 112.971 177.222 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 19.6 t80 -72.74 -49.6 30.02 Favored 'General case' 0 N--CA 1.486 1.353 0 C-N-CA 123.168 0.587 . . . . 74.21 111.822 -179.6 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 70.4 mtp180 -81.36 -16.19 53.05 Favored 'General case' 0 N--CA 1.48 1.072 0 C-N-CA 123.286 0.635 . . . . 74.04 111.62 -177.076 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 73.5 t -90.17 -32.43 5.52 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.635 0 C-N-CA 122.651 0.381 . . . . 74.42 110.828 175.365 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 19.3 ptmt -74.14 -23.83 59.33 Favored 'General case' 0 N--CA 1.488 1.464 0 N-CA-C 109.279 -0.637 . . . . 72.43 109.279 170.121 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -72.74 -36.56 67.77 Favored 'General case' 0 C--N 1.359 0.988 0 C-N-CA 122.778 0.431 . . . . 63.15 110.094 171.887 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 83.1 t80 -60.02 -56.41 22.05 Favored 'General case' 0 N--CA 1.478 0.926 0 CA-C-N 115.688 -0.687 . . . . 74.41 110.02 171.71 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 5.4 m-20 -55.49 -53.71 52.92 Favored 'General case' 0 N--CA 1.48 1.057 0 C-N-CA 124.505 1.122 . . . . 71.11 112.683 177.985 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 32.1 t -66.87 -52.33 44.8 Favored 'General case' 0 N--CA 1.492 1.63 0 C-N-CA 122.92 0.488 . . . . 62.22 111.811 -173.821 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -64.0 -42.51 97.14 Favored 'General case' 0 N--CA 1.475 0.82 0 CA-C-O 119.094 -0.479 . . . . 62.32 111.832 179.347 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -66.33 -48.38 70.45 Favored 'General case' 0 N--CA 1.495 1.825 0 N-CA-C 111.942 0.349 . . . . 64.04 111.942 -177.931 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 37' ' ' SER . . . . . 0.479 ' O ' ' HG2' ' A' ' 41' ' ' ARG . 70.9 m -63.38 -49.44 73.81 Favored 'General case' 0 N--CA 1.483 1.183 0 C-N-CA 123.284 0.634 . . . . 74.32 111.612 179.689 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 47.1 t -72.78 -26.63 61.6 Favored 'General case' 0 N--CA 1.486 1.365 0 N-CA-C 112.337 0.495 . . . . 63.12 112.337 -177.678 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 27.6 t70 -62.52 -49.79 73.94 Favored 'General case' 0 N--CA 1.482 1.131 0 C-N-CA 122.758 0.423 . . . . 64.02 111.206 171.514 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . 0.412 ' HG ' ' O ' ' A' ' 37' ' ' SER . 4.0 pp -72.34 -21.92 61.25 Favored 'General case' 0 N--CA 1.488 1.44 0 CA-C-O 120.758 0.314 . . . . 72.31 111.315 -175.274 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 41' ' ' ARG . . . . . 0.479 ' HG2' ' O ' ' A' ' 37' ' ' SER . 27.1 mmt180 -80.1 -39.72 29.01 Favored 'General case' 0 N--CA 1.485 1.281 0 C-N-CA 123.13 0.572 . . . . 75.51 110.758 171.95 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 42' ' ' ASN . . . . . 0.407 ' O ' HG22 ' A' ' 45' ' ' THR . 61.1 t30 -68.02 -40.77 82.88 Favored 'General case' 0 N--CA 1.488 1.464 0 C-N-CA 123.534 0.734 . . . . 74.11 112.408 -178.095 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 4.3 pp -72.89 -29.87 63.49 Favored 'General case' 0 N--CA 1.485 1.318 0 O-C-N 122.083 -0.386 . . . . 71.21 110.727 177.025 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . 0.624 ' HE2' ' HB2' ' A' ' 57' ' ' TYR . 44.5 tttm -67.86 -40.22 83.68 Favored 'General case' 0 N--CA 1.471 0.612 0 C-N-CA 123.517 0.727 . . . . 64.42 109.81 174.708 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 45' ' ' THR . . . . . 0.536 ' HA ' ' HG2' ' A' ' 48' ' ' GLU . 0.9 OUTLIER -77.97 -31.49 50.82 Favored 'General case' 0 N--CA 1.483 1.18 0 CA-C-N 115.414 -0.812 . . . . 72.52 111.258 -171.501 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -63.57 -46.77 84.36 Favored 'General case' 0 CA--C 1.547 0.836 0 C-N-CA 123.986 0.914 . . . . 63.43 110.888 171.306 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 87.2 mt -67.83 -43.6 79.18 Favored 'General case' 0 N--CA 1.481 1.123 0 C-N-CA 123.729 0.811 . . . . 73.31 112.581 179.354 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . 0.536 ' HG2' ' HA ' ' A' ' 45' ' ' THR . 11.3 pt-20 -71.95 -26.74 62.4 Favored 'General case' 0 N--CA 1.483 1.207 0 O-C-N 122.153 -0.342 . . . . 43.13 111.395 -176.246 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 57.1 m -73.05 -30.0 63.39 Favored 'General case' 0 N--CA 1.49 1.559 0 C-N-CA 122.954 0.501 . . . . 73.5 111.209 169.823 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -76.52 -27.7 56.1 Favored 'General case' 0 N--CA 1.482 1.17 0 C-N-CA 124.151 0.981 . . . . 55.15 112.428 -176.41 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 51' ' ' PHE . . . . . . . . . . . . . 96.5 m-85 -107.69 -16.37 14.35 Favored 'General case' 0 N--CA 1.483 1.211 0 C-N-CA 123.965 0.906 . . . . 74.34 111.04 177.711 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . 71.29 -18.89 0.26 Allowed 'General case' 0 N--CA 1.5 2.054 0 C-N-CA 125.498 1.519 . . . . 73.43 115.079 177.454 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 32.7 t70 -95.97 -26.4 15.58 Favored 'General case' 0 CA--C 1.558 1.253 0 C-N-CA 123.71 0.804 . . . . 74.12 112.385 -172.323 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 24.3 t0 61.38 78.56 0.28 Allowed 'General case' 0 N--CA 1.486 1.35 0 C-N-CA 124.503 1.121 . . . . 73.54 112.329 -172.304 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 1.1 pm0 -109.0 10.87 26.15 Favored 'General case' 0 N--CA 1.484 1.241 0 CA-C-N 114.912 -1.04 . . . . 75.14 110.178 170.838 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 69.0 p -69.05 -60.31 2.44 Favored 'General case' 0 N--CA 1.482 1.159 0 C-N-CA 123.267 0.627 . . . . 74.52 110.026 177.464 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 57' ' ' TYR . . . . . 0.624 ' HB2' ' HE2' ' A' ' 44' ' ' LYS . 74.0 m-85 -144.06 104.41 4.81 Favored Pre-proline 0 CA--C 1.547 0.856 0 C-N-CA 125.127 1.371 . . . . 74.0 107.454 170.967 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 62.8 Cg_exo -43.29 140.85 3.51 Favored 'Trans proline' 0 C--N 1.385 2.477 0 C-N-CA 123.94 3.094 . . . . 74.32 113.701 176.161 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 19.8 Cg_exo -32.97 92.34 0.01 OUTLIER 'Trans proline' 0 C--N 1.395 3.015 1 C-N-CA 125.439 4.093 . . . . 61.53 116.14 -174.097 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 38.0 tt0 -72.81 -55.78 6.2 Favored 'General case' 0 CA--C 1.548 0.872 0 C-N-CA 124.005 0.922 . . . . 75.23 110.466 178.717 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 53.0 p . . . . . 0 CA--C 1.562 1.419 0 C-N-CA 124.431 1.092 . . . . 74.43 110.909 -179.907 . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 1' ' ' PHE . . . . . . . . . . . . . 33.9 p90 . . . . . 0 N--CA 1.485 1.305 0 N-CA-C 111.863 0.32 . . . . 71.24 111.863 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 2' ' ' THR . . . . . 0.569 HG21 ' H ' ' A' ' 4' ' ' ILE . 16.6 m -62.97 145.48 55.26 Favored 'General case' 0 N--CA 1.487 1.385 0 C-N-CA 124.076 0.95 . . . . 73.43 112.462 -174.085 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 49.7 tp -57.5 -26.51 61.41 Favored 'General case' 0 N--CA 1.483 1.179 0 C-N-CA 124.124 0.97 . . . . 71.54 111.808 175.649 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . 0.569 ' H ' HG21 ' A' ' 2' ' ' THR . 52.1 mm -67.37 -41.97 86.91 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.148 0 CA-C-N 115.959 -0.564 . . . . 75.32 110.717 175.622 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 44.3 mt-10 -64.68 -36.35 84.0 Favored 'General case' 0 N--CA 1.488 1.461 0 C-N-CA 123.543 0.737 . . . . 64.13 111.123 175.854 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . 0.423 ' HA ' HG12 ' A' ' 9' ' ' VAL . 77.2 mt -69.11 -33.49 73.57 Favored 'General case' 0 N--CA 1.476 0.83 0 CA-C-N 115.524 -0.762 . . . . 74.22 111.296 174.289 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 26.9 tp -69.55 -33.35 72.64 Favored 'General case' 0 CA--C 1.56 1.327 0 C-N-CA 123.156 0.582 . . . . 74.42 111.346 174.522 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . 0.439 HG13 ' O ' ' A' ' 4' ' ' ILE . 77.8 mt -68.68 -49.39 65.0 Favored 'Isoleucine or valine' 0 C--N 1.363 1.178 0 C-N-CA 123.399 0.68 . . . . 71.15 111.412 175.935 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . 0.423 HG12 ' HA ' ' A' ' 6' ' ' LEU . 8.6 p -63.31 -38.1 81.23 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.972 0 C-N-CA 122.787 0.435 . . . . 61.12 111.852 -179.33 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 44.4 t -66.9 -36.57 77.49 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.064 0 C-N-CA 123.155 0.582 . . . . 75.21 111.889 172.418 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -66.94 -56.42 10.29 Favored 'General case' 0 N--CA 1.485 1.286 0 N-CA-C 111.821 0.304 . . . . 74.44 111.821 178.284 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 12' ' ' ILE . . . . . 0.512 ' O ' ' HG ' ' A' ' 16' ' ' LEU . 28.8 pt -59.9 -50.82 78.65 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.913 0 C-N-CA 122.992 0.517 . . . . 74.32 111.83 -175.473 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 81.4 mt -69.73 -31.12 47.33 Favored 'Isoleucine or valine' 0 C--N 1.36 1.064 0 C-N-CA 123.589 0.756 . . . . 63.23 110.092 -179.233 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -61.28 -34.27 87.56 Favored Glycine 0 C--N 1.349 1.284 0 CA-C-N 115.894 -0.594 . . . . 73.02 113.533 174.335 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 1.7 mp -79.85 -44.61 23.05 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.99 0 C-N-CA 122.934 0.494 . . . . 64.41 110.085 175.484 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . 0.512 ' HG ' ' O ' ' A' ' 12' ' ' ILE . 31.9 mt -54.52 -42.64 71.06 Favored 'General case' 0 N--CA 1.488 1.43 0 C-N-CA 123.13 0.572 . . . . 74.14 111.324 -179.463 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -77.06 -48.73 17.03 Favored 'General case' 0 CA--C 1.55 0.969 0 C-N-CA 123.356 0.662 . . . . 75.42 111.378 179.337 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -55.78 -27.19 49.79 Favored 'General case' 0 N--CA 1.493 1.711 0 N-CA-C 113.182 0.808 . . . . 44.4 113.182 -178.863 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 2.8 pp -90.54 -35.85 7.71 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.105 0 N-CA-C 112.067 0.395 . . . . 71.5 112.067 173.097 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -67.63 -45.71 74.58 Favored 'General case' 0 N--CA 1.484 1.228 0 C-N-CA 123.224 0.609 . . . . 50.51 111.972 -172.639 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 1.9 mp -59.4 -52.98 70.46 Favored Pre-proline 0 CA--C 1.571 1.766 0 CA-C-O 118.486 -0.768 . . . . 60.4 112.478 -177.141 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 40.1 Cg_endo -66.66 -36.4 25.19 Favored 'Trans proline' 0 C--N 1.381 2.27 0 C-N-CA 121.911 1.74 . . . . 71.23 113.498 173.356 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 28.8 tt0 -66.58 -30.93 71.34 Favored 'General case' 0 N--CA 1.495 1.815 0 C-N-CA 123.133 0.573 . . . . 74.04 111.16 -178.096 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 24' ' ' PHE . . . . . . . . . . . . . 75.1 t80 -91.15 -40.13 11.75 Favored 'General case' 0 N--CA 1.489 1.482 0 CA-C-N 115.179 -0.919 . . . . 71.34 110.782 -176.6 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 25' ' ' SER . . . . . 0.423 ' O ' HG22 ' A' ' 29' ' ' VAL . 48.2 t -60.41 -55.47 33.15 Favored 'General case' 0 N--CA 1.479 1.003 0 C-N-CA 123.204 0.602 . . . . 73.41 110.051 174.669 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -64.7 -22.64 67.03 Favored 'General case' 0 N--CA 1.483 1.21 0 C-N-CA 123.74 0.816 . . . . 74.34 112.525 177.252 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 80.4 t80 -66.95 -47.59 71.17 Favored 'General case' 0 N--CA 1.48 1.063 0 CA-C-O 121.088 0.471 . . . . 64.25 110.206 172.92 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 19.9 mtp180 -72.41 -23.1 61.04 Favored 'General case' 0 N--CA 1.474 0.759 0 CA-C-N 115.196 -0.911 . . . . 65.0 111.173 179.806 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . 0.423 HG22 ' O ' ' A' ' 25' ' ' SER . 68.7 t -69.59 -50.79 47.43 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.184 0 N-CA-C 109.909 -0.404 . . . . 63.15 109.909 173.791 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . 0.451 ' HA ' ' HB3' ' A' ' 33' ' ' ASN . 14.7 ptmm? -75.71 -13.96 60.33 Favored 'General case' 0 N--CA 1.484 1.246 0 C-N-CA 122.862 0.465 . . . . 71.44 111.782 178.836 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -74.14 -40.69 62.45 Favored 'General case' 0 N--CA 1.481 1.088 0 CA-C-O 121.647 0.737 . . . . 65.11 109.593 172.393 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 32' ' ' TYR . . . . . 0.401 ' O ' ' HB3' ' A' ' 36' ' ' ALA . 36.2 t80 -85.77 -18.83 31.88 Favored 'General case' 0 N--CA 1.48 1.034 0 CA-C-N 115.068 -0.969 . . . . 73.31 111.582 -179.29 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . 0.451 ' HB3' ' HA ' ' A' ' 30' ' ' LYS . 27.8 t-20 -84.6 -63.24 1.37 Allowed 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 115.585 -0.734 . . . . 63.33 109.971 174.965 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 20.3 m -80.45 -51.46 8.79 Favored 'General case' 0 N--CA 1.487 1.409 0 CA-C-N 115.258 -0.883 . . . . 70.35 111.379 -166.539 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -70.21 -38.64 75.34 Favored 'General case' 0 N--CA 1.481 1.097 0 N-CA-C 111.613 0.227 . . . . 63.15 111.613 -178.281 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . 0.401 ' HB3' ' O ' ' A' ' 32' ' ' TYR . . . -69.82 -41.11 75.42 Favored 'General case' 0 N--CA 1.482 1.17 0 N-CA-C 111.425 0.157 . . . . 74.45 111.425 -179.07 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 68.0 m -67.38 -28.76 68.2 Favored 'General case' 0 N--CA 1.487 1.377 0 C-N-CA 122.45 0.3 . . . . 73.13 111.807 172.776 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 43.0 t -72.14 -37.88 69.34 Favored 'General case' 0 N--CA 1.484 1.256 0 C-N-CA 122.69 0.396 . . . . 54.32 111.128 176.399 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 33.1 m-20 -62.85 -49.05 76.42 Favored 'General case' 0 CA--C 1.544 0.72 0 C-N-CA 123.253 0.621 . . . . 75.24 111.084 170.013 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 73.5 mt -66.56 -32.69 74.2 Favored 'General case' 0 N--CA 1.487 1.405 0 C-N-CA 122.473 0.309 . . . . 62.53 111.066 -176.139 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 33.7 ttm180 -73.08 -47.68 42.42 Favored 'General case' 0 CA--C 1.537 0.444 0 C-N-CA 123.353 0.661 . . . . 74.1 110.016 177.871 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 66.2 t30 -62.71 -33.51 75.27 Favored 'General case' 0 N--CA 1.484 1.271 0 CA-C-N 115.436 -0.802 . . . . 75.31 112.162 179.748 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 91.7 mt -79.57 -37.8 35.56 Favored 'General case' 0 N--CA 1.481 1.1 0 C-N-CA 123.0 0.52 . . . . 72.21 110.717 179.938 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . 0.457 ' O ' ' HG2' ' A' ' 48' ' ' GLU . 0.8 OUTLIER -74.31 -43.54 56.33 Favored 'General case' 0 N--CA 1.476 0.845 0 N-CA-C 109.645 -0.502 . . . . 63.43 109.645 -176.077 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 3.0 t -65.82 -31.12 71.91 Favored 'General case' 0 N--CA 1.483 1.201 0 C-N-CA 123.428 0.691 . . . . 71.25 110.916 178.141 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -69.36 -31.92 70.65 Favored 'General case' 0 N--CA 1.479 1.001 0 CA-C-N 115.209 -0.905 . . . . 72.32 111.477 173.605 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 97.9 mt -67.45 -50.35 59.58 Favored 'General case' 0 N--CA 1.483 1.212 0 C-N-CA 122.768 0.427 . . . . 65.12 110.779 170.842 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . 0.457 ' HG2' ' O ' ' A' ' 44' ' ' LYS . 5.7 mm-40 -60.76 -35.05 75.44 Favored 'General case' 0 N--CA 1.493 1.702 0 C-N-CA 122.954 0.502 . . . . 73.25 110.797 -179.438 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 37.9 t -67.41 -58.77 4.16 Favored 'General case' 0 CA--C 1.54 0.583 0 CA-C-N 115.457 -0.792 . . . . 74.23 110.499 175.272 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . 0.462 ' O ' ' HB3' ' A' ' 54' ' ' ASP . . . -60.85 -38.13 84.46 Favored 'General case' 0 N--CA 1.487 1.415 0 C-N-CA 123.813 0.845 . . . . 74.1 112.17 -172.03 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 51' ' ' PHE . . . . . . . . . . . . . 2.7 m-85 -70.76 -35.64 72.72 Favored 'General case' 0 CA--C 1.542 0.65 0 CA-C-N 115.061 -0.972 . . . . 73.32 110.366 178.968 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -76.16 -51.8 11.39 Favored 'General case' 0 N--CA 1.48 1.053 0 N-CA-C 111.929 0.344 . . . . 55.1 111.929 -175.692 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 2.6 p30 -82.27 -38.07 24.96 Favored 'General case' 0 N--CA 1.482 1.137 0 N-CA-C 113.052 0.76 . . . . 54.41 113.052 -171.753 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . 0.462 ' HB3' ' O ' ' A' ' 50' ' ' ALA . 19.3 t70 -78.69 -74.04 0.3 Allowed 'General case' 0 N--CA 1.484 1.236 0 C-N-CA 122.911 0.484 . . . . 53.12 111.043 -178.397 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 23.5 pt20 -85.26 4.36 35.2 Favored 'General case' 0 N--CA 1.494 1.73 0 N-CA-C 113.291 0.849 . . . . 73.12 113.291 -174.302 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 6.7 m 65.37 28.21 11.78 Favored 'General case' 0 N--CA 1.494 1.742 0 C-N-CA 124.296 1.038 . . . . 74.11 112.158 171.52 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 44.8 t80 -103.18 92.39 3.76 Favored Pre-proline 0 N--CA 1.491 1.594 0 C-N-CA 123.975 0.91 . . . . 71.21 110.625 171.286 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 81.3 Cg_endo -84.6 139.35 7.7 Favored 'Trans proline' 0 CA--C 1.563 1.926 0 C-N-CA 122.398 2.065 . . . . 64.31 112.519 174.341 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 20.2 Cg_exo -65.37 94.45 0.25 Allowed 'Trans proline' 0 C--N 1.377 2.029 0 C-N-CA 122.969 2.446 . . . . 72.33 112.648 179.224 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 43.6 mt-10 55.46 28.38 11.57 Favored 'General case' 0 N--CA 1.494 1.759 0 C-N-CA 124.6 1.16 . . . . 75.35 113.738 176.721 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 33.9 t . . . . . 0 N--CA 1.494 1.727 0 C-N-CA 123.137 0.575 . . . . 71.23 111.566 -174.113 . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 1' ' ' PHE . . . . . . . . . . . . . 94.6 m-85 . . . . . 0 N--CA 1.492 1.641 0 N-CA-C 111.748 0.277 . . . . 75.21 111.748 . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 2' ' ' THR . . . . . 0.412 HG22 ' H ' ' A' ' 5' ' ' GLU . 4.1 t -116.01 142.85 46.24 Favored 'General case' 0 N--CA 1.488 1.449 0 C-N-CA 123.269 0.627 . . . . 73.14 110.982 -178.501 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 4.6 pp -63.36 -18.18 63.38 Favored 'General case' 0 N--CA 1.481 1.078 0 C-N-CA 123.942 0.897 . . . . 74.13 111.391 177.423 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 50.2 mm -64.06 -54.68 28.4 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.807 0 C-N-CA 123.436 0.695 . . . . 75.12 110.325 174.702 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . 0.412 ' H ' HG22 ' A' ' 2' ' ' THR . 42.7 mm-40 -66.84 -29.84 69.87 Favored 'General case' 0 N--CA 1.481 1.087 0 C-N-CA 122.958 0.503 . . . . 63.13 112.113 178.476 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 95.0 mt -67.62 -42.1 82.92 Favored 'General case' 0 N--CA 1.481 1.122 0 C-N-CA 122.966 0.507 . . . . 64.24 111.403 174.068 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -60.69 -50.37 73.76 Favored 'General case' 0 CA--C 1.555 1.172 0 C-N-CA 123.817 0.847 . . . . 65.35 109.962 176.283 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 96.5 mt -63.79 -46.37 94.61 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.869 0 C-N-CA 124.207 1.003 . . . . 55.02 112.603 -178.749 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 6.4 p -65.37 -38.83 83.49 Favored 'Isoleucine or valine' 0 CA--C 1.551 1.011 0 C-N-CA 122.694 0.398 . . . . 73.44 111.181 -178.482 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 8.9 t -66.12 -37.41 79.7 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.083 0 C-N-CA 123.403 0.681 . . . . 64.12 111.578 172.485 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -66.27 -51.68 55.05 Favored 'General case' 0 N--CA 1.48 1.031 0 C-N-CA 123.02 0.528 . . . . 51.43 111.546 -179.066 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 12' ' ' ILE . . . . . 0.532 ' HA ' HD11 ' A' ' 15' ' ' ILE . 20.8 pt -67.49 -44.71 86.5 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.935 0 C-N-CA 123.231 0.613 . . . . 73.23 111.823 -176.878 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 82.4 mt -64.37 -32.67 58.59 Favored 'Isoleucine or valine' 0 C--N 1.361 1.099 0 C-N-CA 123.614 0.766 . . . . 73.15 110.427 174.35 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -61.77 -36.95 93.5 Favored Glycine 0 C--N 1.349 1.291 0 CA-C-N 115.558 -0.746 . . . . 63.14 112.914 175.169 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . 0.532 HD11 ' HA ' ' A' ' 12' ' ' ILE . 22.9 mt -70.76 -42.91 77.62 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.904 0 C-N-CA 123.852 0.861 . . . . 74.52 110.705 175.343 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . 0.497 ' HG ' ' O ' ' A' ' 12' ' ' ILE . 28.6 mt -60.99 -38.36 85.71 Favored 'General case' 0 N--CA 1.482 1.137 0 C-N-CA 123.361 0.664 . . . . 63.23 111.256 -179.948 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -74.36 -48.32 28.8 Favored 'General case' 0 CA--C 1.55 0.966 0 C-N-CA 123.218 0.607 . . . . 72.41 110.754 176.251 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -57.74 -22.83 48.85 Favored 'General case' 0 N--CA 1.487 1.379 0 N-CA-C 113.602 0.964 . . . . 61.14 113.602 -179.287 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 2.8 pp -94.79 -35.56 6.22 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.218 0 N-CA-C 112.07 0.396 . . . . 73.2 112.07 171.687 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -66.71 -46.66 74.83 Favored 'General case' 0 N--CA 1.484 1.275 0 C-N-CA 123.381 0.673 . . . . 74.25 112.471 -172.586 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 2.2 mp -61.78 -53.67 58.35 Favored Pre-proline 0 CA--C 1.574 1.881 0 CA-C-O 118.739 -0.648 . . . . 75.14 112.533 -177.053 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 34.3 Cg_endo -64.53 -37.53 37.58 Favored 'Trans proline' 0 C--N 1.384 2.411 0 C-N-CA 122.256 1.97 . . . . 74.21 113.523 175.013 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 26.0 tt0 -64.98 -38.89 92.45 Favored 'General case' 0 N--CA 1.487 1.381 0 C-N-CA 123.196 0.598 . . . . 50.23 110.502 -178.098 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 24' ' ' PHE . . . . . . . . . . . . . 72.8 t80 -81.99 -34.28 29.74 Favored 'General case' 0 N--CA 1.487 1.393 0 CA-C-N 114.998 -1.001 . . . . 72.05 110.291 -176.068 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 25' ' ' SER . . . . . 0.494 ' O ' HG22 ' A' ' 29' ' ' VAL . 48.4 t -53.76 -59.21 4.92 Favored 'General case' 0 N--CA 1.478 0.97 0 C-N-CA 123.108 0.563 . . . . 64.34 109.868 168.866 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -65.18 -21.32 66.75 Favored 'General case' 0 N--CA 1.482 1.132 0 C-N-CA 124.319 1.047 . . . . 72.2 112.784 179.302 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 57.4 t80 -72.37 -45.02 61.66 Favored 'General case' 0 N--CA 1.483 1.188 0 C-N-CA 123.06 0.544 . . . . 74.24 111.076 174.911 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 27.8 mmm180 -70.2 -25.86 63.61 Favored 'General case' 0 N--CA 1.482 1.153 0 C-N-CA 123.545 0.738 . . . . 73.32 110.334 176.366 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . 0.494 HG22 ' O ' ' A' ' 25' ' ' SER . 91.1 t -69.5 -48.02 68.81 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.152 0 CA-C-N 115.75 -0.659 . . . . 75.15 109.41 172.359 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . 0.498 ' O ' ' HB3' ' A' ' 34' ' ' SER . 55.9 mttp -66.44 -21.28 66.2 Favored 'General case' 0 N--CA 1.488 1.455 0 C-N-CA 123.293 0.637 . . . . 72.41 112.297 175.799 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -68.1 -53.05 28.23 Favored 'General case' 0 N--CA 1.473 0.685 0 O-C-N 121.893 -0.504 . . . . 75.11 109.685 171.719 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 62.9 t80 -69.2 -64.08 0.94 Allowed 'General case' 0 C--O 1.219 -0.53 0 CA-C-N 115.274 -0.875 . . . . 74.34 111.235 -177.435 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 2.8 m-20 -56.91 -55.43 34.69 Favored 'General case' 0 N--CA 1.482 1.137 0 C-N-CA 125.213 1.405 . . . . 61.42 113.518 -177.414 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 34' ' ' SER . . . . . 0.498 ' HB3' ' O ' ' A' ' 30' ' ' LYS . 44.1 t -73.76 -44.62 55.58 Favored 'General case' 0 N--CA 1.493 1.712 0 N-CA-C 111.685 0.254 . . . . 52.41 111.685 -170.486 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -68.18 -30.3 69.37 Favored 'General case' 0 N--CA 1.479 1.008 0 CA-C-O 119.596 -0.24 . . . . 71.1 111.445 176.856 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -64.48 -46.92 80.95 Favored 'General case' 0 N--CA 1.494 1.76 0 N-CA-C 111.908 0.336 . . . . 74.4 111.908 170.529 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 71.1 m -63.62 -41.94 98.24 Favored 'General case' 0 N--CA 1.489 1.504 0 C-N-CA 123.374 0.67 . . . . 72.1 111.742 -179.562 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 80.9 p -77.64 -26.45 50.47 Favored 'General case' 0 N--CA 1.48 1.043 0 C-N-CA 123.441 0.696 . . . . 74.14 111.638 -179.211 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 31.2 t70 -62.48 -51.62 66.74 Favored 'General case' 0 N--CA 1.479 0.998 0 C-N-CA 123.17 0.588 . . . . 55.34 110.011 169.265 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 95.3 mt -64.14 -36.92 85.61 Favored 'General case' 0 N--CA 1.479 1.004 0 CA-C-N 115.498 -0.774 . . . . 73.55 110.859 -178.266 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 20.6 tpt85 -66.98 -44.15 81.17 Favored 'General case' 0 CA--C 1.547 0.83 0 C-N-CA 123.788 0.835 . . . . 74.44 110.475 176.647 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 63.5 t30 -66.94 -35.46 80.04 Favored 'General case' 0 N--CA 1.482 1.132 0 C-N-CA 123.762 0.825 . . . . 74.31 111.591 179.739 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 92.2 mt -72.71 -36.9 67.91 Favored 'General case' 0 N--CA 1.482 1.171 0 C-N-CA 123.135 0.574 . . . . 73.13 110.18 177.665 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 23.2 tptm -73.59 -41.65 62.6 Favored 'General case' 0 CA--C 1.538 0.505 0 CA-C-O 121.383 0.611 . . . . 73.21 110.077 -174.18 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 5.1 t -73.62 -32.58 64.13 Favored 'General case' 0 CA--C 1.547 0.846 0 CA-C-N 115.899 -0.592 . . . . 71.13 111.876 -177.419 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -79.96 -60.67 2.25 Favored 'General case' 0 N--CA 1.482 1.169 0 C-N-CA 123.383 0.673 . . . . 74.22 111.938 179.889 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -65.14 -44.31 89.03 Favored 'General case' 0 N--CA 1.479 1.02 0 C-N-CA 123.038 0.535 . . . . 72.34 112.034 -175.616 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 56.8 mm-40 -73.9 -16.31 61.11 Favored 'General case' 0 N--CA 1.485 1.324 0 CA-C-N 118.215 0.462 . . . . 74.32 112.12 -177.837 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 36.8 t -71.13 -36.25 72.04 Favored 'General case' 0 N--CA 1.485 1.298 0 CA-C-O 121.048 0.451 . . . . 75.01 110.058 168.88 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -69.86 -40.66 75.62 Favored 'General case' 0 N--CA 1.48 1.03 0 C-N-CA 123.756 0.823 . . . . 70.53 111.152 178.681 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 51' ' ' PHE . . . . . 0.452 ' O ' ' HG2' ' A' ' 55' ' ' GLN . 60.5 m-85 -71.0 -41.96 70.24 Favored 'General case' 0 N--CA 1.478 0.967 0 CA-C-N 115.863 -0.608 . . . . 74.4 110.358 176.217 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -76.68 -0.11 22.34 Favored 'General case' 0 N--CA 1.495 1.783 0 C-N-CA 123.166 0.586 . . . . 70.43 112.344 -179.279 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 23.0 t70 -70.0 -48.05 59.7 Favored 'General case' 0 CA--C 1.553 1.08 0 C-N-CA 123.267 0.627 . . . . 75.13 110.236 170.201 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 9.5 m-20 -87.41 -62.18 1.56 Allowed 'General case' 0 N--CA 1.483 1.198 0 C-N-CA 123.579 0.752 . . . . 73.43 111.701 -176.218 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . 0.452 ' HG2' ' O ' ' A' ' 51' ' ' PHE . 10.2 pt20 -73.97 -16.79 61.07 Favored 'General case' 0 N--CA 1.49 1.574 0 C-N-CA 123.068 0.547 . . . . 41.42 112.368 -175.732 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 21.3 m 75.9 -45.42 0.53 Allowed 'General case' 0 N--CA 1.496 1.835 0 C-N-CA 125.734 1.613 . . . . 72.25 112.423 -177.718 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 75.4 t80 -67.43 118.84 60.58 Favored Pre-proline 0 CA--C 1.559 1.323 0 C-N-CA 124.758 1.223 . . . . 73.15 112.52 -179.48 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 59.0 Cg_endo -89.52 169.08 4.88 Favored 'Trans proline' 0 CA--C 1.562 1.921 0 C-N-CA 122.811 2.341 . . . . 70.22 110.821 162.822 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 21.8 Cg_exo -68.26 15.02 0.16 Allowed 'Trans proline' 0 N--CA 1.509 2.417 0 C-N-CA 122.729 2.286 . . . . 73.43 115.419 179.766 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 28.9 tt0 64.21 -75.39 0.04 OUTLIER 'General case' 0 CA--C 1.554 1.1 0 C-N-CA 125.76 1.624 . . . . 73.42 111.715 -176.583 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 32.3 t . . . . . 0 CA--C 1.563 1.452 0 CA-C-O 118.128 -0.939 . . . . 73.25 110.146 172.517 . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 1' ' ' PHE . . . . . . . . . . . . . 30.4 p90 . . . . . 0 N--CA 1.48 1.048 0 N-CA-C 111.712 0.264 . . . . 73.01 111.712 . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 2' ' ' THR . . . . . 0.422 HG22 ' H ' ' A' ' 5' ' ' GLU . 5.7 t -113.63 149.22 34.9 Favored 'General case' 0 N--CA 1.488 1.443 0 CA-C-O 121.207 0.527 . . . . 65.43 111.732 -175.222 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . 0.457 HD13 HD13 ' A' ' 6' ' ' LEU . 3.2 mm? -68.8 -17.99 64.11 Favored 'General case' 0 N--CA 1.479 0.995 0 CA-C-N 115.038 -0.983 . . . . 70.21 111.028 175.913 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 50.4 mm -65.05 -51.21 69.22 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.216 0 C-N-CA 123.194 0.598 . . . . 63.1 110.572 176.886 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . 0.422 ' H ' HG22 ' A' ' 2' ' ' THR . 18.9 mm-40 -62.76 -41.09 99.06 Favored 'General case' 0 N--CA 1.481 1.097 0 C-N-CA 123.001 0.52 . . . . 75.42 111.689 177.725 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . 0.457 HD13 HD13 ' A' ' 3' ' ' LEU . 90.9 mt -62.54 -37.33 85.69 Favored 'General case' 0 N--CA 1.489 1.524 0 C-N-CA 123.051 0.541 . . . . 73.41 111.96 174.182 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 34.4 tp -64.75 -41.15 96.13 Favored 'General case' 0 N--CA 1.476 0.861 0 C-N-CA 123.817 0.847 . . . . 51.4 111.736 178.504 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 93.4 mt -69.47 -43.81 80.44 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.768 0 C-N-CA 123.654 0.781 . . . . 74.21 111.226 178.333 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 82.9 t -61.92 -47.25 94.11 Favored 'Isoleucine or valine' 0 CA--C 1.556 1.18 0 C-N-CA 122.976 0.511 . . . . 65.3 111.465 176.041 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 2.5 p -68.07 -29.44 44.66 Favored 'Isoleucine or valine' 0 CA--C 1.556 1.179 0 C-N-CA 122.572 0.349 . . . . 74.11 111.6 179.656 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -70.75 -53.63 14.79 Favored 'General case' 0 C--N 1.365 1.258 0 C-N-CA 122.698 0.399 . . . . 70.1 111.164 177.558 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 12' ' ' ILE . . . . . 0.517 ' O ' ' HG ' ' A' ' 16' ' ' LEU . 21.4 pt -63.83 -42.14 94.87 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.101 0 C-N-CA 123.168 0.587 . . . . 65.32 111.794 -176.554 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 65.7 mt -66.08 -32.76 59.55 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.047 0 C-N-CA 123.697 0.799 . . . . 74.14 110.275 173.809 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -63.75 -32.78 85.32 Favored Glycine 0 C--N 1.351 1.412 0 CA-C-N 116.029 -0.532 . . . . 37.25 113.179 172.23 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 18.8 mm -72.55 -44.91 60.39 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.202 0 N-CA-C 109.216 -0.661 . . . . 73.34 109.216 175.116 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . 0.517 ' HG ' ' O ' ' A' ' 12' ' ' ILE . 26.3 mt -59.77 -36.09 75.95 Favored 'General case' 0 N--CA 1.484 1.25 0 C-N-CA 123.655 0.782 . . . . 61.43 111.257 -179.316 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -70.62 -51.96 24.59 Favored 'General case' 0 N--CA 1.476 0.872 0 C-N-CA 123.232 0.613 . . . . 62.43 110.808 174.48 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -61.84 -22.9 65.9 Favored 'General case' 0 N--CA 1.481 1.095 0 N-CA-C 113.618 0.97 . . . . 72.12 113.618 -176.635 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 2.8 pp -92.4 -38.87 10.76 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.292 0 N-CA-C 111.835 0.309 . . . . 74.01 111.835 173.907 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -67.86 -43.39 79.55 Favored 'General case' 0 N--CA 1.485 1.323 0 N-CA-C 112.726 0.639 . . . . 72.43 112.726 -173.613 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 27.9 mt -61.06 -52.83 69.1 Favored Pre-proline 0 CA--C 1.563 1.454 0 CA-C-O 118.09 -0.957 . . . . 64.45 113.194 -177.071 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 46.2 Cg_endo -67.39 -35.78 22.58 Favored 'Trans proline' 0 C--N 1.377 2.077 0 CA-C-N 121.521 1.579 . . . . 74.41 112.956 173.765 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 29.3 tt0 -69.84 -31.08 68.75 Favored 'General case' 0 N--CA 1.483 1.201 0 CA-C-O 121.13 0.49 . . . . 63.52 111.106 -177.067 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 24' ' ' PHE . . . . . . . . . . . . . 16.4 t80 -95.22 -30.61 13.91 Favored 'General case' 0 N--CA 1.491 1.58 0 CA-C-N 115.796 -0.638 . . . . 74.41 110.781 -176.668 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 25' ' ' SER . . . . . 0.419 ' O ' HG22 ' A' ' 29' ' ' VAL . 41.6 t -57.02 -56.88 16.07 Favored 'General case' 0 N--CA 1.486 1.337 0 N-CA-C 109.87 -0.418 . . . . 70.22 109.87 165.446 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -67.26 -17.55 64.84 Favored 'General case' 0 N--CA 1.486 1.362 0 C-N-CA 123.965 0.906 . . . . 65.32 112.843 177.996 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 93.2 t80 -67.01 -46.71 73.69 Favored 'General case' 0 N--CA 1.485 1.306 0 C-N-CA 123.286 0.634 . . . . 74.31 110.273 171.422 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 39.9 mtt180 -70.91 -29.64 65.75 Favored 'General case' 0 N--CA 1.478 0.966 0 CA-C-N 115.716 -0.675 . . . . 71.34 110.591 177.225 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . 0.419 HG22 ' O ' ' A' ' 25' ' ' SER . 73.2 t -67.65 -54.08 26.09 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.409 0 CA-C-N 116.033 -0.53 . . . . 71.33 110.398 177.4 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 12.4 ptmm? -68.96 -21.45 64.18 Favored 'General case' 0 N--CA 1.479 0.999 0 CA-C-N 115.659 -0.701 . . . . 74.1 110.803 177.645 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -69.1 -39.27 79.08 Favored 'General case' 0 N--CA 1.482 1.171 0 O-C-N 121.931 -0.481 . . . . 75.52 110.114 173.551 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 92.9 t80 -66.42 -43.72 84.9 Favored 'General case' 0 N--CA 1.474 0.727 0 CA-C-N 115.539 -0.755 . . . . 74.14 111.769 -179.552 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 22.3 m120 -83.87 -45.83 12.81 Favored 'General case' 0 N--CA 1.476 0.851 0 C-N-CA 123.627 0.771 . . . . 64.24 112.701 -175.233 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 30.3 t -77.6 -47.01 20.43 Favored 'General case' 0 N--CA 1.494 1.739 0 N-CA-C 111.49 0.182 . . . . 65.32 111.49 -171.506 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -62.28 -35.51 79.23 Favored 'General case' 0 N--CA 1.481 1.077 0 C-N-CA 122.473 0.309 . . . . 72.35 111.203 174.915 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -63.01 -49.89 72.88 Favored 'General case' 0 N--CA 1.486 1.343 0 O-C-N 123.418 0.449 . . . . 75.21 111.619 175.348 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 71.2 m -57.1 -38.68 73.74 Favored 'General case' 0 N--CA 1.491 1.59 0 C-N-CA 122.871 0.468 . . . . 71.03 112.2 -178.688 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 33.5 t -85.96 -31.59 22.0 Favored 'General case' 0 N--CA 1.487 1.397 0 C-N-CA 123.625 0.77 . . . . 61.24 112.648 -177.619 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 38.8 t70 -70.07 -44.61 68.77 Favored 'General case' 0 N--CA 1.48 1.052 0 CA-C-O 120.846 0.355 . . . . 71.11 110.616 176.406 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 97.0 mt -71.99 -27.53 62.81 Favored 'General case' 0 N--CA 1.475 0.79 0 CA-C-N 115.702 -0.681 . . . . 71.13 110.242 -178.732 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 20.5 tpp180 -71.63 -43.13 66.68 Favored 'General case' 0 N--CA 1.475 0.787 0 C-N-CA 123.604 0.762 . . . . 70.43 110.483 173.319 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 58.2 t30 -61.66 -44.07 97.65 Favored 'General case' 0 N--CA 1.486 1.335 0 C-N-CA 124.076 0.95 . . . . 72.55 111.944 177.218 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 94.6 mt -75.15 -33.11 61.48 Favored 'General case' 0 N--CA 1.479 1.001 0 CA-C-N 115.923 -0.581 . . . . 75.21 111.142 -179.05 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . 0.412 ' O ' ' HG2' ' A' ' 48' ' ' GLU . 22.4 ttmm -71.44 -48.1 51.63 Favored 'General case' 0 N--CA 1.475 0.799 0 N-CA-C 109.747 -0.464 . . . . 75.24 109.747 179.789 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 3.4 t -61.76 -36.0 79.76 Favored 'General case' 0 N--CA 1.484 1.256 0 C-N-CA 123.025 0.53 . . . . 55.1 111.197 -176.354 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -63.71 -50.49 68.96 Favored 'General case' 0 N--CA 1.477 0.879 0 C-N-CA 123.586 0.754 . . . . 60.21 111.634 175.397 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 8.3 mp -66.91 -42.05 86.08 Favored 'General case' 0 N--CA 1.488 1.473 0 C-N-CA 123.503 0.721 . . . . 75.43 112.715 -179.024 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . 0.412 ' HG2' ' O ' ' A' ' 44' ' ' LYS . 36.9 mm-40 -67.85 -45.8 73.57 Favored 'General case' 0 N--CA 1.477 0.886 0 C-N-CA 123.363 0.665 . . . . 73.01 110.755 -178.596 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 62.3 m -66.07 -37.16 85.11 Favored 'General case' 0 N--CA 1.482 1.165 0 C-N-CA 122.626 0.37 . . . . 74.52 111.599 179.439 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -68.02 -49.63 60.31 Favored 'General case' 0 N--CA 1.489 1.512 0 C-N-CA 123.264 0.626 . . . . 73.21 112.135 179.113 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 51' ' ' PHE . . . . . . . . . . . . . 28.9 t80 -72.44 -28.81 63.17 Favored 'General case' 0 N--CA 1.484 1.263 0 C-N-CA 123.491 0.717 . . . . 72.12 111.563 -176.948 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -91.26 -11.65 37.51 Favored 'General case' 0 N--CA 1.488 1.461 0 C-N-CA 123.286 0.634 . . . . 54.2 112.208 177.997 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 18.2 t70 -62.66 -50.49 70.98 Favored 'General case' 0 N--CA 1.484 1.246 0 C-N-CA 123.223 0.609 . . . . 74.43 109.93 175.846 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 35.0 t70 -136.82 99.68 4.1 Favored 'General case' 0 CA--C 1.551 0.992 0 CA-C-N 115.319 -0.855 . . . . 70.32 109.156 174.882 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 22.1 tt0 -124.34 24.06 8.12 Favored 'General case' 0 N--CA 1.487 1.389 0 C-N-CA 124.203 1.001 . . . . 61.23 109.731 -178.12 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 69.1 p -79.5 -5.96 55.94 Favored 'General case' 0 N--CA 1.485 1.305 0 C-N-CA 124.125 0.97 . . . . 74.4 113.106 -175.466 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 12.2 p90 -64.79 131.94 95.3 Favored Pre-proline 0 CA--C 1.563 1.477 0 C-N-CA 123.254 0.622 . . . . 73.54 110.866 179.037 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 23.8 Cg_exo -67.02 166.69 22.07 Favored 'Trans proline' 0 CA--C 1.565 2.037 0 C-N-CA 122.938 2.425 . . . . 64.31 112.779 173.323 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 36.3 Cg_endo -62.76 -1.99 3.13 Favored 'Trans proline' 0 C--N 1.387 2.566 0 C-N-CA 122.868 2.378 . . . . 74.43 114.849 174.612 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 45.2 mt-10 64.11 41.76 6.08 Favored 'General case' 0 N--CA 1.491 1.607 0 C-N-CA 125.081 1.352 . . . . 72.22 112.237 173.962 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 23.6 m . . . . . 0 N--CA 1.495 1.815 0 C-N-CA 125.514 1.526 . . . . 61.4 112.121 178.514 . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 1' ' ' PHE . . . . . . . . . . . . . 59.5 m-85 . . . . . 0 N--CA 1.485 1.322 0 CA-C-O 120.61 0.243 . . . . 73.12 110.707 . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 2' ' ' THR . . . . . 0.559 HG21 ' H ' ' A' ' 4' ' ' ILE . 36.7 m -108.13 134.7 50.64 Favored 'General case' 0 N--CA 1.484 1.226 0 C-N-CA 123.85 0.86 . . . . 70.24 110.93 -178.926 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 2.5 pt? -61.22 -17.46 53.36 Favored 'General case' 0 N--CA 1.49 1.57 0 C-N-CA 124.123 0.969 . . . . 75.01 113.202 179.175 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . 0.559 ' H ' HG21 ' A' ' 2' ' ' THR . 50.6 mm -86.17 -45.05 16.88 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.735 0 C-N-CA 123.369 0.668 . . . . 60.11 110.322 179.461 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 20.1 mm-40 -64.16 -33.77 76.55 Favored 'General case' 0 N--CA 1.481 1.08 0 C-N-CA 123.304 0.642 . . . . 72.21 111.799 -179.812 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 3.5 pp -70.07 -34.0 72.64 Favored 'General case' 0 N--CA 1.477 0.921 0 O-C-N 123.156 0.285 . . . . 63.41 111.332 174.245 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -67.7 -37.69 82.63 Favored 'General case' 0 CA--C 1.561 1.398 0 C-N-CA 123.814 0.846 . . . . 74.12 110.904 176.759 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 87.4 mt -70.39 -49.37 54.09 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.707 0 C-N-CA 123.292 0.637 . . . . 73.31 111.99 178.996 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 9.7 p -64.52 -39.66 86.36 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.901 0 C-N-CA 122.684 0.394 . . . . 74.33 111.789 -179.527 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 2.0 p -67.28 -30.0 47.71 Favored 'Isoleucine or valine' 0 CA--C 1.56 1.351 0 C-N-CA 122.435 0.294 . . . . 72.23 111.3 175.697 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -69.15 -52.76 24.89 Favored 'General case' 0 N--CA 1.483 1.219 0 C-N-CA 122.652 0.381 . . . . 54.13 111.583 177.533 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 12' ' ' ILE . . . . . 0.513 ' O ' ' HG ' ' A' ' 16' ' ' LEU . 21.3 pt -62.54 -41.5 92.24 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.967 0 C-N-CA 122.723 0.409 . . . . 71.13 111.46 -179.117 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 56.0 mt -62.15 -36.21 73.09 Favored 'Isoleucine or valine' 0 C--N 1.362 1.139 0 C-N-CA 124.277 1.031 . . . . 75.22 111.097 174.382 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -58.13 -36.43 81.94 Favored Glycine 0 C--N 1.355 1.596 0 O-C-N 123.553 0.533 . . . . 74.41 113.198 174.856 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 1.7 mp -75.98 -42.81 39.12 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.877 0 C-N-CA 123.06 0.544 . . . . 72.41 109.995 175.768 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . 0.513 ' HG ' ' O ' ' A' ' 12' ' ' ILE . 37.9 mt -59.52 -36.59 76.4 Favored 'General case' 0 N--CA 1.489 1.488 0 C-N-CA 122.975 0.51 . . . . 74.45 112.006 -176.623 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -73.73 -52.43 13.23 Favored 'General case' 0 CA--C 1.546 0.826 0 C-N-CA 122.738 0.415 . . . . 62.02 110.228 175.143 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -53.87 -30.05 44.08 Favored 'General case' 0 N--CA 1.488 1.431 0 C-N-CA 124.226 1.01 . . . . 71.11 113.444 -178.168 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 19' ' ' ILE . . . . . 0.517 ' O ' ' HB3' ' A' ' 23' ' ' GLN . 2.8 pp -88.47 -35.94 8.55 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.297 0 N-CA-C 112.177 0.436 . . . . 73.04 112.177 175.501 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -71.74 -42.98 66.62 Favored 'General case' 0 N--CA 1.481 1.092 0 N-CA-C 112.872 0.693 . . . . 72.31 112.872 -170.985 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 1.9 mp -57.07 -54.13 57.83 Favored Pre-proline 0 CA--C 1.567 1.624 0 CA-C-O 118.723 -0.656 . . . . 64.53 111.591 -178.286 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 36.3 Cg_endo -64.72 -39.64 25.77 Favored 'Trans proline' 0 C--N 1.386 2.515 0 C-N-CA 121.493 1.462 . . . . 75.15 113.441 173.226 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 23' ' ' GLN . . . . . 0.517 ' HB3' ' O ' ' A' ' 19' ' ' ILE . 0.1 OUTLIER -64.94 -29.88 70.85 Favored 'General case' 0 N--CA 1.496 1.841 0 C-N-CA 122.77 0.428 . . . . 75.53 110.685 -175.669 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 24' ' ' PHE . . . . . . . . . . . . . 73.7 t80 -96.59 -37.94 10.17 Favored 'General case' 0 N--CA 1.485 1.276 0 CA-C-N 115.533 -0.758 . . . . 74.34 111.135 -173.61 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 25' ' ' SER . . . . . 0.427 ' O ' HG22 ' A' ' 29' ' ' VAL . 46.2 t -61.09 -57.51 12.25 Favored 'General case' 0 N--CA 1.477 0.884 0 N-CA-C 109.167 -0.679 . . . . 60.43 109.167 174.524 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -63.34 -22.02 66.62 Favored 'General case' 0 N--CA 1.482 1.159 0 C-N-CA 123.632 0.773 . . . . 64.23 112.658 177.275 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 27' ' ' TYR . . . . . 0.425 ' HB2' ' O ' ' A' ' 23' ' ' GLN . 75.7 t80 -67.23 -48.73 66.93 Favored 'General case' 0 N--CA 1.489 1.497 0 CA-C-O 121.278 0.561 . . . . 74.35 110.502 173.488 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 74.4 mtp180 -73.28 -27.27 61.46 Favored 'General case' 0 N--CA 1.472 0.643 0 CA-C-N 115.612 -0.722 . . . . 74.2 111.617 178.26 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . 0.427 HG22 ' O ' ' A' ' 25' ' ' SER . 55.5 t -73.62 -42.65 55.29 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.4 0 O-C-N 123.347 0.404 . . . . 74.3 110.494 178.636 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . 0.425 ' HG2' ' O ' ' A' ' 27' ' ' TYR . 11.7 ptmm? -68.59 -30.32 69.05 Favored 'General case' 0 N--CA 1.476 0.869 0 CA-C-N 116.311 -0.404 . . . . 74.11 110.147 177.29 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -80.09 -34.83 37.66 Favored 'General case' 0 N--CA 1.482 1.138 0 C-N-CA 122.903 0.481 . . . . 74.1 110.837 -179.3 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 39.8 t80 -72.26 -21.56 61.35 Favored 'General case' 0 N--CA 1.485 1.291 0 C-N-CA 123.544 0.738 . . . . 75.52 110.922 -179.282 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 2.9 m-20 -94.49 -45.72 7.3 Favored 'General case' 0 N--CA 1.478 0.929 0 C-N-CA 123.872 0.869 . . . . 75.11 111.658 175.025 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 42.4 t -65.33 -55.33 18.82 Favored 'General case' 0 N--CA 1.495 1.817 0 C-N-CA 122.835 0.454 . . . . 61.14 111.75 -176.63 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -62.23 -39.29 92.31 Favored 'General case' 0 N--CA 1.474 0.747 0 CA-C-N 115.954 -0.566 . . . . 61.22 111.578 179.152 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -61.29 -60.57 3.54 Favored 'General case' 0 N--CA 1.485 1.318 0 C-N-CA 123.158 0.583 . . . . 61.23 111.569 178.695 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 37.7 t -53.26 -50.54 64.62 Favored 'General case' 0 N--CA 1.479 1.007 0 C-N-CA 123.937 0.895 . . . . 63.1 111.913 -179.713 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 30.5 t -72.01 -29.8 64.56 Favored 'General case' 0 N--CA 1.478 0.952 0 N-CA-C 112.621 0.6 . . . . 74.22 112.621 -175.967 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 37.0 t70 -63.93 -49.73 71.44 Favored 'General case' 0 N--CA 1.484 1.245 0 C-N-CA 122.64 0.376 . . . . 74.45 111.075 172.69 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 88.3 mt -67.78 -35.48 78.75 Favored 'General case' 0 N--CA 1.481 1.118 0 CA-C-N 115.622 -0.717 . . . . 74.43 110.782 -174.981 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 99.6 mtt180 -70.66 -42.24 71.03 Favored 'General case' 0 N--CA 1.48 1.064 0 CA-C-N 115.054 -0.976 . . . . 73.44 110.681 175.363 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 65.2 t30 -64.75 -36.13 83.31 Favored 'General case' 0 N--CA 1.489 1.516 0 C-N-CA 123.462 0.705 . . . . 43.35 111.671 179.774 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . 0.432 ' O ' HD13 ' A' ' 47' ' ' LEU . 93.6 mt -76.64 -34.77 58.28 Favored 'General case' 0 N--CA 1.478 0.97 0 C-N-CA 122.976 0.511 . . . . 71.51 110.974 179.632 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 79.4 tttt -70.98 -48.29 54.13 Favored 'General case' 0 N--CA 1.472 0.658 0 N-CA-C 109.822 -0.436 . . . . 64.41 109.822 -178.396 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 6.2 t -65.47 -31.76 73.01 Favored 'General case' 0 N--CA 1.478 0.973 0 C-N-CA 123.863 0.865 . . . . 75.41 111.674 -177.481 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -61.63 -46.48 89.62 Favored 'General case' 0 N--CA 1.481 1.121 0 C-N-CA 124.024 0.93 . . . . 64.44 111.243 172.149 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 47' ' ' LEU . . . . . 0.432 HD13 ' O ' ' A' ' 43' ' ' LEU . 8.4 mp -66.92 -39.15 87.3 Favored 'General case' 0 N--CA 1.479 1.002 0 CA-C-N 115.622 -0.717 . . . . 72.22 111.675 176.326 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 49.8 mt-10 -66.95 -38.2 85.7 Favored 'General case' 0 N--CA 1.484 1.247 0 C-N-CA 122.872 0.469 . . . . 61.14 111.147 179.647 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 34.2 t -69.04 -27.61 65.81 Favored 'General case' 0 N--CA 1.479 1.011 0 C-N-CA 123.509 0.723 . . . . 53.41 111.145 175.393 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -74.83 -53.58 8.86 Favored 'General case' 0 N--CA 1.477 0.881 0 C-N-CA 123.283 0.633 . . . . 62.51 110.341 178.057 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 51' ' ' PHE . . . . . . . . . . . . . 57.9 m-85 -72.46 -14.52 61.7 Favored 'General case' 0 N--CA 1.487 1.377 0 C-N-CA 123.961 0.905 . . . . 63.5 112.466 -177.404 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -67.67 -19.11 65.14 Favored 'General case' 0 N--CA 1.486 1.357 0 C-N-CA 123.455 0.702 . . . . 73.22 111.731 172.31 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 20.5 t70 -78.41 -27.34 46.64 Favored 'General case' 0 CA--C 1.558 1.253 0 C-N-CA 123.548 0.739 . . . . 62.44 110.871 174.232 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 36.6 t70 65.63 91.41 0.08 Allowed 'General case' 0 CA--C 1.558 1.27 0 C-N-CA 125.397 1.479 . . . . 74.12 111.338 -176.112 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -89.94 -25.43 20.93 Favored 'General case' 0 N--CA 1.485 1.285 0 C-N-CA 123.904 0.882 . . . . 70.32 111.424 -176.406 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 47.4 p -122.27 78.16 1.47 Allowed 'General case' 0 N--CA 1.481 1.108 0 C-N-CA 123.517 0.727 . . . . 73.11 110.739 -179.444 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 48.4 p90 -65.98 143.85 98.59 Favored Pre-proline 0 N--CA 1.489 1.489 0 CA-C-N 115.71 -0.677 . . . . 74.34 111.088 175.163 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 70.3 Cg_endo -72.63 130.94 16.58 Favored 'Trans proline' 0 CA--C 1.566 2.082 0 C-N-CA 121.529 1.486 . . . . 75.44 111.775 175.149 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 16.3 Cg_exo -71.01 -179.43 3.47 Favored 'Trans proline' 0 C--N 1.376 2.011 0 C-N-CA 122.963 2.442 . . . . 73.45 112.913 174.132 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 31.2 mm-40 -62.65 129.93 42.75 Favored 'General case' 0 N--CA 1.483 1.2 0 C-N-CA 123.175 0.59 . . . . 54.32 111.826 179.906 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 39.4 t . . . . . 0 C--O 1.254 1.315 0 C-N-CA 123.866 0.866 . . . . 50.2 110.24 -179.465 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 2' ' ' THR . . . . . 0.57 HG23 ' H ' ' A' ' 5' ' ' GLU . 7.2 t . . . . . 0 N--CA 1.492 1.659 0 CA-C-O 121.179 0.514 . . . . 73.510000000000005 111.834 . . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 3' ' ' LEU . . . . . 0.577 HD13 HD12 ' A' ' 6' ' ' LEU . 4.3 mm? -61.23 -22.72 65.06 Favored 'General case' 0 N--CA 1.482 1.139 0 CA-C-N 115.743 -0.662 . . . . 72.299999999999997 111.147 174.802 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 1.5 mp -62.14 -45.73 98.08 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.427 0 C-N-CA 123.596 0.758 . . . . 54.539999999999999 110.474 177.338 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 5' ' ' GLU . . . . . 0.57 ' H ' HG23 ' A' ' 2' ' ' THR . 14.4 mm-40 -56.23 -47.32 78.7 Favored 'General case' 0 N--CA 1.484 1.244 0 C-N-CA 123.021 0.528 . . . . 74.140000000000001 111.422 174.856 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 6' ' ' LEU . . . . . 0.577 HD12 HD13 ' A' ' 3' ' ' LEU . 85.5 mt -64.08 -41.66 97.24 Favored 'General case' 0 N--CA 1.478 0.953 0 C-N-CA 123.436 0.694 . . . . 75.430000000000007 111.956 -179.759 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 90.9 mt -61.75 -45.43 93.94 Favored 'General case' 0 N--CA 1.48 1.067 0 C-N-CA 123.174 0.589 . . . . 73.209999999999994 111.82 177.672 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 87.1 mt -63.77 -47.94 88.73 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.801 0 C-N-CA 123.324 0.65 . . . . 63.210000000000001 112.235 176.998 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 50.3 t -62.01 -44.57 99.13 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.834 0 C-N-CA 123.38 0.672 . . . . 71.25 111.379 -178.953 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 40.2 t -67.82 -31.64 53.07 Favored 'Isoleucine or valine' 0 CA--C 1.555 1.173 0 C-N-CA 123.041 0.536 . . . . 54.119999999999997 111.355 176.427 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -68.5 -58.91 3.6 Favored 'General case' 0 N--CA 1.481 1.086 0 C-N-CA 122.44 0.296 . . . . 62.530000000000001 111.274 177.855 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 12' ' ' ILE . . . . . 0.545 ' O ' ' HG ' ' A' ' 16' ' ' LEU . 20.9 pt -60.58 -49.21 85.32 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.955 0 C-N-CA 123.464 0.706 . . . . 43.329999999999998 111.83 -176.387 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 71.3 mt -68.47 -30.41 47.4 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.934 0 C-N-CA 123.613 0.765 . . . . 73.209999999999994 110.665 178.994 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -61.04 -36.39 92.24 Favored Glycine 0 C--N 1.351 1.369 0 CA-C-N 115.938 -0.574 . . . . 42.539999999999999 112.968 175.256 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 17.4 mt -75.79 -45.92 36.9 Favored 'Isoleucine or valine' 0 C--N 1.354 0.795 0 C-N-CA 123.289 0.636 . . . . 62.520000000000003 110.11 176.194 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 16' ' ' LEU . . . . . 0.545 ' HG ' ' O ' ' A' ' 12' ' ' ILE . 36.5 mt -55.17 -43.25 74.13 Favored 'General case' 0 N--CA 1.485 1.294 0 O-C-N 124.055 0.847 . . . . 70.409999999999997 111.501 -178.81 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -75.1 -49.81 18.42 Favored 'General case' 0 N--CA 1.476 0.861 0 C-N-CA 123.071 0.548 . . . . 61.109999999999999 111.33 -177.857 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -55.28 -30.18 59.64 Favored 'General case' 0 N--CA 1.482 1.148 0 C-N-CA 123.665 0.786 . . . . 74.109999999999999 112.921 -178.037 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 2.8 pp -89.1 -37.52 10.11 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.974 0 N-CA-C 112.155 0.428 . . . . 71.230000000000004 112.155 173.624 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -65.96 -53.04 44.12 Favored 'General case' 0 N--CA 1.487 1.388 0 N-CA-C 113.052 0.76 . . . . 64.239999999999995 113.052 -171.093 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 2.4 mp -54.64 -56.3 28.65 Favored Pre-proline 0 CA--C 1.566 1.562 0 CA-C-O 118.629 -0.7 . . . . 72.299999999999997 112.494 -174.759 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 37.2 Cg_endo -65.31 -41.05 17.05 Favored 'Trans proline' 0 C--N 1.38 2.224 0 C-N-CA 121.576 1.517 . . . . 70.239999999999995 113.493 177.624 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 28.2 tt0 -63.87 -36.47 84.04 Favored 'General case' 0 N--CA 1.488 1.464 0 C-N-CA 123.369 0.668 . . . . 71.040000000000006 111.098 -176.13 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 24' ' ' PHE . . . . . . . . . . . . . 37.5 t80 -88.33 -36.24 16.74 Favored 'General case' 0 N--CA 1.485 1.31 0 CA-C-N 114.837 -1.074 . . . . 55.439999999999998 111.023 -174.84 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 31.3 t -60.3 -51.18 70.65 Favored 'General case' 0 N--CA 1.478 0.943 0 C-N-CA 122.991 0.517 . . . . 75.430000000000007 110.411 173.612 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -69.99 -21.29 63.24 Favored 'General case' 0 CA--C 1.551 0.998 0 CA-C-N 115.486 -0.779 . . . . 74.150000000000006 112.644 176.789 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 79.7 t80 -71.19 -48.47 51.41 Favored 'General case' 0 N--CA 1.488 1.427 0 C-N-CA 122.686 0.395 . . . . 54.409999999999997 110.995 175.361 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 73.5 mtp180 -67.62 -27.14 66.64 Favored 'General case' 0 N--CA 1.477 0.886 0 C-N-CA 123.015 0.526 . . . . 72.030000000000001 111.106 177.62 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 24.0 t -71.17 -49.03 51.37 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.892 0 CA-C-N 115.694 -0.685 . . . . 45.049999999999997 110.69 174.214 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 18.9 ptmt -70.73 -22.39 62.43 Favored 'General case' 0 N--CA 1.476 0.861 0 CA-C-O 119.427 -0.32 . . . . 71.109999999999999 111.024 -179.099 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -78.19 -36.57 47.21 Favored 'General case' 0 N--CA 1.48 1.052 0 CA-C-O 120.909 0.385 . . . . 72.409999999999997 110.132 176.501 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 88.6 t80 -63.76 -43.87 95.13 Favored 'General case' 0 C--O 1.218 -0.559 0 CA-C-N 115.059 -0.973 . . . . 75.400000000000006 109.935 174.652 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 82.5 m-20 -80.0 -31.82 39.72 Favored 'General case' 0 N--CA 1.484 1.247 0 C-N-CA 124.075 0.95 . . . . 70.409999999999997 112.608 -176.667 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 39.7 t -66.01 -51.56 57.19 Favored 'General case' 0 N--CA 1.492 1.662 0 C-N-CA 122.521 0.329 . . . . 64.549999999999997 110.235 173.907 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -65.91 -38.52 88.93 Favored 'General case' 0 CA--C 1.541 0.596 0 CA-C-N 115.596 -0.729 . . . . 53.149999999999999 111.706 177.505 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -61.95 -53.56 53.97 Favored 'General case' 0 N--CA 1.497 1.921 0 N-CA-C 112.3 0.481 . . . . 73.5 112.3 177.169 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 44.1 t -61.15 -49.48 77.07 Favored 'General case' 0 N--CA 1.483 1.186 0 C-N-CA 122.855 0.462 . . . . 52.530000000000001 111.282 179.466 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 64.4 m -66.4 -27.67 68.03 Favored 'General case' 0 N--CA 1.483 1.189 0 C-N-CA 123.312 0.645 . . . . 72.200000000000003 112.681 -178.621 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 32.1 t70 -63.17 -47.2 83.68 Favored 'General case' 0 N--CA 1.483 1.221 0 CA-C-O 121.336 0.589 . . . . 74.239999999999995 110.815 170.027 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 90.9 mt -74.28 -22.48 59.27 Favored 'General case' 0 N--CA 1.481 1.106 0 CA-C-N 115.274 -0.875 . . . . 74.230000000000004 112.188 -178.042 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 61.6 mtp180 -83.99 -60.8 1.99 Allowed 'General case' 0 N--CA 1.479 1.006 0 C-N-CA 123.457 0.703 . . . . 74.299999999999997 111.488 177.194 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 7.3 t30 -61.16 -38.46 86.54 Favored 'General case' 0 N--CA 1.483 1.223 0 C-N-CA 123.916 0.886 . . . . 61.109999999999999 112.988 -171.038 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 83.9 mt -78.22 -31.95 49.63 Favored 'General case' 0 N--CA 1.486 1.336 0 N-CA-C 111.654 0.242 . . . . 74.239999999999995 111.654 -178.99 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 40.6 ttmt -76.05 -44.96 36.68 Favored 'General case' 0 N--CA 1.474 0.76 0 C-N-CA 122.844 0.457 . . . . 45.43 110.519 -177.286 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 5.8 t -66.77 -32.84 74.4 Favored 'General case' 0 N--CA 1.478 0.951 0 CA-C-N 115.305 -0.861 . . . . 73.319999999999993 110.853 -179.736 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -67.2 -40.19 86.45 Favored 'General case' 0 N--CA 1.475 0.819 0 CA-C-N 114.98 -1.009 . . . . 74.030000000000001 111.557 172.964 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 8.0 tt -64.58 -47.01 80.27 Favored 'General case' 0 N--CA 1.482 1.14 0 C-N-CA 123.724 0.81 . . . . 70.200000000000003 110.465 176.218 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 40.3 mt-10 -65.55 -30.58 71.35 Favored 'General case' 0 N--CA 1.479 1.02 0 C-N-CA 123.54 0.736 . . . . 73.420000000000002 111.523 -179.444 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 23.5 t -81.01 -39.15 26.33 Favored 'General case' 0 N--CA 1.479 0.975 0 C-N-CA 123.012 0.525 . . . . 70.230000000000004 111.591 179.122 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -74.44 -36.72 63.39 Favored 'General case' 0 N--CA 1.486 1.344 0 C-N-CA 123.33 0.652 . . . . 71.019999999999996 111.724 -175.272 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 51' ' ' PHE . . . . . . . . . . . . . 88.4 m-85 . . . . . 0 N--CA 1.479 1.015 0 C-N-CA 124.044 0.938 . . . . 72.430000000000007 110.671 177.983 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 2.7 t . . . . . 0 N--CA 1.48 1.068 0 N-CA-C 110.207 -0.294 . . . . 74.019999999999996 110.207 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 83.1 mt -55.57 -25.24 37.05 Favored 'General case' 0 N--CA 1.482 1.173 0 C-N-CA 124.11 0.964 . . . . 73.340000000000003 112.168 -179.173 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 49.0 mm -64.72 -58.42 7.22 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.767 0 O-C-N 124.007 0.817 . . . . 62.350000000000001 110.798 178.733 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 18.3 mm-40 -67.95 -37.9 82.15 Favored 'General case' 0 N--CA 1.478 0.951 0 N-CA-C 111.912 0.338 . . . . 60.109999999999999 111.912 -176.359 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 70.6 mt -62.42 -41.6 98.81 Favored 'General case' 0 N--CA 1.485 1.296 0 C-N-CA 123.152 0.581 . . . . 63.210000000000001 111.973 176.249 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 37.6 tp -66.35 -39.45 89.2 Favored 'General case' 0 CA--C 1.549 0.939 0 C-N-CA 123.252 0.621 . . . . 62.109999999999999 111.82 178.165 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 83.4 mt -67.85 -44.03 85.66 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.873 0 C-N-CA 122.843 0.457 . . . . 75.010000000000005 111.789 176.957 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 53.6 t -60.44 -47.84 90.9 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.974 0 C-N-CA 123.157 0.583 . . . . 55.409999999999997 111.76 177.028 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 4.0 p -66.9 -29.24 45.64 Favored 'Isoleucine or valine' 0 CA--C 1.561 1.383 0 N-CA-C 111.636 0.235 . . . . 63.109999999999999 111.636 178.021 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -71.93 -51.8 20.34 Favored 'General case' 0 N--CA 1.483 1.177 0 C-N-CA 123.074 0.55 . . . . 62.450000000000003 111.899 178.515 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 12' ' ' ILE . . . . . 0.555 ' HA ' HD12 ' A' ' 15' ' ' ILE . 27.3 pt -64.69 -46.26 92.81 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.921 0 C-N-CA 123.141 0.577 . . . . 71.430000000000007 111.273 -175.805 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 81.9 mt -64.67 -29.31 47.0 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.093 0 C-N-CA 123.72 0.808 . . . . 75.200000000000003 110.642 176.405 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -61.26 -39.68 97.54 Favored Glycine 0 C--N 1.354 1.553 0 CA-C-N 116.0 -0.546 . . . . 44.32 112.843 172.515 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 15' ' ' ILE . . . . . 0.555 HD12 ' HA ' ' A' ' 12' ' ' ILE . 16.3 mt -73.38 -44.94 53.8 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.914 0 C-N-CA 123.618 0.767 . . . . 72.239999999999995 110.807 176.644 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 16' ' ' LEU . . . . . 0.52 ' HG ' ' O ' ' A' ' 12' ' ' ILE . 24.9 mt -59.06 -36.81 75.69 Favored 'General case' 0 N--CA 1.485 1.309 0 C-N-CA 123.4 0.68 . . . . 75.030000000000001 111.249 -177.315 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -70.53 -54.3 12.72 Favored 'General case' 0 CA--C 1.548 0.883 0 C-N-CA 123.131 0.572 . . . . 74.230000000000004 110.253 174.518 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -57.92 -21.35 43.26 Favored 'General case' 0 N--CA 1.48 1.035 0 N-CA-C 114.066 1.136 . . . . 51.340000000000003 114.066 -177.46 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 2.7 pp -97.54 -36.23 5.88 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.06 0 N-CA-C 112.283 0.475 . . . . 73.0 112.283 174.202 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -69.65 -45.87 67.44 Favored 'General case' 0 N--CA 1.49 1.538 0 N-CA-C 112.639 0.607 . . . . 74.010000000000005 112.639 -172.519 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 2.3 mp -57.93 -55.02 49.49 Favored Pre-proline 0 CA--C 1.571 1.759 0 CA-C-O 118.619 -0.705 . . . . 72.219999999999999 112.298 -179.177 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 55.6 Cg_endo -68.51 -34.98 18.68 Favored 'Trans proline' 0 C--N 1.383 2.382 0 C-N-CA 122.277 1.984 . . . . 74.099999999999994 114.025 177.538 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 26.5 tt0 -64.75 -36.93 85.89 Favored 'General case' 0 N--CA 1.49 1.568 0 CA-C-O 121.455 0.645 . . . . 71.150000000000006 110.274 -179.143 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 24' ' ' PHE . . . . . . . . . . . . . 58.4 t80 -86.55 -35.22 19.65 Favored 'General case' 0 N--CA 1.484 1.245 0 CA-C-N 114.636 -1.165 . . . . 75.129999999999995 110.763 -175.477 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 25' ' ' SER . . . . . 0.446 ' O ' HG23 ' A' ' 29' ' ' VAL . 44.5 t -56.89 -55.28 36.52 Favored 'General case' 0 N--CA 1.478 0.93 0 C-N-CA 123.225 0.61 . . . . 74.420000000000002 110.319 169.985 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -61.65 -30.46 70.73 Favored 'General case' 0 N--CA 1.484 1.249 0 C-N-CA 124.26 1.024 . . . . 64.420000000000002 112.483 177.252 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 69.0 t80 -64.15 -51.69 62.66 Favored 'General case' 0 N--CA 1.478 0.926 0 C-N-CA 122.816 0.446 . . . . 71.430000000000007 110.154 175.342 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 28' ' ' ARG . . . . . 0.418 ' O ' ' HB2' ' A' ' 32' ' ' TYR . 80.7 mtp180 -67.49 -25.25 65.77 Favored 'General case' 0 N--CA 1.476 0.861 0 CA-C-N 115.429 -0.805 . . . . 74.530000000000001 111.796 179.709 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 29' ' ' VAL . . . . . 0.446 HG23 ' O ' ' A' ' 25' ' ' SER . 41.9 t -68.19 -54.49 21.71 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.393 0 O-C-N 123.43 0.456 . . . . 63.100000000000001 110.459 176.55 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.17 -24.38 64.06 Favored 'General case' 0 N--CA 1.478 0.926 0 CA-C-N 115.725 -0.671 . . . . 74.409999999999997 111.097 179.099 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -80.8 -31.39 35.68 Favored 'General case' 0 N--CA 1.484 1.24 0 C-N-CA 122.925 0.49 . . . . 70.239999999999995 110.783 -179.884 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 32' ' ' TYR . . . . . 0.418 ' HB2' ' O ' ' A' ' 28' ' ' ARG . 4.9 t80 -74.27 -19.19 60.58 Favored 'General case' 0 N--CA 1.484 1.268 0 C-N-CA 123.181 0.592 . . . . 71.439999999999998 110.372 177.897 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 17.9 m120 -91.94 -52.76 4.57 Favored 'General case' 0 N--CA 1.473 0.707 0 C-N-CA 123.721 0.808 . . . . 63.229999999999997 110.86 175.063 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 44.0 t -65.43 -59.37 4.08 Favored 'General case' 0 N--CA 1.484 1.259 0 C-N-CA 123.313 0.645 . . . . 65.340000000000003 111.683 -174.096 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -61.58 -40.54 95.14 Favored 'General case' 0 N--CA 1.479 0.977 0 N-CA-C 112.135 0.42 . . . . 74.420000000000002 112.135 -179.09 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -64.18 -46.42 84.06 Favored 'General case' 0 N--CA 1.485 1.294 0 C-N-CA 122.427 0.291 . . . . 62.240000000000002 111.015 -178.201 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 73.0 m -65.14 -44.01 90.01 Favored 'General case' 0 N--CA 1.476 0.839 0 CA-C-N 116.184 -0.462 . . . . 73.439999999999998 111.663 175.659 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 64.1 m -72.23 -35.36 68.84 Favored 'General case' 0 N--CA 1.484 1.256 0 N-CA-C 113.06 0.763 . . . . 72.239999999999995 113.06 -171.535 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 17.4 m-20 -64.1 -51.42 64.1 Favored 'General case' 0 N--CA 1.476 0.86 0 O-C-N 123.474 0.484 . . . . 63.450000000000003 110.339 170.53 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -64.24 -32.47 74.07 Favored 'General case' 0 N--CA 1.483 1.21 0 C-N-CA 123.021 0.529 . . . . 50.0 111.95 -176.115 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 88.6 mtm180 -79.78 -38.12 33.82 Favored 'General case' 0 N--CA 1.486 1.366 0 C-N-CA 122.787 0.435 . . . . 72.310000000000002 110.787 178.712 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 62.4 t30 -64.55 -35.91 82.51 Favored 'General case' 0 N--CA 1.49 1.536 0 C-N-CA 122.967 0.507 . . . . 72.519999999999996 111.192 175.425 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 96.2 mt -78.02 -35.99 49.22 Favored 'General case' 0 N--CA 1.48 1.043 0 C-N-CA 123.402 0.681 . . . . 74.450000000000003 110.985 179.058 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 6.2 tmmm? -72.02 -43.77 64.47 Favored 'General case' 0 N--CA 1.478 0.962 0 C-N-CA 122.74 0.416 . . . . 74.109999999999999 110.177 -177.955 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 2.0 t -67.22 -30.92 70.97 Favored 'General case' 0 N--CA 1.479 0.984 0 C-N-CA 123.781 0.832 . . . . 62.509999999999998 111.569 -179.892 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -63.59 -53.18 55.68 Favored 'General case' 0 N--CA 1.478 0.969 0 CA-C-N 115.37 -0.832 . . . . 61.409999999999997 111.038 173.817 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 10.8 mp -68.61 -27.02 65.66 Favored 'General case' 0 N--CA 1.487 1.418 0 C-N-CA 123.432 0.693 . . . . 74.230000000000004 112.111 177.297 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 9.5 tp10 -69.89 -51.44 33.13 Favored 'General case' 0 C--N 1.35 0.624 0 C-N-CA 124.348 1.059 . . . . 53.509999999999998 110.365 179.142 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 47.1 t -62.83 -36.58 83.67 Favored 'General case' 0 N--CA 1.481 1.092 0 C-N-CA 124.091 0.956 . . . . 65.349999999999994 111.756 177.207 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -61.97 -50.56 71.61 Favored 'General case' 0 N--CA 1.479 1.006 0 C-N-CA 123.638 0.775 . . . . 64.120000000000005 111.798 177.919 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 51' ' ' PHE . . . . . . . . . . . . . 32.5 t80 . . . . . 0 CA--C 1.56 1.331 0 C-N-CA 122.819 0.447 . . . . 73.409999999999997 111.348 178.552 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 2' ' ' THR . . . . . 0.544 HG23 ' H ' ' A' ' 5' ' ' GLU . 6.7 t . . . . . 0 N--CA 1.482 1.16 0 CA-C-O 121.236 0.541 . . . . 70.230000000000004 110.696 . . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 3' ' ' LEU . . . . . 0.468 ' HA ' HD12 ' A' ' 6' ' ' LEU . 9.2 mp -65.84 -17.43 64.64 Favored 'General case' 0 N--CA 1.478 0.958 0 CA-C-N 115.331 -0.849 . . . . 62.229999999999997 111.247 176.858 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 45.8 mm -67.86 -43.86 85.76 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.141 0 C-N-CA 123.136 0.574 . . . . 64.420000000000002 110.894 175.398 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 5' ' ' GLU . . . . . 0.544 ' H ' HG23 ' A' ' 2' ' ' THR . 25.6 mm-40 -58.86 -41.26 86.62 Favored 'General case' 0 N--CA 1.49 1.545 0 C-N-CA 123.089 0.555 . . . . 62.329999999999998 111.372 174.308 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 6' ' ' LEU . . . . . 0.468 HD12 ' HA ' ' A' ' 3' ' ' LEU . 71.5 mt -61.2 -47.48 85.95 Favored 'General case' 0 N--CA 1.482 1.134 0 C-N-CA 123.368 0.667 . . . . 72.519999999999996 111.223 175.13 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 60.4 tp -54.93 -42.94 72.88 Favored 'General case' 0 CA--C 1.554 1.104 0 C-N-CA 124.59 1.156 . . . . 74.239999999999995 112.238 176.305 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 94.8 mt -70.69 -40.54 77.07 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.091 0 C-N-CA 124.308 1.043 . . . . 73.310000000000002 111.993 178.88 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 46.1 t -62.52 -45.7 98.16 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.959 0 C-N-CA 123.325 0.65 . . . . 72.409999999999997 111.095 175.718 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 69.1 t -62.07 -36.79 76.16 Favored 'Isoleucine or valine' 0 CA--C 1.561 1.387 0 C-N-CA 123.281 0.633 . . . . 74.150000000000006 111.379 174.664 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -65.95 -51.6 57.12 Favored 'General case' 0 CA--C 1.553 1.081 0 C-N-CA 123.099 0.559 . . . . 73.329999999999998 112.276 178.688 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 12' ' ' ILE . . . . . 0.609 ' HA ' HD12 ' A' ' 15' ' ' ILE . 23.5 pt -68.41 -42.42 84.04 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.089 0 C-N-CA 123.159 0.584 . . . . 71.430000000000007 111.978 -175.199 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 79.3 mt -65.14 -32.68 59.34 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.028 0 C-N-CA 123.307 0.643 . . . . 75.030000000000001 110.51 174.807 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -60.82 -38.25 94.99 Favored Glycine 0 C--N 1.354 1.573 0 CA-C-N 115.831 -0.622 . . . . 71.439999999999998 112.833 174.992 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 15' ' ' ILE . . . . . 0.609 HD12 ' HA ' ' A' ' 12' ' ' ILE . 24.7 mt -69.87 -43.05 79.96 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.975 0 C-N-CA 123.877 0.871 . . . . 64.0 111.173 175.569 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 16' ' ' LEU . . . . . 0.492 ' HG ' ' O ' ' A' ' 12' ' ' ILE . 20.7 mt -63.95 -35.73 81.65 Favored 'General case' 0 N--CA 1.486 1.37 0 C-N-CA 122.969 0.508 . . . . 74.25 111.366 -178.766 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -73.24 -44.58 59.22 Favored 'General case' 0 N--CA 1.479 1.014 0 C-N-CA 123.216 0.606 . . . . 75.209999999999994 110.673 175.564 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -60.38 -28.56 68.31 Favored 'General case' 0 N--CA 1.483 1.209 0 C-N-CA 124.166 0.986 . . . . 55.299999999999997 113.267 -179.843 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 2.8 pp -89.75 -38.38 11.03 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.327 0 CA-C-N 118.101 0.41 . . . . 63.450000000000003 111.607 173.656 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -67.8 -54.42 19.22 Favored 'General case' 0 N--CA 1.487 1.386 0 N-CA-C 112.724 0.639 . . . . 63.43 112.724 -172.779 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 21.7 mt -53.07 -54.19 47.06 Favored Pre-proline 0 CA--C 1.566 1.576 0 N-CA-C 113.902 1.075 . . . . 73.150000000000006 113.902 -176.587 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 38.2 Cg_endo -65.66 -38.83 22.97 Favored 'Trans proline' 0 C--N 1.381 2.24 0 CA-C-N 121.636 1.62 . . . . 73.120000000000005 113.166 175.118 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 20.1 tt0 -62.98 -38.16 90.03 Favored 'General case' 0 N--CA 1.489 1.525 0 C-N-CA 123.462 0.705 . . . . 75.310000000000002 110.95 -177.102 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 24' ' ' PHE . . . . . . . . . . . . . 32.8 m-85 -91.9 -36.99 13.15 Favored 'General case' 0 N--CA 1.486 1.348 0 CA-C-N 115.046 -0.979 . . . . 72.409999999999997 111.746 -174.663 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 47.3 t -63.59 -46.75 84.41 Favored 'General case' 0 N--CA 1.492 1.639 0 CA-C-N 117.774 0.261 . . . . 70.140000000000001 111.189 173.777 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -67.14 -26.44 66.67 Favored 'General case' 0 N--CA 1.483 1.207 0 C-N-CA 122.909 0.484 . . . . 62.329999999999998 111.834 174.796 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 68.8 t80 -66.42 -55.15 17.14 Favored 'General case' 0 N--CA 1.485 1.284 0 C-N-CA 122.995 0.518 . . . . 74.439999999999998 111.131 178.897 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 35.6 ptt180 -65.45 -28.93 69.57 Favored 'General case' 0 N--CA 1.475 0.817 0 C-N-CA 123.473 0.709 . . . . 74.329999999999998 111.488 -175.841 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 78.6 t -77.35 -48.32 24.79 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.843 0 CA-C-N 115.976 -0.556 . . . . 63.030000000000001 110.422 179.085 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 15.1 pttp -67.79 -27.52 66.81 Favored 'General case' 0 N--CA 1.476 0.848 0 CA-C-N 116.171 -0.468 . . . . 72.400000000000006 110.557 178.709 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -81.28 -30.01 34.13 Favored 'General case' 0 C--N 1.366 1.292 0 N-CA-C 110.086 -0.339 . . . . 74.439999999999998 110.086 -179.798 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 62.2 t80 -62.75 -54.29 41.41 Favored 'General case' 0 C--N 1.352 0.7 0 CA-C-N 115.957 -0.565 . . . . 73.239999999999995 109.724 174.72 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 52.1 m-80 -69.35 -37.7 77.78 Favored 'General case' 0 N--CA 1.479 0.993 0 C-N-CA 123.637 0.775 . . . . 75.310000000000002 113.064 179.512 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 33.7 t -63.42 -55.89 20.65 Favored 'General case' 0 N--CA 1.498 1.953 0 CA-C-O 120.964 0.411 . . . . 34.210000000000001 111.502 178.734 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -68.12 -38.01 81.78 Favored 'General case' 0 CA--C 1.542 0.637 0 CA-C-N 115.435 -0.802 . . . . 74.129999999999995 112.027 -179.205 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -66.35 -52.79 43.42 Favored 'General case' 0 N--CA 1.499 1.983 0 N-CA-C 112.242 0.46 . . . . 62.439999999999998 112.242 179.735 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 50.7 m -58.16 -43.45 87.4 Favored 'General case' 0 N--CA 1.488 1.431 0 C-N-CA 123.1 0.56 . . . . 75.540000000000006 111.465 179.689 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 41.7 t -74.37 -32.08 62.62 Favored 'General case' 0 N--CA 1.481 1.121 0 CA-C-N 116.022 -0.535 . . . . 73.230000000000004 112.038 -179.275 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 24.1 t70 -59.09 -54.92 41.59 Favored 'General case' 0 N--CA 1.48 1.062 0 C-N-CA 122.926 0.49 . . . . 63.409999999999997 111.21 175.44 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 4.0 pp -75.4 -26.46 58.43 Favored 'General case' 0 N--CA 1.49 1.567 0 CA-C-N 116.125 -0.488 . . . . 74.129999999999995 111.455 -172.119 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 59.1 ttp180 -75.76 -40.99 54.41 Favored 'General case' 0 CA--C 1.545 0.785 0 C-N-CA 123.554 0.742 . . . . 75.030000000000001 110.87 175.788 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 64.1 t30 -67.62 -36.93 81.73 Favored 'General case' 0 N--CA 1.487 1.409 0 C-N-CA 123.301 0.641 . . . . 60.149999999999999 111.11 178.945 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 81.0 mt -73.3 -27.97 61.84 Favored 'General case' 0 N--CA 1.482 1.168 0 C-N-CA 122.891 0.476 . . . . 75.200000000000003 111.33 178.443 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 44' ' ' LYS . . . . . 0.463 ' HE3' ' HA ' ' A' ' 44' ' ' LYS . 0.1 OUTLIER -79.34 -44.72 21.01 Favored 'General case' 0 N--CA 1.469 0.506 0 C-N-CA 122.723 0.409 . . . . 61.340000000000003 110.215 -179.887 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 4.9 t -69.53 -34.43 74.24 Favored 'General case' 0 N--CA 1.48 1.033 0 O-C-N 123.715 0.634 . . . . 72.409999999999997 111.17 -177.637 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -69.1 -41.79 76.98 Favored 'General case' 0 N--CA 1.477 0.887 0 C-N-CA 123.718 0.807 . . . . 62.439999999999998 111.304 174.06 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 42.9 tp -66.32 -43.98 84.67 Favored 'General case' 0 N--CA 1.477 0.899 0 C-N-CA 123.481 0.712 . . . . 74.200000000000003 112.165 -179.78 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 12.9 pt-20 -74.05 -34.05 63.93 Favored 'General case' 0 N--CA 1.484 1.254 0 C-N-CA 122.798 0.439 . . . . 73.340000000000003 111.624 -177.199 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 79.4 p -72.32 -33.95 67.74 Favored 'General case' 0 N--CA 1.489 1.484 0 C-N-CA 122.725 0.41 . . . . 55.119999999999997 110.896 175.561 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -70.38 -41.91 72.44 Favored 'General case' 0 N--CA 1.479 0.986 0 CA-C-N 115.646 -0.706 . . . . 72.319999999999993 111.074 177.696 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 51' ' ' PHE . . . . . . . . . . . . . 69.7 t80 . . . . . 0 CA--C 1.553 1.059 0 C-N-CA 123.256 0.622 . . . . 74.439999999999998 110.67 179.998 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 55.1 m . . . . . 0 N--CA 1.476 0.845 0 N-CA-C 109.023 -0.732 . . . . 64.200000000000003 109.023 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 3' ' ' LEU . . . . . 0.506 HD13 HD12 ' A' ' 6' ' ' LEU . 3.3 mm? -62.27 -23.04 66.47 Favored 'General case' 0 N--CA 1.487 1.391 0 C-N-CA 123.192 0.597 . . . . 60.140000000000001 111.755 -177.594 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 47.8 mm -69.75 -49.37 58.42 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.118 0 C-N-CA 123.165 0.586 . . . . 72.319999999999993 110.475 171.397 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 40.8 mm-40 -59.35 -38.32 80.08 Favored 'General case' 0 N--CA 1.491 1.614 0 C-N-CA 123.337 0.655 . . . . 74.450000000000003 112.166 176.062 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 6' ' ' LEU . . . . . 0.506 HD12 HD13 ' A' ' 3' ' ' LEU . 78.6 mt -69.95 -39.75 75.84 Favored 'General case' 0 N--CA 1.48 1.033 0 C-N-CA 123.001 0.521 . . . . 72.450000000000003 111.31 176.883 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 2.1 tm? -60.01 -48.46 81.62 Favored 'General case' 0 CA--C 1.552 1.028 0 C-N-CA 123.632 0.773 . . . . 63.399999999999999 110.432 176.958 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 77.6 mt -68.84 -48.29 71.57 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.732 0 C-N-CA 123.997 0.919 . . . . 75.519999999999996 112.227 -177.568 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 7.1 p -60.57 -40.62 85.07 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.158 0 CA-C-N 118.22 0.463 . . . . 64.310000000000002 111.823 -178.29 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 54.0 t -67.16 -41.52 87.02 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.027 0 C-N-CA 123.328 0.651 . . . . 64.239999999999995 110.903 173.572 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -64.03 -52.43 59.5 Favored 'General case' 0 N--CA 1.484 1.242 0 C-N-CA 122.946 0.498 . . . . 63.350000000000001 111.987 -178.581 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 12' ' ' ILE . . . . . 0.51 ' O ' ' HG ' ' A' ' 16' ' ' LEU . 28.6 pt -64.09 -47.21 91.23 Favored 'Isoleucine or valine' 0 C--N 1.355 0.815 0 C-N-CA 123.362 0.665 . . . . 70.030000000000001 111.474 -175.817 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 79.0 mt -64.21 -31.04 51.8 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.054 0 C-N-CA 123.322 0.649 . . . . 63.039999999999999 110.443 177.929 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -65.26 -40.52 96.69 Favored Glycine 0 C--N 1.352 1.445 0 CA-C-N 115.714 -0.675 . . . . 74.140000000000001 112.9 174.084 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 22.4 mt -69.05 -44.77 80.91 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.052 0 C-N-CA 123.63 0.772 . . . . 61.030000000000001 110.833 175.382 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 16' ' ' LEU . . . . . 0.51 ' HG ' ' O ' ' A' ' 12' ' ' ILE . 16.3 mt -60.99 -37.14 81.44 Favored 'General case' 0 N--CA 1.48 1.047 0 C-N-CA 123.345 0.658 . . . . 72.340000000000003 111.043 -178.314 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -74.24 -49.33 23.73 Favored 'General case' 0 CA--C 1.551 1.002 0 C-N-CA 122.959 0.504 . . . . 74.329999999999998 110.944 176.352 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -55.82 -29.94 60.6 Favored 'General case' 0 N--CA 1.491 1.594 0 C-N-CA 124.017 0.927 . . . . 74.310000000000002 113.248 -178.787 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 2.8 pp -86.97 -37.66 11.44 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.833 0 CA-C-O 119.601 -0.237 . . . . 74.5 111.472 172.432 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -61.95 -53.98 48.06 Favored 'General case' 0 N--CA 1.487 1.411 0 C-N-CA 124.009 0.924 . . . . 75.120000000000005 113.274 -172.098 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 3.0 mp -56.46 -54.62 51.35 Favored Pre-proline 0 CA--C 1.572 1.817 0 CA-C-O 118.444 -0.789 . . . . 54.130000000000003 112.614 -175.094 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 36.7 Cg_endo -64.85 -39.33 26.0 Favored 'Trans proline' 0 C--N 1.381 2.268 0 C-N-CA 122.166 1.911 . . . . 75.219999999999999 113.305 176.385 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 38.5 tt0 -60.05 -43.55 95.3 Favored 'General case' 0 N--CA 1.489 1.512 0 C-N-CA 123.944 0.898 . . . . 65.510000000000005 110.523 -179.075 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 24' ' ' PHE . . . . . . . . . . . . . 16.0 m-85 -87.67 -28.28 21.92 Favored 'General case' 0 N--CA 1.485 1.324 0 CA-C-N 114.819 -1.082 . . . . 74.319999999999993 111.319 -172.281 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 74.3 m -59.62 -59.41 5.48 Favored 'General case' 0 N--CA 1.481 1.122 0 N-CA-C 109.549 -0.537 . . . . 74.219999999999999 109.549 167.264 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -62.0 -26.95 68.52 Favored 'General case' 0 N--CA 1.485 1.289 0 C-N-CA 124.02 0.928 . . . . 51.310000000000002 112.715 -179.714 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 27' ' ' TYR . . . . . 0.428 ' O ' ' HG2' ' A' ' 30' ' ' LYS . 57.3 t80 -70.03 -52.92 20.2 Favored 'General case' 0 N--CA 1.484 1.252 0 C-N-CA 123.476 0.71 . . . . 65.409999999999997 110.885 176.21 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 82.4 mtp180 -71.84 -20.68 61.79 Favored 'General case' 0 N--CA 1.475 0.81 0 CA-C-N 115.812 -0.631 . . . . 73.099999999999994 111.524 179.505 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 38.9 t -76.82 -44.51 32.68 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.445 0 C-N-CA 122.744 0.418 . . . . 64.209999999999994 110.397 174.996 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 30' ' ' LYS . . . . . 0.428 ' HG2' ' O ' ' A' ' 27' ' ' TYR . 17.1 ptmt -71.15 -26.79 63.14 Favored 'General case' 0 N--CA 1.479 1.001 0 O-C-N 123.391 0.432 . . . . 73.510000000000005 110.34 178.57 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -81.81 -32.88 31.07 Favored 'General case' 0 C--N 1.362 1.111 0 C-N-CA 123.059 0.544 . . . . 54.25 110.453 178.176 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 41.5 t80 -65.39 -46.23 80.89 Favored 'General case' 0 C--O 1.21 -0.996 0 N-CA-C 108.888 -0.782 . . . . 75.420000000000002 108.888 174.772 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 8.2 t30 -66.64 -45.07 80.22 Favored 'General case' 0 CA--C 1.547 0.832 0 C-N-CA 125.034 1.334 . . . . 74.400000000000006 111.982 177.294 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 42.4 t -63.99 -56.7 13.17 Favored 'General case' 0 N--CA 1.491 1.618 0 C-N-CA 123.27 0.628 . . . . 55.109999999999999 111.877 -179.094 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -65.91 -36.42 83.34 Favored 'General case' 0 N--CA 1.475 0.779 0 C-N-CA 123.139 0.576 . . . . 51.240000000000002 111.992 -179.248 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -69.47 -40.75 76.91 Favored 'General case' 0 N--CA 1.496 1.83 0 CA-C-N 117.764 0.256 . . . . 71.109999999999999 111.639 177.954 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 47.2 t -62.59 -44.58 95.96 Favored 'General case' 0 N--CA 1.484 1.242 0 C-N-CA 123.155 0.582 . . . . 72.219999999999999 110.816 175.375 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 70.9 m -71.04 -26.4 63.07 Favored 'General case' 0 N--CA 1.483 1.207 0 C-N-CA 122.942 0.497 . . . . 72.200000000000003 111.853 178.303 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 28.2 t70 -66.31 -51.17 60.05 Favored 'General case' 0 CA--C 1.551 0.993 0 C-N-CA 123.252 0.621 . . . . 73.140000000000001 110.416 172.929 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 4.0 pp -78.25 -18.34 55.48 Favored 'General case' 0 N--CA 1.49 1.569 0 N-CA-C 112.082 0.401 . . . . 63.439999999999998 112.082 -174.853 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 41' ' ' ARG . . . . . 0.413 ' HA ' ' HD3' ' A' ' 41' ' ' ARG . 26.9 mmt180 -84.13 -59.49 2.39 Favored 'General case' 0 N--CA 1.48 1.06 0 CA-C-O 118.93 -0.557 . . . . 74.530000000000001 112.113 172.695 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 49.5 t-20 -60.56 -42.6 96.95 Favored 'General case' 0 N--CA 1.497 1.887 0 C-N-CA 123.034 0.534 . . . . 62.350000000000001 111.824 -174.432 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 43' ' ' LEU . . . . . 0.439 ' O ' HD23 ' A' ' 47' ' ' LEU . 96.7 mt -75.08 -28.25 60.24 Favored 'General case' 0 N--CA 1.486 1.335 0 C-N-CA 122.43 0.292 . . . . 73.510000000000005 111.471 -175.312 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 29.4 ttpp -79.42 -48.1 14.56 Favored 'General case' 0 N--CA 1.474 0.765 0 N-CA-C 109.664 -0.495 . . . . 74.340000000000003 109.664 178.613 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 3.9 t -70.22 -27.21 64.29 Favored 'General case' 0 N--CA 1.487 1.424 0 C-N-CA 124.174 0.99 . . . . 71.109999999999999 112.071 -174.455 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -60.92 -50.77 72.08 Favored 'General case' 0 N--CA 1.478 0.97 0 O-C-N 123.74 0.65 . . . . 72.239999999999995 110.914 173.146 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 47' ' ' LEU . . . . . 0.439 HD23 ' O ' ' A' ' 43' ' ' LEU . 4.2 mm? -65.68 -36.16 82.84 Favored 'General case' 0 N--CA 1.487 1.41 0 C-N-CA 123.609 0.763 . . . . 73.510000000000005 111.569 175.98 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 48.7 mt-10 -68.04 -33.75 75.16 Favored 'General case' 0 N--CA 1.483 1.211 0 C-N-CA 122.968 0.507 . . . . 74.109999999999999 111.499 176.579 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 44.1 t -83.08 -23.16 33.22 Favored 'General case' 0 N--CA 1.485 1.302 0 C-N-CA 123.313 0.645 . . . . 43.329999999999998 111.84 177.736 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -79.0 -30.13 44.09 Favored 'General case' 0 N--CA 1.486 1.331 0 C-N-CA 123.6 0.76 . . . . 51.509999999999998 112.551 -175.268 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 51' ' ' PHE . . . . . . . . . . . . . 78.1 t80 . . . . . 0 N--CA 1.477 0.898 0 C-N-CA 123.434 0.694 . . . . 64.420000000000002 110.135 -177.966 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 31.4 p . . . . . 0 N--CA 1.483 1.201 0 CA-C-O 121.032 0.444 . . . . 72.010000000000005 111.822 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 3.3 mm? -64.63 -19.29 65.6 Favored 'General case' 0 N--CA 1.484 1.255 0 CA-C-N 115.574 -0.739 . . . . 62.399999999999999 111.05 171.931 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 49.6 mm -73.64 -48.57 39.93 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.026 0 C-N-CA 123.163 0.585 . . . . 54.030000000000001 110.668 178.878 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 47.1 mt-10 -56.64 -44.35 81.18 Favored 'General case' 0 N--CA 1.489 1.49 0 C-N-CA 123.396 0.679 . . . . 74.310000000000002 111.267 175.971 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 82.3 mt -59.18 -47.0 86.94 Favored 'General case' 0 N--CA 1.481 1.106 0 C-N-CA 123.439 0.696 . . . . 72.400000000000006 111.579 174.213 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 37.1 tp -56.7 -40.37 75.49 Favored 'General case' 0 CA--C 1.549 0.926 0 C-N-CA 123.454 0.701 . . . . 73.140000000000001 112.138 178.706 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 82.4 mt -66.52 -50.43 66.9 Favored 'Isoleucine or valine' 0 C--N 1.355 0.825 0 C-N-CA 123.972 0.909 . . . . 72.519999999999996 111.275 178.458 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 86.8 t -58.25 -44.11 87.31 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.974 0 C-N-CA 123.583 0.753 . . . . 75.030000000000001 111.343 179.18 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 70.0 t -67.07 -36.15 76.28 Favored 'Isoleucine or valine' 0 CA--C 1.554 1.121 0 C-N-CA 122.896 0.478 . . . . 75.239999999999995 111.695 176.429 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -67.18 -53.55 29.35 Favored 'General case' 0 N--CA 1.483 1.188 0 C-N-CA 122.607 0.363 . . . . 75.519999999999996 111.325 179.991 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 12' ' ' ILE . . . . . 0.628 HG13 HD12 ' A' ' 13' ' ' ILE . 33.4 pt -64.1 -48.4 86.0 Favored 'Isoleucine or valine' 0 CA--C 1.554 1.107 0 C-N-CA 123.439 0.696 . . . . 61.25 111.651 -175.829 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 13' ' ' ILE . . . . . 0.628 HD12 HG13 ' A' ' 12' ' ' ILE . 1.8 mp -64.84 -32.97 60.41 Favored 'Isoleucine or valine' 0 C--N 1.372 1.566 0 C-N-CA 123.066 0.546 . . . . 75.109999999999999 109.986 175.479 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -59.53 -37.63 92.44 Favored Glycine 0 C--N 1.352 1.424 0 O-C-N 123.578 0.549 . . . . 63.43 113.328 177.641 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 18.5 mt -72.12 -44.65 64.93 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.989 0 C-N-CA 123.372 0.669 . . . . 65.310000000000002 110.784 176.043 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 16' ' ' LEU . . . . . 0.521 ' HG ' ' O ' ' A' ' 12' ' ' ILE . 22.7 mt -59.63 -37.89 79.87 Favored 'General case' 0 N--CA 1.488 1.442 0 C-N-CA 123.428 0.691 . . . . 72.329999999999998 111.136 179.41 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -74.1 -48.7 27.9 Favored 'General case' 0 N--CA 1.474 0.754 0 C-N-CA 123.603 0.761 . . . . 52.520000000000003 110.918 178.498 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -56.41 -27.76 57.45 Favored 'General case' 0 N--CA 1.486 1.33 0 C-N-CA 123.91 0.884 . . . . 71.200000000000003 112.803 -178.176 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 2.8 pp -91.39 -37.92 9.82 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.175 0 N-CA-C 112.035 0.383 . . . . 64.230000000000004 112.035 172.89 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -66.93 -50.1 63.45 Favored 'General case' 0 N--CA 1.489 1.498 0 N-CA-C 113.141 0.793 . . . . 75.310000000000002 113.141 -171.089 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 2.5 mp -59.35 -54.24 58.11 Favored Pre-proline 0 CA--C 1.567 1.623 0 CA-C-O 118.534 -0.746 . . . . 74.239999999999995 112.509 -175.392 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 30.2 Cg_endo -63.44 -39.74 35.05 Favored 'Trans proline' 0 C--N 1.384 2.43 0 C-N-CA 121.921 1.747 . . . . 64.439999999999998 113.43 176.514 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 61.0 tt0 -64.88 -37.29 87.13 Favored 'General case' 0 N--CA 1.483 1.199 0 CA-C-N 115.366 -0.834 . . . . 75.299999999999997 110.566 -177.04 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 24' ' ' PHE . . . . . . . . . . . . . 71.6 t80 -83.05 -36.86 24.6 Favored 'General case' 0 N--CA 1.484 1.234 0 CA-C-N 114.701 -1.136 . . . . 73.340000000000003 110.898 -176.243 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 40.6 t -57.39 -44.69 84.71 Favored 'General case' 0 N--CA 1.48 1.053 0 C-N-CA 123.139 0.575 . . . . 53.009999999999998 110.941 172.108 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -72.57 -32.8 66.3 Favored 'General case' 0 N--CA 1.477 0.907 0 CA-C-N 115.878 -0.601 . . . . 64.340000000000003 111.873 176.077 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 76.5 t80 -68.48 -47.44 67.06 Favored 'General case' 0 N--CA 1.493 1.684 0 C-N-CA 124.135 0.974 . . . . 75.540000000000006 112.223 -176.437 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 10.4 ptm180 -75.2 -24.72 57.82 Favored 'General case' 0 N--CA 1.475 0.802 0 CA-C-N 115.303 -0.862 . . . . 64.299999999999997 110.914 -175.274 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 86.2 t -84.01 -34.14 9.84 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.555 0 CA-C-O 121.143 0.497 . . . . 51.310000000000002 109.966 175.851 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 30.0 tttt -61.77 -35.28 77.67 Favored 'General case' 0 CA--C 1.546 0.823 0 C-N-CA 123.703 0.801 . . . . 74.120000000000005 110.172 167.301 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -68.72 -39.45 80.4 Favored 'General case' 0 N--CA 1.48 1.07 0 C-N-CA 123.239 0.616 . . . . 31.32 110.724 178.111 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 76.0 t80 -59.16 -59.7 5.04 Favored 'General case' 0 C--O 1.212 -0.871 0 CA-C-N 115.714 -0.675 . . . . 75.400000000000006 110.084 173.908 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 3.9 m-20 -56.8 -44.15 81.66 Favored 'General case' 0 N--CA 1.486 1.325 0 C-N-CA 124.06 0.944 . . . . 73.439999999999998 113.128 -179.512 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 46.9 t -68.04 -57.16 6.59 Favored 'General case' 0 N--CA 1.487 1.401 0 C-N-CA 123.289 0.635 . . . . 64.400000000000006 110.842 -177.151 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -65.9 -36.14 82.57 Favored 'General case' 0 N--CA 1.48 1.037 0 N-CA-C 112.3 0.482 . . . . 72.230000000000004 112.3 -178.758 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -69.08 -47.83 64.26 Favored 'General case' 0 N--CA 1.495 1.803 0 N-CA-C 111.921 0.341 . . . . 51.32 111.921 179.175 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 67.3 m -69.23 -33.26 73.0 Favored 'General case' 0 N--CA 1.486 1.372 0 C-N-CA 122.62 0.368 . . . . 63.130000000000003 111.762 179.179 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 32.2 t -78.96 -26.14 43.51 Favored 'General case' 0 N--CA 1.486 1.342 0 C-N-CA 123.071 0.549 . . . . 42.520000000000003 111.339 178.284 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 27.1 t70 -67.63 -48.27 67.21 Favored 'General case' 0 N--CA 1.476 0.865 0 C-N-CA 123.146 0.578 . . . . 74.010000000000005 110.123 169.165 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 92.2 mt -67.13 -30.97 71.11 Favored 'General case' 0 N--CA 1.483 1.193 0 C-N-CA 123.144 0.578 . . . . 64.329999999999998 110.974 -179.497 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 50.1 ttm-85 -71.78 -45.79 60.45 Favored 'General case' 0 CA--C 1.541 0.626 0 C-N-CA 123.269 0.628 . . . . 74.409999999999997 110.266 175.178 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 63.3 t30 -64.28 -39.76 94.58 Favored 'General case' 0 N--CA 1.482 1.139 0 C-N-CA 123.605 0.762 . . . . 75.439999999999998 111.863 -179.047 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 93.9 mt -75.91 -30.93 58.93 Favored 'General case' 0 N--CA 1.479 1.009 0 C-N-CA 123.247 0.619 . . . . 74.310000000000002 111.292 179.889 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 23.8 ttmm -73.55 -47.52 40.13 Favored 'General case' 0 N--CA 1.477 0.918 0 C-N-CA 123.039 0.536 . . . . 75.019999999999996 110.21 -178.483 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 3.6 t -68.69 -32.83 72.92 Favored 'General case' 0 N--CA 1.475 0.811 0 CA-C-N 114.592 -1.185 . . . . 75.409999999999997 111.362 -178.436 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -70.68 -43.6 68.74 Favored 'General case' 0 N--CA 1.474 0.727 0 CA-C-N 115.356 -0.838 . . . . 74.109999999999999 111.236 173.791 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 14.4 tp -70.52 -37.23 74.1 Favored 'General case' 0 N--CA 1.487 1.377 0 C-N-CA 123.108 0.563 . . . . 54.039999999999999 111.611 -175.77 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 12.2 pt-20 -74.16 -30.85 62.46 Favored 'General case' 0 N--CA 1.482 1.137 0 CA-C-N 116.187 -0.461 . . . . 75.200000000000003 111.071 178.217 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 24.9 t -82.28 -14.9 54.7 Favored 'General case' 0 N--CA 1.487 1.414 0 C-N-CA 123.027 0.531 . . . . 51.210000000000001 112.103 174.296 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -83.2 -49.37 9.52 Favored 'General case' 0 N--CA 1.485 1.305 0 C-N-CA 123.568 0.747 . . . . 74.25 111.159 -179.12 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 51' ' ' PHE . . . . . . . . . . . . . 25.6 m-85 . . . . . 0 N--CA 1.47 0.539 0 CA-C-N 115.845 -0.616 . . . . 63.219999999999999 110.498 179.713 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 2' ' ' THR . . . . . 0.518 HG23 ' H ' ' A' ' 5' ' ' GLU . 6.7 t . . . . . 0 N--CA 1.487 1.417 0 N-CA-C 111.745 0.276 . . . . 73.209999999999994 111.745 . . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 3' ' ' LEU . . . . . 0.532 HD13 HD12 ' A' ' 6' ' ' LEU . 3.4 mm? -63.22 -24.2 67.77 Favored 'General case' 0 N--CA 1.483 1.212 0 CA-C-N 115.538 -0.756 . . . . 61.100000000000001 110.63 174.317 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 41.3 mm -59.24 -49.69 82.54 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.297 0 C-N-CA 123.725 0.81 . . . . 54.219999999999999 111.22 179.301 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 5' ' ' GLU . . . . . 0.518 ' H ' HG23 ' A' ' 2' ' ' THR . 43.8 mm-40 -65.5 -35.55 81.2 Favored 'General case' 0 N--CA 1.479 1.02 0 CA-C-N 116.079 -0.509 . . . . 71.409999999999997 111.854 177.639 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 6' ' ' LEU . . . . . 0.532 HD12 HD13 ' A' ' 3' ' ' LEU . 82.4 mt -64.31 -38.63 91.72 Favored 'General case' 0 N--CA 1.483 1.206 0 C-N-CA 122.617 0.367 . . . . 63.039999999999999 111.571 176.258 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 7' ' ' LEU . . . . . 0.434 ' HG ' ' O ' ' A' ' 3' ' ' LEU . 91.8 mt -60.77 -44.24 97.02 Favored 'General case' 0 N--CA 1.485 1.28 0 C-N-CA 123.327 0.651 . . . . 74.049999999999997 111.213 174.321 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 96.7 mt -68.66 -53.22 28.67 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.78 0 C-N-CA 124.087 0.955 . . . . 63.229999999999997 112.565 -179.163 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 71.0 t -57.63 -43.45 83.5 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.027 0 C-N-CA 123.705 0.802 . . . . 74.439999999999998 112.005 -177.209 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 72.9 t -68.42 -33.77 62.06 Favored 'Isoleucine or valine' 0 CA--C 1.559 1.32 0 C-N-CA 122.627 0.371 . . . . 74.430000000000007 111.952 176.919 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -73.46 -49.72 25.38 Favored 'General case' 0 N--CA 1.485 1.283 0 CA-C-N 118.091 0.405 . . . . 74.109999999999999 111.841 -179.52 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 12' ' ' ILE . . . . . 0.432 ' O ' ' HG ' ' A' ' 16' ' ' LEU . 25.8 pt -64.93 -43.11 96.28 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.151 0 C-N-CA 123.744 0.818 . . . . 74.209999999999994 112.064 -175.488 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 78.8 mt -73.38 -30.1 29.47 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.882 0 C-N-CA 123.881 0.873 . . . . 54.229999999999997 109.893 176.305 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -62.01 -36.24 92.59 Favored Glycine 0 C--N 1.355 1.624 0 CA-C-N 115.604 -0.725 . . . . 71.409999999999997 113.046 174.858 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 15' ' ' ILE . . . . . 0.425 HD12 ' HA ' ' A' ' 12' ' ' ILE . 21.5 mt -69.51 -47.21 73.37 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.892 0 C-N-CA 123.407 0.683 . . . . 64.310000000000002 110.549 173.544 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 16' ' ' LEU . . . . . 0.432 ' HG ' ' O ' ' A' ' 12' ' ' ILE . 14.6 mt -59.94 -35.73 75.54 Favored 'General case' 0 N--CA 1.484 1.241 0 O-C-N 123.562 0.539 . . . . 72.319999999999993 112.172 -176.073 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -72.2 -52.16 17.79 Favored 'General case' 0 N--CA 1.478 0.939 0 CA-C-O 121.289 0.566 . . . . 63.240000000000002 110.662 174.87 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -64.51 -19.55 65.66 Favored 'General case' 0 N--CA 1.479 1.005 0 N-CA-C 114.175 1.176 . . . . 72.319999999999993 114.175 -176.837 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 2.7 pp -94.57 -43.33 13.09 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.178 0 CA-C-N 118.458 0.572 . . . . 65.209999999999994 111.441 173.441 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -72.39 -46.9 53.17 Favored 'General case' 0 N--CA 1.491 1.577 0 N-CA-C 112.542 0.571 . . . . 44.509999999999998 112.542 -170.483 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 23.4 mt -59.35 -54.41 56.43 Favored Pre-proline 0 CA--C 1.561 1.379 0 CA-C-O 118.091 -0.957 . . . . 73.430000000000007 113.063 -177.988 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 39.2 Cg_endo -65.43 -37.87 28.39 Favored 'Trans proline' 0 C--N 1.38 2.221 0 C-N-CA 121.821 1.681 . . . . 74.340000000000003 112.773 176.554 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 27.4 tt0 -66.07 -35.63 81.03 Favored 'General case' 0 N--CA 1.485 1.284 0 C-N-CA 123.349 0.66 . . . . 74.310000000000002 110.291 -178.124 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 24' ' ' PHE . . . . . . . . . . . . . 66.8 t80 -87.37 -38.03 16.55 Favored 'General case' 0 N--CA 1.489 1.49 0 CA-C-N 115.563 -0.744 . . . . 74.310000000000002 111.082 -176.959 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 25' ' ' SER . . . . . 0.404 ' O ' HG23 ' A' ' 29' ' ' VAL . 74.7 m -56.15 -49.21 74.61 Favored 'General case' 0 N--CA 1.488 1.453 0 C-N-CA 122.358 0.263 . . . . 74.209999999999994 110.721 171.008 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -67.3 -30.76 70.7 Favored 'General case' 0 N--CA 1.483 1.216 0 C-N-CA 123.264 0.626 . . . . 54.420000000000002 112.19 175.932 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 61.2 t80 -68.38 -53.36 24.41 Favored 'General case' 0 N--CA 1.479 1.007 0 C-N-CA 123.16 0.584 . . . . 71.400000000000006 110.906 -179.044 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 1.8 ptm180 -69.59 -18.24 63.6 Favored 'General case' 0 N--CA 1.475 0.815 0 C-N-CA 123.317 0.647 . . . . 73.420000000000002 111.443 -175.415 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 29' ' ' VAL . . . . . 0.404 HG23 ' O ' ' A' ' 25' ' ' SER . 52.9 t -76.5 -51.43 19.51 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.183 0 CA-C-O 120.906 0.384 . . . . 75.030000000000001 110.45 171.436 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 21.2 ptmt -73.41 -18.7 61.12 Favored 'General case' 0 N--CA 1.482 1.154 0 CA-C-N 115.819 -0.628 . . . . 64.439999999999998 111.882 -178.572 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -87.15 -33.2 19.49 Favored 'General case' 0 N--CA 1.486 1.375 0 C-N-CA 123.459 0.704 . . . . 72.439999999999998 109.822 179.09 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 69.8 t80 -69.77 -22.32 63.36 Favored 'General case' 0 N--CA 1.483 1.211 0 CA-C-N 115.566 -0.743 . . . . 71.120000000000005 109.967 171.58 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 7.6 t30 -84.33 -51.23 7.14 Favored 'General case' 0 N--CA 1.475 0.785 0 C-N-CA 124.221 1.008 . . . . 61.420000000000002 111.218 173.106 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 46.5 t -67.67 -54.95 15.4 Favored 'General case' 0 N--CA 1.492 1.631 0 C-N-CA 123.247 0.619 . . . . 64.400000000000006 112.181 -172.427 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -61.41 -39.25 90.06 Favored 'General case' 0 N--CA 1.474 0.762 0 CA-C-N 115.981 -0.554 . . . . 72.120000000000005 111.296 178.572 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -70.36 -43.3 70.46 Favored 'General case' 0 N--CA 1.483 1.176 0 O-C-N 123.359 0.412 . . . . 75.439999999999998 111.808 -178.424 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 40.2 t -59.11 -43.91 91.94 Favored 'General case' 0 N--CA 1.491 1.6 0 C-N-CA 123.53 0.732 . . . . 74.349999999999994 111.514 178.249 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 44.6 t -79.08 -27.54 43.03 Favored 'General case' 0 N--CA 1.475 0.823 0 CA-C-N 115.411 -0.813 . . . . 72.25 112.059 -179.211 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 26.6 t70 -66.6 -47.17 73.55 Favored 'General case' 0 N--CA 1.481 1.083 0 C-N-CA 122.82 0.448 . . . . 75.450000000000003 110.809 172.414 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 97.2 mt -71.82 -31.73 66.85 Favored 'General case' 0 N--CA 1.481 1.091 0 C-N-CA 123.423 0.689 . . . . 71.209999999999994 110.829 -177.288 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 50.4 ttp180 -74.08 -31.99 63.07 Favored 'General case' 0 CA--C 1.548 0.882 0 CA-C-N 115.842 -0.617 . . . . 73.420000000000002 110.3 173.347 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 42' ' ' ASN . . . . . 0.468 ' HA ' HG22 ' A' ' 45' ' ' THR . 18.0 t-20 -68.63 -31.38 70.48 Favored 'General case' 0 N--CA 1.485 1.285 0 C-N-CA 122.802 0.441 . . . . 70.329999999999998 111.14 173.916 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 96.3 mt -66.67 -37.33 84.54 Favored 'General case' 0 N--CA 1.486 1.358 0 C-N-CA 123.022 0.529 . . . . 75.25 110.391 172.719 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 17.8 tppt? -72.61 -47.66 46.06 Favored 'General case' 0 N--CA 1.473 0.677 0 C-N-CA 123.682 0.793 . . . . 61.009999999999998 110.258 -176.761 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 45' ' ' THR . . . . . 0.468 HG22 ' HA ' ' A' ' 42' ' ' ASN . 2.9 t -68.3 -31.16 70.39 Favored 'General case' 0 N--CA 1.485 1.285 0 C-N-CA 123.872 0.869 . . . . 63.299999999999997 111.489 -177.52 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -65.51 -52.43 52.76 Favored 'General case' 0 N--CA 1.473 0.687 0 CA-C-N 115.18 -0.918 . . . . 74.310000000000002 110.569 173.929 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 91.7 mt -66.36 -27.75 68.12 Favored 'General case' 0 N--CA 1.485 1.301 0 C-N-CA 123.643 0.777 . . . . 70.200000000000003 112.494 176.535 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 13.1 tp10 -71.78 -53.36 13.63 Favored 'General case' 0 C--N 1.349 0.571 0 C-N-CA 124.304 1.042 . . . . 72.319999999999993 111.108 -179.577 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 46.8 t -67.46 -34.76 77.83 Favored 'General case' 0 N--CA 1.48 1.075 0 CA-C-N 115.542 -0.754 . . . . 74.150000000000006 111.569 178.897 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -65.94 -52.14 52.39 Favored 'General case' 0 N--CA 1.482 1.126 0 C-N-CA 123.347 0.659 . . . . 63.200000000000003 111.555 177.263 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 51' ' ' PHE . . . . . . . . . . . . . 73.9 t80 . . . . . 0 N--CA 1.492 1.635 0 C-N-CA 123.334 0.654 . . . . 72.209999999999994 111.231 -178.923 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 2' ' ' THR . . . . . 0.663 ' HB ' ' HG2' ' A' ' 5' ' ' GLU . 25.8 m . . . . . 0 N--CA 1.479 0.979 0 N-CA-C 109.908 -0.404 . . . . 60.32 109.908 . . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 7.7 tt -57.15 -33.31 67.27 Favored 'General case' 0 N--CA 1.488 1.473 0 C-N-CA 123.53 0.732 . . . . 64.230000000000004 110.745 176.594 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 4' ' ' ILE . . . . . 0.57 ' H ' HG22 ' A' ' 2' ' ' THR . 48.7 mm -65.95 -37.34 79.61 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.251 0 C-N-CA 123.093 0.557 . . . . 73.329999999999998 111.461 -178.223 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 5' ' ' GLU . . . . . 0.663 ' HG2' ' HB ' ' A' ' 2' ' ' THR . 11.2 mm-40 -56.68 -45.55 81.67 Favored 'General case' 0 N--CA 1.491 1.577 0 C-N-CA 123.296 0.639 . . . . 70.510000000000005 110.726 173.586 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 53.8 mt -65.43 -42.6 92.27 Favored 'General case' 0 N--CA 1.479 1.004 0 C-N-CA 123.625 0.77 . . . . 64.030000000000001 111.385 177.887 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -56.73 -48.91 76.7 Favored 'General case' 0 CA--C 1.552 1.041 0 C-N-CA 124.364 1.066 . . . . 73.310000000000002 110.294 178.089 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 95.2 mt -65.88 -43.77 92.92 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.791 0 C-N-CA 124.254 1.022 . . . . 63.32 112.143 -179.249 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 49.6 t -62.91 -45.45 98.84 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.061 0 C-N-CA 122.868 0.467 . . . . 73.040000000000006 111.396 178.383 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 71.6 t -66.58 -32.8 59.66 Favored 'Isoleucine or valine' 0 CA--C 1.562 1.431 0 C-N-CA 122.7 0.4 . . . . 73.099999999999994 111.016 175.36 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -67.23 -55.63 13.22 Favored 'General case' 0 CA--C 1.552 1.031 0 C-N-CA 123.065 0.546 . . . . 53.340000000000003 111.584 179.219 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 12' ' ' ILE . . . . . 0.477 ' O ' ' HG ' ' A' ' 16' ' ' LEU . 23.7 pt -61.28 -46.03 97.43 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.125 0 C-N-CA 123.461 0.705 . . . . 72.439999999999998 111.45 -176.869 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 77.1 mt -65.76 -32.16 56.95 Favored 'Isoleucine or valine' 0 CA--C 1.551 1.002 0 C-N-CA 124.138 0.975 . . . . 64.530000000000001 110.598 176.853 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -60.35 -39.69 96.49 Favored Glycine 0 C--N 1.349 1.293 0 CA-C-N 115.685 -0.689 . . . . 72.319999999999993 112.882 172.911 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 1.8 mp -72.99 -40.32 58.98 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.06 0 N-CA-C 109.757 -0.46 . . . . 73.540000000000006 109.757 176.869 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 16' ' ' LEU . . . . . 0.477 ' HG ' ' O ' ' A' ' 12' ' ' ILE . 28.2 mt -58.83 -40.28 83.72 Favored 'General case' 0 N--CA 1.491 1.59 0 C-N-CA 123.113 0.565 . . . . 55.439999999999998 111.681 179.973 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -74.32 -45.77 45.19 Favored 'General case' 0 N--CA 1.479 1.009 0 C-N-CA 123.287 0.635 . . . . 72.230000000000004 110.864 176.833 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -59.18 -32.39 69.87 Favored 'General case' 0 N--CA 1.482 1.171 0 C-N-CA 123.99 0.916 . . . . 72.25 113.275 -178.871 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 2.8 pp -86.01 -37.71 12.02 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.153 0 C-N-CA 122.327 0.251 . . . . 75.400000000000006 111.324 175.628 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -63.44 -55.18 26.31 Favored 'General case' 0 N--CA 1.486 1.342 0 C-N-CA 123.792 0.837 . . . . 72.140000000000001 112.954 -174.799 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 21.5 mt -54.09 -54.51 46.6 Favored Pre-proline 0 CA--C 1.563 1.444 0 N-CA-C 113.66 0.985 . . . . 64.340000000000003 113.66 -174.956 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 37.7 Cg_endo -66.08 -40.42 15.87 Favored 'Trans proline' 0 C--N 1.378 2.103 0 CA-C-N 121.619 1.614 . . . . 72.5 112.894 176.107 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 23' ' ' GLN . . . . . 0.414 ' O ' ' HB2' ' A' ' 27' ' ' TYR . 43.3 tt0 -59.58 -41.75 90.94 Favored 'General case' 0 N--CA 1.485 1.314 0 C-N-CA 123.565 0.746 . . . . 65.329999999999998 110.829 -177.566 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 24' ' ' PHE . . . . . . . . . . . . . 19.1 m-85 -92.59 -33.9 14.24 Favored 'General case' 0 N--CA 1.484 1.234 0 CA-C-N 114.65 -1.159 . . . . 61.109999999999999 112.005 -172.068 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 25' ' ' SER . . . . . 0.429 ' O ' HG23 ' A' ' 29' ' ' VAL . 43.3 t -61.82 -53.34 57.26 Favored 'General case' 0 N--CA 1.49 1.545 0 N-CA-C 110.284 -0.265 . . . . 62.420000000000002 110.284 170.764 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -63.58 -27.38 69.21 Favored 'General case' 0 N--CA 1.48 1.037 0 C-N-CA 123.384 0.673 . . . . 73.439999999999998 112.333 176.308 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 27' ' ' TYR . . . . . 0.414 ' HB2' ' O ' ' A' ' 23' ' ' GLN . 66.6 t80 -66.22 -48.48 70.44 Favored 'General case' 0 N--CA 1.482 1.171 0 C-N-CA 122.975 0.51 . . . . 61.210000000000001 111.386 176.904 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 13.7 mmt180 -67.65 -29.72 69.1 Favored 'General case' 0 N--CA 1.476 0.853 0 O-C-N 124.067 0.854 . . . . 73.329999999999998 111.548 -179.212 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 29' ' ' VAL . . . . . 0.429 HG23 ' O ' ' A' ' 25' ' ' SER . 87.8 t -72.7 -48.69 44.95 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.382 0 N-CA-C 109.359 -0.608 . . . . 60.350000000000001 109.359 176.486 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 8.1 tttp -55.14 -40.41 70.53 Favored 'General case' 0 CA--C 1.549 0.931 0 C-N-CA 124.722 1.209 . . . . 74.510000000000005 111.213 172.986 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -73.83 -45.22 52.59 Favored 'General case' 0 N--CA 1.476 0.845 0 C-N-CA 122.918 0.487 . . . . 72.040000000000006 110.78 -174.045 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 53.7 t80 -64.18 -37.44 87.48 Favored 'General case' 0 CA--C 1.544 0.737 0 O-C-N 123.829 0.706 . . . . 72.109999999999999 110.676 179.636 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 93.1 m-20 -72.99 -41.68 64.06 Favored 'General case' 0 N--CA 1.485 1.287 0 C-N-CA 123.774 0.83 . . . . 71.319999999999993 112.192 178.905 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 64.7 m -68.85 -49.81 55.18 Favored 'General case' 0 N--CA 1.496 1.843 0 C-N-CA 123.184 0.594 . . . . 75.120000000000005 110.935 -179.28 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -62.61 -40.11 95.92 Favored 'General case' 0 N--CA 1.476 0.842 0 CA-C-N 115.564 -0.744 . . . . 52.329999999999998 111.333 176.345 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -61.89 -46.33 89.87 Favored 'General case' 0 N--CA 1.496 1.832 0 O-C-N 123.465 0.478 . . . . 71.519999999999996 112.219 174.793 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 67.8 m -60.34 -43.44 96.45 Favored 'General case' 0 N--CA 1.494 1.727 0 C-N-CA 123.563 0.745 . . . . 73.239999999999995 111.329 179.206 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 37.6 m -73.36 -33.72 65.23 Favored 'General case' 0 N--CA 1.476 0.834 0 CA-C-N 115.362 -0.835 . . . . 73.430000000000007 111.607 179.248 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 29.5 t70 -60.49 -52.93 63.09 Favored 'General case' 0 N--CA 1.48 1.029 0 C-N-CA 123.52 0.728 . . . . 72.019999999999996 111.338 175.872 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 4.2 pp -71.22 -31.51 67.67 Favored 'General case' 0 N--CA 1.486 1.347 0 CA-C-N 116.194 -0.457 . . . . 65.439999999999998 111.143 -172.063 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 36.2 ttm180 -80.67 -40.74 24.94 Favored 'General case' 0 CA--C 1.548 0.891 0 C-N-CA 123.131 0.572 . . . . 64.420000000000002 110.92 -179.275 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 42' ' ' ASN . . . . . 0.476 ' HA ' HG22 ' A' ' 45' ' ' THR . 19.9 t-20 -68.04 -38.07 82.09 Favored 'General case' 0 N--CA 1.489 1.501 0 N-CA-C 112.183 0.438 . . . . 71.010000000000005 112.183 -178.738 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 86.9 mt -69.99 -29.07 66.07 Favored 'General case' 0 N--CA 1.484 1.23 0 C-N-CA 122.48 0.312 . . . . 54.219999999999999 111.369 179.005 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 44' ' ' LYS . . . . . 0.429 ' O ' ' HG2' ' A' ' 48' ' ' GLU . 86.4 tttt -78.15 -45.08 24.2 Favored 'General case' 0 CA--C 1.542 0.655 0 CA-C-N 115.906 -0.588 . . . . 72.319999999999993 110.423 176.394 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 45' ' ' THR . . . . . 0.476 HG22 ' HA ' ' A' ' 42' ' ' ASN . 1.5 t -68.23 -30.11 69.1 Favored 'General case' 0 N--CA 1.487 1.399 0 C-N-CA 123.374 0.669 . . . . 42.130000000000003 110.832 -176.65 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -58.27 -43.91 88.15 Favored 'General case' 0 N--CA 1.474 0.762 0 CA-C-N 115.02 -0.991 . . . . 63.140000000000001 110.582 169.5 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -68.09 -39.67 82.81 Favored 'General case' 0 CA--C 1.567 1.606 0 C-N-CA 123.608 0.763 . . . . 71.409999999999997 110.832 175.016 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 48' ' ' GLU . . . . . 0.429 ' HG2' ' O ' ' A' ' 44' ' ' LYS . 25.0 mm-40 -65.49 -33.74 76.64 Favored 'General case' 0 N--CA 1.487 1.404 0 C-N-CA 123.498 0.719 . . . . 74.510000000000005 111.662 -178.309 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 43.3 t -84.15 -55.81 4.0 Favored 'General case' 0 N--CA 1.478 0.94 0 C-N-CA 122.803 0.441 . . . . 71.430000000000007 111.952 176.408 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -60.5 -53.21 60.26 Favored 'General case' 0 N--CA 1.479 1.017 0 C-N-CA 123.414 0.686 . . . . 24.219999999999999 112.408 -175.457 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 51' ' ' PHE . . . . . . . . . . . . . 80.1 t80 . . . . . 0 N--CA 1.481 1.09 0 CA-C-O 120.665 0.269 . . . . 72.230000000000004 111.607 -173.72 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 2' ' ' THR . . . . . 0.714 HG22 ' H ' ' A' ' 4' ' ' ILE . 19.7 m . . . . . 0 N--CA 1.484 1.275 0 CA-C-O 120.6 0.238 . . . . 54.530000000000001 111.455 . . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 3' ' ' LEU . . . . . 0.411 ' O ' ' HG ' ' A' ' 7' ' ' LEU . 2.5 pt? -57.41 -27.87 62.76 Favored 'General case' 0 N--CA 1.484 1.225 0 C-N-CA 123.603 0.761 . . . . 70.400000000000006 112.449 175.218 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 4' ' ' ILE . . . . . 0.714 ' H ' HG22 ' A' ' 2' ' ' THR . 51.8 mm -84.42 -44.94 17.97 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.109 0 C-N-CA 123.37 0.668 . . . . 75.430000000000007 110.996 -176.708 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 5' ' ' GLU . . . . . 0.456 ' O ' HG23 ' A' ' 9' ' ' VAL . 22.4 mm-40 -58.69 -39.66 81.38 Favored 'General case' 0 N--CA 1.481 1.093 0 O-C-N 123.432 0.457 . . . . 72.200000000000003 111.357 176.126 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 2.4 pp -69.34 -31.61 70.16 Favored 'General case' 0 N--CA 1.484 1.226 0 C-N-CA 122.351 0.26 . . . . 65.310000000000002 111.33 178.923 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 7' ' ' LEU . . . . . 0.411 ' HG ' ' O ' ' A' ' 3' ' ' LEU . 90.5 mt -64.15 -37.34 87.12 Favored 'General case' 0 N--CA 1.484 1.241 0 C-N-CA 122.464 0.305 . . . . 64.209999999999994 111.579 172.035 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 84.0 mt -68.7 -43.48 83.04 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.078 0 C-N-CA 123.252 0.621 . . . . 73.450000000000003 111.645 175.446 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 9' ' ' VAL . . . . . 0.456 HG23 ' O ' ' A' ' 5' ' ' GLU . 95.9 t -59.53 -48.34 87.64 Favored 'Isoleucine or valine' 0 CA--C 1.556 1.196 0 C-N-CA 123.657 0.783 . . . . 74.019999999999996 111.928 175.323 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 10' ' ' VAL . . . . . 0.405 HG12 ' HA ' ' A' ' 7' ' ' LEU . 5.5 p -69.77 -25.13 27.71 Favored 'Isoleucine or valine' 0 CA--C 1.557 1.215 0 C-N-CA 122.77 0.428 . . . . 75.030000000000001 111.374 179.281 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -68.66 -55.61 10.88 Favored 'General case' 0 C--N 1.36 1.038 0 C-N-CA 122.766 0.426 . . . . 63.200000000000003 111.366 175.196 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 12' ' ' ILE . . . . . 0.557 ' HA ' HD12 ' A' ' 15' ' ' ILE . 23.1 pt -65.15 -45.46 93.97 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.966 0 C-N-CA 123.3 0.64 . . . . 72.219999999999999 111.819 -177.703 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 72.5 mt -68.15 -28.84 42.43 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.918 0 C-N-CA 123.562 0.745 . . . . 51.039999999999999 110.479 174.712 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -61.71 -38.75 96.42 Favored Glycine 0 C--N 1.346 1.109 0 CA-C-N 116.046 -0.525 . . . . 62.549999999999997 112.822 173.057 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 15' ' ' ILE . . . . . 0.557 HD12 ' HA ' ' A' ' 12' ' ' ILE . 14.4 mt -70.71 -44.32 76.55 Favored 'Isoleucine or valine' 0 C--N 1.352 0.682 0 C-N-CA 123.064 0.545 . . . . 62.5 109.929 175.387 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 16' ' ' LEU . . . . . 0.485 ' HG ' ' O ' ' A' ' 12' ' ' ILE . 22.0 mt -58.57 -40.42 83.05 Favored 'General case' 0 N--CA 1.482 1.165 0 O-C-N 123.791 0.682 . . . . 65.319999999999993 111.501 179.669 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -72.01 -51.92 19.5 Favored 'General case' 0 N--CA 1.476 0.843 0 C-N-CA 123.053 0.541 . . . . 71.209999999999994 110.754 179.171 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -55.09 -30.79 60.43 Favored 'General case' 0 N--CA 1.482 1.152 0 C-N-CA 123.981 0.913 . . . . 72.230000000000004 112.879 -179.132 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 2.7 pp -88.26 -34.51 7.19 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.256 0 N-CA-C 112.551 0.575 . . . . 71.129999999999995 112.551 174.529 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -65.79 -52.32 51.78 Favored 'General case' 0 N--CA 1.484 1.251 0 C-N-CA 123.074 0.55 . . . . 41.439999999999998 112.264 -173.268 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 2.1 mp -54.61 -54.12 52.52 Favored Pre-proline 0 CA--C 1.574 1.894 0 N-CA-C 112.851 0.686 . . . . 63.119999999999997 112.851 -174.733 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 36.7 Cg_endo -65.13 -42.25 14.35 Favored 'Trans proline' 0 C--N 1.38 2.221 0 CA-C-N 121.065 1.416 . . . . 74.239999999999995 113.115 175.113 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 28.8 tt0 -62.76 -34.41 77.16 Favored 'General case' 0 N--CA 1.486 1.357 0 C-N-CA 123.358 0.663 . . . . 74.140000000000001 111.001 -177.859 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 24' ' ' PHE . . . . . . . . . . . . . 84.3 t80 -84.42 -42.06 16.04 Favored 'General case' 0 N--CA 1.484 1.229 0 C-N-CA 123.912 0.885 . . . . 51.149999999999999 110.49 -174.137 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 26.4 t -67.16 -28.34 68.04 Favored 'General case' 0 N--CA 1.479 1.004 0 CA-C-N 116.402 -0.363 . . . . 71.349999999999994 110.582 175.253 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -79.94 -29.81 39.79 Favored 'General case' 0 C--O 1.214 -0.808 0 C-N-CA 123.109 0.564 . . . . 55.539999999999999 111.717 172.737 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 78.7 t80 -71.97 -45.8 59.72 Favored 'General case' 0 N--CA 1.487 1.408 0 C-N-CA 123.89 0.876 . . . . 72.340000000000003 111.722 -175.539 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 39.3 ptt180 -68.23 -29.32 68.12 Favored 'General case' 0 N--CA 1.477 0.92 0 CA-C-N 115.181 -0.918 . . . . 52.219999999999999 111.309 179.74 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 79.3 t -83.3 -34.89 11.38 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.375 0 CA-C-N 115.699 -0.682 . . . . 73.109999999999999 110.136 178.896 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 10.8 tttp -61.25 -42.87 99.37 Favored 'General case' 0 C--O 1.214 -0.769 0 C-N-CA 124.061 0.944 . . . . 51.229999999999997 109.783 168.69 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -71.04 -42.46 69.46 Favored 'General case' 0 N--CA 1.476 0.842 0 N-CA-C 109.935 -0.395 . . . . 74.349999999999994 109.935 -176.686 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 74.9 t80 -62.53 -62.48 1.71 Allowed 'General case' 0 C--O 1.215 -0.715 0 CA-C-N 115.57 -0.741 . . . . 72.430000000000007 110.977 178.828 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 85.4 m-20 -66.95 -44.46 80.51 Favored 'General case' 0 N--CA 1.485 1.275 0 N-CA-C 113.664 0.987 . . . . 73.239999999999995 113.664 -174.535 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 47.0 t -68.01 -52.85 30.9 Favored 'General case' 0 N--CA 1.497 1.918 0 CA-C-N 117.636 0.198 . . . . 75.329999999999998 111.09 -176.321 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -62.8 -41.36 99.25 Favored 'General case' 0 C--O 1.212 -0.882 0 O-C-N 123.446 0.466 . . . . 41.0 111.27 177.765 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -59.82 -50.44 73.78 Favored 'General case' 0 N--CA 1.498 1.937 0 N-CA-C 112.24 0.459 . . . . 52.140000000000001 112.24 178.379 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 66.8 m -63.81 -37.55 87.8 Favored 'General case' 0 N--CA 1.486 1.356 0 C-N-CA 123.331 0.652 . . . . 73.120000000000005 111.891 -179.277 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 79.9 p -80.97 -25.52 37.26 Favored 'General case' 0 N--CA 1.482 1.135 0 C-N-CA 122.844 0.458 . . . . 72.140000000000001 111.997 -178.626 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 39' ' ' ASP . . . . . 0.438 ' O ' ' HG ' ' A' ' 43' ' ' LEU . 94.6 m-20 -65.69 -52.65 49.75 Favored 'General case' 0 C--O 1.211 -0.958 0 N-CA-C 109.336 -0.616 . . . . 72.340000000000003 109.336 167.254 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 98.5 mt -64.37 -29.83 70.89 Favored 'General case' 0 N--CA 1.481 1.11 0 C-N-CA 123.483 0.713 . . . . 75.319999999999993 111.63 -176.516 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 47.4 ttp180 -75.29 -43.21 52.34 Favored 'General case' 0 CA--C 1.546 0.809 0 C-N-CA 123.536 0.734 . . . . 73.400000000000006 110.663 175.213 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 62.4 t30 -69.68 -34.49 74.03 Favored 'General case' 0 N--CA 1.488 1.471 0 C-N-CA 123.467 0.707 . . . . 54.530000000000001 112.221 -179.78 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 43' ' ' LEU . . . . . 0.438 ' HG ' ' O ' ' A' ' 39' ' ' ASP . 89.8 mt -77.21 -32.01 55.61 Favored 'General case' 0 N--CA 1.478 0.949 0 C-N-CA 123.007 0.523 . . . . 75.219999999999999 110.12 179.37 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 44' ' ' LYS . . . . . 0.415 ' O ' ' HG2' ' A' ' 48' ' ' GLU . 38.8 ttpt -77.55 -36.87 51.82 Favored 'General case' 0 N--CA 1.477 0.885 0 C-N-CA 122.913 0.485 . . . . 53.200000000000003 110.602 179.091 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 1.7 t -70.57 -30.93 67.77 Favored 'General case' 0 N--CA 1.485 1.298 0 CA-C-O 121.369 0.604 . . . . 74.310000000000002 110.753 179.438 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -66.42 -43.86 84.55 Favored 'General case' 0 N--CA 1.479 1.003 0 CA-C-N 114.86 -1.064 . . . . 64.540000000000006 111.101 168.915 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 36.5 tp -63.71 -34.52 78.07 Favored 'General case' 0 CA--C 1.554 1.13 0 C-N-CA 123.648 0.779 . . . . 72.129999999999995 111.308 177.132 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 48' ' ' GLU . . . . . 0.415 ' HG2' ' O ' ' A' ' 44' ' ' LYS . 80.9 mm-40 -67.32 -47.84 69.34 Favored 'General case' 0 N--CA 1.474 0.762 0 C-N-CA 123.582 0.753 . . . . 71.049999999999997 110.115 173.356 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 40.5 t -57.63 -44.13 85.33 Favored 'General case' 0 N--CA 1.483 1.215 0 C-N-CA 123.681 0.792 . . . . 60.450000000000003 112.852 -176.435 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -72.41 -52.28 16.66 Favored 'General case' 0 N--CA 1.481 1.091 0 C-N-CA 123.407 0.683 . . . . 50.030000000000001 112.66 178.863 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 51' ' ' PHE . . . . . . . . . . . . . 41.5 t80 . . . . . 0 N--CA 1.486 1.357 0 CA-C-N 115.635 -0.712 . . . . 70.129999999999995 111.45 -170.344 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 4.7 t . . . . . 0 N--CA 1.481 1.078 0 CA-C-O 120.557 0.218 . . . . 70.519999999999996 110.605 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 9.3 mp -59.95 -18.97 49.4 Favored 'General case' 0 N--CA 1.481 1.1 0 C-N-CA 123.272 0.629 . . . . 70.150000000000006 111.01 176.244 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 50.3 mm -64.07 -49.79 79.91 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.102 0 C-N-CA 123.505 0.722 . . . . 73.540000000000006 110.822 174.962 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 40.8 mm-40 -57.95 -47.71 82.1 Favored 'General case' 0 N--CA 1.49 1.544 0 C-N-CA 123.376 0.67 . . . . 45.509999999999998 111.512 -179.753 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 46.9 mt -68.88 -32.7 72.55 Favored 'General case' 0 CA--C 1.547 0.853 0 CA-C-N 115.576 -0.738 . . . . 71.120000000000005 111.382 -178.108 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 42.3 tp -66.77 -37.15 84.02 Favored 'General case' 0 CA--C 1.549 0.906 0 C-N-CA 123.976 0.911 . . . . 73.200000000000003 111.659 173.855 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 96.2 mt -68.95 -50.11 56.97 Favored 'Isoleucine or valine' 0 C--N 1.35 0.606 0 C-N-CA 123.636 0.775 . . . . 71.439999999999998 111.245 176.946 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 88.3 t -60.07 -43.03 91.85 Favored 'Isoleucine or valine' 0 CA--C 1.554 1.107 0 C-N-CA 123.119 0.568 . . . . 70.049999999999997 111.482 179.345 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 2.7 p -69.24 -31.45 49.87 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.093 0 O-C-N 122.328 -0.233 . . . . 73.319999999999993 111.595 177.482 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -68.24 -57.52 5.85 Favored 'General case' 0 C--N 1.363 1.162 0 C-N-CA 123.141 0.576 . . . . 53.32 111.193 179.308 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 12' ' ' ILE . . . . . 0.507 ' O ' ' HG ' ' A' ' 16' ' ' LEU . 21.9 pt -60.33 -46.99 94.18 Favored 'Isoleucine or valine' 0 CA--C 1.554 1.101 0 C-N-CA 123.776 0.83 . . . . 73.120000000000005 112.055 -177.943 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 1.7 mp -62.03 -35.48 68.72 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.558 0 C-N-CA 123.721 0.808 . . . . 52.25 110.345 174.887 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -62.07 -39.64 97.88 Favored Glycine 0 C--N 1.352 1.418 0 CA-C-N 115.554 -0.748 . . . . 71.310000000000002 113.067 176.241 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 15' ' ' ILE . . . . . 0.486 HD12 ' HA ' ' A' ' 12' ' ' ILE . 21.7 mt -69.59 -40.49 79.59 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.917 0 C-N-CA 123.507 0.723 . . . . 62.340000000000003 111.088 176.686 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 16' ' ' LEU . . . . . 0.507 ' HG ' ' O ' ' A' ' 12' ' ' ILE . 21.8 mt -57.75 -40.06 78.84 Favored 'General case' 0 N--CA 1.489 1.491 0 C-N-CA 123.207 0.603 . . . . 74.140000000000001 111.192 178.647 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -76.84 -49.18 16.38 Favored 'General case' 0 N--CA 1.48 1.026 0 C-N-CA 123.391 0.676 . . . . 65.010000000000005 111.478 179.067 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -59.43 -26.18 64.96 Favored 'General case' 0 N--CA 1.483 1.2 0 C-N-CA 124.182 0.993 . . . . 71.140000000000001 113.263 -176.485 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 19' ' ' ILE . . . . . 0.417 HD12 ' N ' ' A' ' 20' ' ' ALA . 2.8 pp -87.22 -38.51 12.2 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.382 0 CA-C-N 117.915 0.325 . . . . 74.109999999999999 111.741 170.556 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 20' ' ' ALA . . . . . 0.417 ' N ' HD12 ' A' ' 19' ' ' ILE . . . -65.19 -56.85 10.47 Favored 'General case' 0 N--CA 1.478 0.934 0 C-N-CA 123.568 0.747 . . . . 72.200000000000003 112.807 -170.276 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 2.6 mp -58.9 -50.99 85.0 Favored Pre-proline 0 CA--C 1.571 1.777 0 N-CA-C 113.228 0.825 . . . . 71.150000000000006 113.228 -173.503 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 37.7 Cg_endo -65.99 -36.51 30.04 Favored 'Trans proline' 0 C--N 1.382 2.338 0 C-N-CA 121.72 1.613 . . . . 63.049999999999997 113.354 176.395 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 22.0 tt0 -65.31 -36.88 85.42 Favored 'General case' 0 N--CA 1.489 1.504 0 CA-C-O 121.489 0.661 . . . . 62.219999999999999 109.788 178.851 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 24' ' ' PHE . . . . . . . . . . . . . 64.3 t80 -76.04 -39.92 54.56 Favored 'General case' 0 N--CA 1.484 1.261 0 CA-C-N 113.994 -1.457 . . . . 72.239999999999995 110.689 -177.951 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 44.4 t -58.3 -52.25 66.38 Favored 'General case' 0 N--CA 1.478 0.947 0 C-N-CA 123.769 0.828 . . . . 75.049999999999997 110.582 173.9 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -64.11 -28.56 69.85 Favored 'General case' 0 N--CA 1.484 1.232 0 C-N-CA 123.683 0.793 . . . . 72.230000000000004 112.269 176.636 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 47.8 t80 -75.69 -46.01 33.67 Favored 'General case' 0 N--CA 1.484 1.271 0 C-N-CA 123.085 0.554 . . . . 74.129999999999995 111.442 -176.503 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 14.3 ptm180 -73.78 -23.69 59.74 Favored 'General case' 0 N--CA 1.474 0.749 0 CA-C-N 115.42 -0.809 . . . . 62.299999999999997 111.082 -179.499 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 28.3 t -69.32 -58.79 4.64 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.781 0 N-CA-C 109.389 -0.597 . . . . 52.200000000000003 109.389 171.328 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 30' ' ' LYS . . . . . 0.434 ' O ' ' HB3' ' A' ' 34' ' ' SER . 21.1 ptmt -65.98 -17.24 64.55 Favored 'General case' 0 N--CA 1.486 1.366 0 N-CA-C 112.253 0.464 . . . . 63.520000000000003 112.253 -179.223 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -72.95 -46.17 53.96 Favored 'General case' 0 N--CA 1.479 0.99 0 CA-C-O 121.334 0.588 . . . . 73.219999999999999 109.696 172.633 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 12.5 t80 -89.36 -9.99 48.31 Favored 'General case' 0 N--CA 1.488 1.447 0 CA-C-N 115.244 -0.889 . . . . 75.019999999999996 112.195 -173.59 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 29.6 m-80 -101.5 -58.8 1.81 Allowed 'General case' 0 N--CA 1.47 0.574 0 CA-C-N 115.552 -0.749 . . . . 71.349999999999994 110.479 172.93 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 34' ' ' SER . . . . . 0.434 ' HB3' ' O ' ' A' ' 30' ' ' LYS . 47.2 t -83.54 -52.03 6.82 Favored 'General case' 0 N--CA 1.496 1.849 0 CA-C-N 116.745 -0.207 . . . . 71.239999999999995 111.552 -168.405 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -69.15 -32.28 71.53 Favored 'General case' 0 N--CA 1.486 1.348 0 C-N-CA 122.165 0.186 . . . . 60.310000000000002 111.148 179.546 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -72.12 -38.52 69.26 Favored 'General case' 0 N--CA 1.478 0.97 0 C-N-CA 122.745 0.418 . . . . 62.200000000000003 111.25 176.028 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 36.4 t -66.11 -32.39 73.82 Favored 'General case' 0 N--CA 1.494 1.773 0 C-N-CA 122.526 0.331 . . . . 53.240000000000002 111.443 174.355 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 38' ' ' SER . . . . . 0.504 ' HA ' ' HB3' ' A' ' 41' ' ' ARG . 52.7 m -80.37 -23.52 40.44 Favored 'General case' 0 N--CA 1.48 1.062 0 C-N-CA 123.489 0.716 . . . . 74.200000000000003 111.323 177.798 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 39' ' ' ASP . . . . . 0.441 ' O ' ' HG ' ' A' ' 43' ' ' LEU . 24.0 t70 -68.79 -46.94 67.39 Favored 'General case' 0 CA--C 1.553 1.072 0 C-N-CA 122.985 0.514 . . . . 74.450000000000003 110.597 168.718 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 11.1 mp -69.68 -27.76 65.29 Favored 'General case' 0 N--CA 1.482 1.152 0 C-N-CA 123.378 0.671 . . . . 71.430000000000007 111.481 176.634 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 41' ' ' ARG . . . . . 0.504 ' HB3' ' HA ' ' A' ' 38' ' ' SER . 51.5 ttt180 -69.78 -41.02 75.68 Favored 'General case' 0 N--CA 1.478 0.975 0 C-N-CA 123.701 0.8 . . . . 75.349999999999994 110.033 171.738 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 52.9 t30 -60.15 -36.04 76.67 Favored 'General case' 0 CA--C 1.554 1.108 0 C-N-CA 123.793 0.837 . . . . 65.239999999999995 111.2 175.33 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 43' ' ' LEU . . . . . 0.441 ' HG ' ' O ' ' A' ' 39' ' ' ASP . 77.4 mt -79.76 -35.76 38.25 Favored 'General case' 0 N--CA 1.478 0.974 0 C-N-CA 123.272 0.629 . . . . 64.209999999999994 111.38 178.171 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 22.5 tptm -70.24 -45.31 66.73 Favored 'General case' 0 N--CA 1.481 1.087 0 N-CA-C 109.912 -0.403 . . . . 73.219999999999999 109.912 -177.343 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 45' ' ' THR . . . . . 0.496 ' HA ' ' HG2' ' A' ' 48' ' ' GLU . 3.2 t -67.44 -33.63 75.55 Favored 'General case' 0 N--CA 1.473 0.71 0 CA-C-N 114.864 -1.062 . . . . 63.32 111.158 179.622 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -63.39 -52.24 62.48 Favored 'General case' 0 N--CA 1.477 0.882 0 C-N-CA 123.461 0.705 . . . . 73.400000000000006 111.356 176.388 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 10.8 mp -67.08 -46.33 74.59 Favored 'General case' 0 N--CA 1.478 0.964 0 C-N-CA 123.01 0.524 . . . . 73.030000000000001 112.156 -179.887 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 48' ' ' GLU . . . . . 0.496 ' HG2' ' HA ' ' A' ' 45' ' ' THR . 11.1 pt-20 -67.51 -33.55 75.32 Favored 'General case' 0 N--CA 1.487 1.398 0 CA-C-N 117.935 0.334 . . . . 72.230000000000004 111.22 -176.407 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 48.2 t -74.86 -32.97 62.03 Favored 'General case' 0 N--CA 1.478 0.961 0 C-N-CA 123.242 0.617 . . . . 73.439999999999998 111.031 175.951 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -70.63 -44.36 67.33 Favored 'General case' 0 N--CA 1.489 1.512 0 CA-C-O 121.207 0.527 . . . . 72.230000000000004 110.722 -178.674 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 51' ' ' PHE . . . . . . . . . . . . . 58.1 m-85 . . . . . 0 CA--C 1.549 0.93 0 CA-C-N 115.238 -0.892 . . . . 73.409999999999997 111.614 175.703 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 57.5 p . . . . . 0 N--CA 1.487 1.377 0 CA-C-O 120.7 0.286 . . . . 51.240000000000002 111.206 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 9.3 tt -61.07 -23.45 65.48 Favored 'General case' 0 N--CA 1.486 1.369 0 C-N-CA 123.347 0.659 . . . . 73.129999999999995 110.32 171.603 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 51.4 mm -83.0 -43.42 18.47 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.692 0 CA-C-N 115.586 -0.734 . . . . 72.25 110.001 -178.542 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 70.7 mm-40 -56.76 -42.83 80.03 Favored 'General case' 0 N--CA 1.483 1.203 0 C-N-CA 123.55 0.74 . . . . 65.120000000000005 111.658 173.943 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 2.4 pp -71.19 -37.91 72.13 Favored 'General case' 0 N--CA 1.476 0.869 0 O-C-N 123.31 0.382 . . . . 74.310000000000002 110.924 178.651 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -61.48 -46.66 89.1 Favored 'General case' 0 CA--C 1.551 1.011 0 C-N-CA 122.941 0.496 . . . . 74.540000000000006 110.765 177.978 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 95.2 mt -67.65 -49.88 66.08 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.721 0 C-N-CA 123.857 0.863 . . . . 70.430000000000007 112.341 -177.938 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 7.2 p -60.38 -41.13 86.21 Favored 'Isoleucine or valine' 0 CA--C 1.555 1.137 0 CA-C-N 118.194 0.452 . . . . 52.100000000000001 111.852 -177.05 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 74.1 t -68.81 -39.83 80.57 Favored 'Isoleucine or valine' 0 CA--C 1.555 1.16 0 C-N-CA 122.909 0.484 . . . . 72.329999999999998 111.307 174.858 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -64.27 -51.57 62.91 Favored 'General case' 0 N--CA 1.487 1.379 0 C-N-CA 122.835 0.454 . . . . 64.230000000000004 111.855 -178.733 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 12' ' ' ILE . . . . . 0.549 ' O ' ' HG ' ' A' ' 16' ' ' LEU . 22.9 pt -62.28 -48.14 89.76 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.776 0 C-N-CA 123.533 0.733 . . . . 73.519999999999996 111.471 -176.464 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 86.2 mt -63.69 -31.72 54.13 Favored 'Isoleucine or valine' 0 C--N 1.361 1.097 0 C-N-CA 123.306 0.642 . . . . 63.119999999999997 110.925 177.99 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -60.92 -40.66 98.68 Favored Glycine 0 C--N 1.35 1.341 0 CA-C-N 115.562 -0.745 . . . . 74.040000000000006 112.961 174.134 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 15' ' ' ILE . . . . . 0.529 HD12 ' HA ' ' A' ' 12' ' ' ILE . 14.5 mt -71.35 -43.78 73.09 Favored 'Isoleucine or valine' 0 C--N 1.355 0.811 0 C-N-CA 123.282 0.633 . . . . 73.109999999999999 110.465 177.061 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 16' ' ' LEU . . . . . 0.549 ' HG ' ' O ' ' A' ' 12' ' ' ILE . 34.5 mt -58.23 -39.62 79.59 Favored 'General case' 0 N--CA 1.486 1.356 0 C-N-CA 123.54 0.736 . . . . 73.219999999999999 111.283 -177.578 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -73.49 -48.68 31.49 Favored 'General case' 0 N--CA 1.478 0.97 0 C-N-CA 123.016 0.526 . . . . 74.519999999999996 110.913 177.559 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -63.96 -23.9 67.52 Favored 'General case' 0 N--CA 1.482 1.149 0 N-CA-C 113.53 0.937 . . . . 62.140000000000001 113.53 -176.756 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 2.8 pp -89.76 -38.26 10.86 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.28 0 CA-C-N 118.213 0.461 . . . . 70.310000000000002 111.359 172.362 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -63.6 -47.63 80.67 Favored 'General case' 0 N--CA 1.486 1.373 0 C-N-CA 123.429 0.692 . . . . 65.219999999999999 112.789 -175.177 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 27.5 mt -57.43 -54.62 53.03 Favored Pre-proline 0 CA--C 1.563 1.462 0 CA-C-O 118.097 -0.954 . . . . 74.439999999999998 113.281 -176.692 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 39.4 Cg_endo -66.13 -37.42 25.41 Favored 'Trans proline' 0 C--N 1.378 2.09 0 CA-C-N 121.504 1.573 . . . . 64.420000000000002 113.093 174.149 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 23.8 tt0 -63.34 -37.1 85.95 Favored 'General case' 0 N--CA 1.49 1.573 0 C-N-CA 123.519 0.728 . . . . 71.519999999999996 110.802 -177.671 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 24' ' ' PHE . . . . . . . . . . . . . 70.1 t80 -93.8 -36.46 12.25 Favored 'General case' 0 N--CA 1.487 1.407 0 CA-C-N 114.685 -1.143 . . . . 71.540000000000006 111.315 -173.055 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 25' ' ' SER . . . . . 0.505 ' O ' HG23 ' A' ' 29' ' ' VAL . 39.5 t -59.55 -53.26 60.1 Favored 'General case' 0 N--CA 1.486 1.334 0 N-CA-C 110.05 -0.352 . . . . 61.009999999999998 110.05 170.983 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -65.13 -28.15 69.23 Favored 'General case' 0 N--CA 1.488 1.474 0 C-N-CA 123.668 0.787 . . . . 61.350000000000001 112.518 176.866 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 84.6 t80 -63.25 -51.07 67.68 Favored 'General case' 0 N--CA 1.487 1.38 0 CA-C-O 120.835 0.35 . . . . 75.409999999999997 110.209 172.697 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 57.0 mtp180 -65.82 -24.63 66.95 Favored 'General case' 0 N--CA 1.47 0.571 0 CA-C-N 115.465 -0.789 . . . . 74.230000000000004 111.721 179.475 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 29' ' ' VAL . . . . . 0.505 HG23 ' O ' ' A' ' 25' ' ' SER . 79.6 t -68.98 -56.29 12.52 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.09 0 N-CA-C 109.871 -0.418 . . . . 74.450000000000003 109.871 174.341 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 48.4 pttt -67.6 -24.68 65.51 Favored 'General case' 0 CA--C 1.546 0.814 0 CA-C-N 115.491 -0.777 . . . . 73.439999999999998 111.545 -176.85 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -81.65 -37.64 27.17 Favored 'General case' 0 N--CA 1.485 1.305 0 CA-C-O 121.313 0.578 . . . . 71.409999999999997 110.002 -178.522 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 21.4 t80 -76.94 -16.03 59.49 Favored 'General case' 0 N--CA 1.483 1.178 0 CA-C-N 115.048 -0.978 . . . . 74.400000000000006 111.079 -179.85 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 85.6 m-20 -94.89 -50.76 4.98 Favored 'General case' 0 N--CA 1.478 0.95 0 C-N-CA 123.798 0.839 . . . . 71.420000000000002 111.857 173.957 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 46.9 t -70.54 -52.8 19.23 Favored 'General case' 0 N--CA 1.501 2.085 0 N-CA-C 111.864 0.32 . . . . 70.329999999999998 111.864 -172.16 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -66.44 -29.78 70.0 Favored 'General case' 0 N--CA 1.479 0.99 0 C-N-CA 122.998 0.519 . . . . 54.439999999999998 111.706 179.089 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -65.99 -59.02 4.23 Favored 'General case' 0 N--CA 1.482 1.161 0 C-N-CA 122.848 0.459 . . . . 61.350000000000001 111.136 174.144 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 66.2 m -53.65 -40.55 65.96 Favored 'General case' 0 N--CA 1.482 1.143 0 C-N-CA 123.846 0.858 . . . . 74.120000000000005 111.984 179.174 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 47.7 t -76.0 -38.31 57.5 Favored 'General case' 0 N--CA 1.48 1.072 0 C-N-CA 123.105 0.562 . . . . 74.319999999999993 112.446 -176.945 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 38.5 t70 -63.72 -47.02 82.77 Favored 'General case' 0 N--CA 1.483 1.183 0 CA-C-O 121.266 0.555 . . . . 72.439999999999998 111.435 176.981 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 70.0 mt -78.66 -32.63 47.26 Favored 'General case' 0 N--CA 1.476 0.849 0 CA-C-N 115.113 -0.948 . . . . 73.329999999999998 110.78 -172.658 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 17.3 ttp180 -71.68 -35.28 70.25 Favored 'General case' 0 N--CA 1.479 1.002 0 C-N-CA 122.602 0.361 . . . . 71.129999999999995 110.244 174.643 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 28.6 t-20 -61.23 -39.76 91.49 Favored 'General case' 0 N--CA 1.485 1.316 0 C-N-CA 123.232 0.613 . . . . 71.109999999999999 111.258 171.903 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 87.2 mt -69.58 -34.12 73.69 Favored 'General case' 0 N--CA 1.48 1.026 0 C-N-CA 122.757 0.423 . . . . 52.0 111.072 177.849 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 55.8 tptt -80.58 -35.41 34.27 Favored 'General case' 0 CA--C 1.548 0.866 0 C-N-CA 123.574 0.749 . . . . 74.430000000000007 111.214 -176.636 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 3.2 t -74.35 -38.57 63.2 Favored 'General case' 0 N--CA 1.482 1.129 0 CA-C-O 121.226 0.536 . . . . 62.039999999999999 110.389 -178.022 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -71.69 -35.66 70.33 Favored 'General case' 0 N--CA 1.478 0.961 0 CA-C-N 115.193 -0.912 . . . . 61.420000000000002 111.21 174.012 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 69.8 tp -57.77 -62.65 1.65 Allowed 'General case' 0 C--N 1.359 1.021 0 O-C-N 123.89 0.744 . . . . 73.519999999999996 110.705 175.118 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 33.4 mm-40 -59.89 -32.92 71.18 Favored 'General case' 0 N--CA 1.489 1.502 0 C-N-CA 123.661 0.784 . . . . 71.340000000000003 112.583 -173.435 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 25.3 t -61.63 -52.23 65.22 Favored 'General case' 0 CA--C 1.551 1.004 0 CA-C-N 115.439 -0.8 . . . . 70.140000000000001 111.18 178.267 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -78.38 -34.1 48.42 Favored 'General case' 0 N--CA 1.486 1.36 0 C-N-CA 123.43 0.692 . . . . 41.450000000000003 112.33 -179.018 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 51' ' ' PHE . . . . . . . . . . . . . 75.1 t80 . . . . . 0 N--CA 1.488 1.456 0 C-N-CA 125.25 1.42 . . . . 72.439999999999998 110.572 -176.146 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 72.4 p . . . . . 0 N--CA 1.491 1.598 0 CA-C-O 120.488 0.185 . . . . 74.510000000000005 110.851 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 2.4 pt? -60.72 -21.33 62.83 Favored 'General case' 0 N--CA 1.489 1.494 0 C-N-CA 123.567 0.747 . . . . 75.299999999999997 111.348 171.179 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 49.2 mm -69.33 -47.57 72.56 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.087 0 C-N-CA 123.821 0.848 . . . . 73.310000000000002 110.316 176.353 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 22.9 mm-40 -59.94 -42.22 93.55 Favored 'General case' 0 N--CA 1.484 1.229 0 C-N-CA 123.441 0.696 . . . . 74.140000000000001 111.355 175.41 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 83.4 mt -63.75 -37.34 86.98 Favored 'General case' 0 N--CA 1.487 1.408 0 C-N-CA 123.19 0.596 . . . . 72.439999999999998 111.835 176.508 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 6.7 tt -64.51 -43.09 95.16 Favored 'General case' 0 CA--C 1.548 0.883 0 C-N-CA 124.026 0.931 . . . . 63.32 110.108 176.416 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 96.0 mt -67.95 -42.1 85.26 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.943 0 C-N-CA 123.546 0.738 . . . . 74.540000000000006 111.762 179.193 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 79.1 t -63.48 -45.72 97.1 Favored 'Isoleucine or valine' 0 CA--C 1.556 1.177 0 C-N-CA 123.325 0.65 . . . . 73.329999999999998 111.601 176.764 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 3.1 p -69.36 -26.48 31.58 Favored 'Isoleucine or valine' 0 CA--C 1.56 1.338 0 C-N-CA 122.368 0.267 . . . . 74.219999999999999 111.603 177.864 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -73.89 -55.35 6.29 Favored 'General case' 0 N--CA 1.48 1.046 0 C-N-CA 123.242 0.617 . . . . 73.230000000000004 111.272 178.673 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 12' ' ' ILE . . . . . 0.535 ' O ' ' HG ' ' A' ' 16' ' ' LEU . 16.3 pt -57.3 -53.28 45.81 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.039 0 C-N-CA 122.943 0.497 . . . . 72.299999999999997 111.435 -179.853 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 80.1 mt -66.6 -32.81 59.71 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.967 0 C-N-CA 123.777 0.831 . . . . 71.120000000000005 110.869 -179.56 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -60.81 -42.37 99.49 Favored Glycine 0 C--N 1.353 1.481 0 O-C-N 123.628 0.58 . . . . 74.439999999999998 113.651 176.796 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 1.8 mp -75.74 -34.93 29.57 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.255 0 C-N-CA 122.856 0.462 . . . . 62.539999999999999 110.408 177.249 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 16' ' ' LEU . . . . . 0.535 ' HG ' ' O ' ' A' ' 12' ' ' ILE . 19.3 mt -62.31 -39.06 91.79 Favored 'General case' 0 N--CA 1.489 1.523 0 C-N-CA 122.377 0.271 . . . . 73.549999999999997 111.089 176.409 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -74.28 -39.9 62.66 Favored 'General case' 0 N--CA 1.477 0.888 0 C-N-CA 123.529 0.732 . . . . 71.430000000000007 110.944 177.501 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -62.48 -24.06 67.25 Favored 'General case' 0 N--CA 1.483 1.176 0 C-N-CA 123.894 0.878 . . . . 74.299999999999997 112.947 178.835 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 2.8 pp -96.85 -37.63 7.25 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.208 0 N-CA-C 111.846 0.313 . . . . 72.540000000000006 111.846 171.723 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -67.62 -48.47 66.67 Favored 'General case' 0 N--CA 1.493 1.713 0 N-CA-C 112.891 0.701 . . . . 73.140000000000001 112.891 -173.011 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 27.9 mt -58.79 -52.56 73.85 Favored Pre-proline 0 CA--C 1.556 1.199 0 CA-C-O 118.059 -0.972 . . . . 74.209999999999994 113.18 -178.565 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 42.9 Cg_endo -67.09 -36.96 20.16 Favored 'Trans proline' 0 C--N 1.378 2.101 0 CA-C-N 121.77 1.668 . . . . 54.439999999999998 113.123 174.115 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 28.6 tt0 -66.64 -32.45 73.78 Favored 'General case' 0 N--CA 1.491 1.599 0 C-N-CA 122.854 0.462 . . . . 64.319999999999993 110.52 -177.627 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 24' ' ' PHE . . . . . . . . . . . . . 85.5 t80 -90.09 -40.06 12.51 Favored 'General case' 0 N--CA 1.487 1.396 0 CA-C-N 115.366 -0.833 . . . . 63.109999999999999 111.406 -178.5 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 34.8 t -56.91 -55.24 37.08 Favored 'General case' 0 N--CA 1.488 1.449 0 C-N-CA 122.849 0.459 . . . . 55.299999999999997 110.837 172.645 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -61.89 -26.32 68.08 Favored 'General case' 0 N--CA 1.487 1.399 0 C-N-CA 123.357 0.663 . . . . 74.530000000000001 112.571 175.336 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 57.5 t80 -70.81 -51.74 24.89 Favored 'General case' 0 N--CA 1.48 1.052 0 C-N-CA 123.119 0.568 . . . . 72.430000000000007 111.104 178.534 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 13.6 ptm180 -70.53 -21.57 62.71 Favored 'General case' 0 N--CA 1.475 0.824 0 C-N-CA 123.184 0.593 . . . . 74.319999999999993 111.108 -177.707 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 49.1 t -73.96 -52.79 19.39 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.969 0 CA-C-N 115.989 -0.551 . . . . 64.239999999999995 109.884 172.939 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 21.1 ptmt -70.74 -15.92 62.73 Favored 'General case' 0 N--CA 1.489 1.485 0 C-N-CA 122.773 0.429 . . . . 74.430000000000007 111.379 179.17 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -76.64 -36.46 57.39 Favored 'General case' 0 N--CA 1.481 1.1 0 CA-C-O 121.547 0.689 . . . . 64.010000000000005 109.737 172.964 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 33.4 t80 -83.61 -19.04 36.2 Favored 'General case' 0 N--CA 1.48 1.036 0 CA-C-N 115.133 -0.94 . . . . 74.310000000000002 111.87 -179.735 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 3.8 m-20 -92.63 -56.46 3.01 Favored 'General case' 0 N--CA 1.473 0.722 0 CA-C-N 115.556 -0.747 . . . . 75.200000000000003 111.069 175.97 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 46.0 t -88.97 -51.71 5.47 Favored 'General case' 0 N--CA 1.497 1.882 0 CA-C-N 116.247 -0.433 . . . . 64.049999999999997 111.585 -168.802 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -71.7 -24.8 61.88 Favored 'General case' 0 N--CA 1.484 1.275 0 C-N-CA 122.656 0.382 . . . . 64.430000000000007 111.966 -178.148 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -79.43 -37.25 37.5 Favored 'General case' 0 N--CA 1.481 1.1 0 C-N-CA 122.478 0.311 . . . . 71.040000000000006 110.805 174.246 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 37.9 t -61.62 -43.47 98.8 Favored 'General case' 0 N--CA 1.494 1.748 0 C-N-CA 123.075 0.55 . . . . 75.150000000000006 111.507 173.245 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 80.1 p -75.83 -27.51 57.89 Favored 'General case' 0 N--CA 1.481 1.107 0 C-N-CA 124.127 0.971 . . . . 54.149999999999999 111.637 -177.909 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 16.8 t70 -63.08 -48.03 80.35 Favored 'General case' 0 CA--C 1.553 1.071 0 O-C-N 123.419 0.449 . . . . 64.349999999999994 110.712 169.159 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 40' ' ' LEU . . . . . 0.471 HD23 HD12 ' A' ' 43' ' ' LEU . 96.2 mt -71.04 -26.94 63.31 Favored 'General case' 0 N--CA 1.484 1.253 0 C-N-CA 123.199 0.6 . . . . 64.439999999999998 111.244 179.317 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 27.9 tpt180 -72.22 -37.84 69.09 Favored 'General case' 0 CA--C 1.548 0.883 0 C-N-CA 123.894 0.878 . . . . 64.109999999999999 110.136 174.845 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 44.7 t-20 -65.95 -38.89 89.77 Favored 'General case' 0 CA--C 1.56 1.329 0 C-N-CA 124.197 0.999 . . . . 55.350000000000001 110.36 174.447 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 43' ' ' LEU . . . . . 0.471 HD12 HD23 ' A' ' 40' ' ' LEU . 96.0 mt -69.5 -33.08 72.33 Favored 'General case' 0 N--CA 1.482 1.125 0 C-N-CA 123.167 0.587 . . . . 65.010000000000005 110.979 175.97 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 44' ' ' LYS . . . . . 0.451 ' O ' ' HG2' ' A' ' 48' ' ' GLU . 60.7 tttp -73.78 -46.42 45.71 Favored 'General case' 0 N--CA 1.474 0.767 0 CA-C-N 116.102 -0.499 . . . . 65.329999999999998 110.51 179.93 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 3.7 t -64.01 -32.27 73.75 Favored 'General case' 0 N--CA 1.487 1.389 0 C-N-CA 123.573 0.749 . . . . 70.299999999999997 111.168 -174.58 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -68.88 -43.46 75.28 Favored 'General case' 0 N--CA 1.478 0.945 0 CA-C-N 115.035 -0.984 . . . . 74.299999999999997 111.679 171.521 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 9.7 tt -60.7 -39.89 90.21 Favored 'General case' 0 N--CA 1.483 1.179 0 C-N-CA 123.976 0.911 . . . . 70.319999999999993 110.609 176.514 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 48' ' ' GLU . . . . . 0.451 ' HG2' ' O ' ' A' ' 44' ' ' LYS . 60.8 mm-40 -65.31 -47.87 75.06 Favored 'General case' 0 N--CA 1.476 0.85 0 C-N-CA 123.244 0.618 . . . . 74.530000000000001 110.499 179.988 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 59.5 m -61.33 -31.92 71.79 Favored 'General case' 0 N--CA 1.483 1.186 0 C-N-CA 123.356 0.663 . . . . 74.450000000000003 112.08 179.543 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -78.5 -52.1 9.01 Favored 'General case' 0 N--CA 1.482 1.156 0 C-N-CA 123.205 0.602 . . . . 72.519999999999996 111.965 -178.507 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 51' ' ' PHE . . . . . . . . . . . . . 70.6 m-85 . . . . . 0 N--CA 1.482 1.138 0 N-CA-C 113.482 0.919 . . . . 55.240000000000002 113.482 -170.207 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 38.8 p . . . . . 0 N--CA 1.495 1.775 0 CA-C-O 121.081 0.467 . . . . 75.439999999999998 111.229 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 44.4 mt -67.84 -19.04 65.01 Favored 'General case' 0 N--CA 1.484 1.271 0 C-N-CA 124.112 0.965 . . . . 75.510000000000005 111.846 178.64 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 46.6 mm -87.65 -48.96 14.96 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.167 0 CA-C-N 115.437 -0.801 . . . . 74.140000000000001 111.083 -175.362 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 9.0 tp10 -54.12 -47.66 71.61 Favored 'General case' 0 N--CA 1.475 0.78 0 C-N-CA 124.046 0.938 . . . . 55.020000000000003 110.959 175.941 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 3.0 pp -64.7 -37.08 86.37 Favored 'General case' 0 N--CA 1.48 1.069 0 C-N-CA 122.843 0.457 . . . . 74.340000000000003 111.951 -178.539 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 61.2 tp -59.31 -45.66 90.69 Favored 'General case' 0 CA--C 1.547 0.864 0 C-N-CA 123.495 0.718 . . . . 74.200000000000003 111.36 175.093 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 94.1 mt -68.4 -39.74 81.26 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.039 0 C-N-CA 124.272 1.029 . . . . 74.310000000000002 111.967 178.779 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 48.5 t -60.82 -47.9 91.23 Favored 'Isoleucine or valine' 0 CA--C 1.554 1.13 0 C-N-CA 123.645 0.778 . . . . 73.319999999999993 111.454 175.485 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 76.7 t -64.39 -32.16 56.49 Favored 'Isoleucine or valine' 0 CA--C 1.558 1.269 0 C-N-CA 123.323 0.649 . . . . 74.430000000000007 111.571 176.086 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -65.73 -57.22 8.54 Favored 'General case' 0 N--CA 1.482 1.156 0 C-N-CA 122.983 0.513 . . . . 72.140000000000001 111.584 176.181 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 12' ' ' ILE . . . . . 0.574 ' HA ' HD12 ' A' ' 15' ' ' ILE . 22.5 pt -66.14 -42.39 91.17 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.011 0 C-N-CA 123.548 0.739 . . . . 62.420000000000002 112.054 -175.122 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 58.2 mt -65.2 -34.88 73.57 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.13 0 C-N-CA 123.764 0.825 . . . . 71.120000000000005 110.57 174.149 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -60.67 -37.33 93.31 Favored Glycine 0 C--N 1.353 1.525 0 CA-C-N 115.674 -0.694 . . . . 42.109999999999999 112.67 174.402 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 15' ' ' ILE . . . . . 0.574 HD12 ' HA ' ' A' ' 12' ' ' ILE . 21.8 mt -71.31 -46.96 62.45 Favored 'Isoleucine or valine' 0 C--N 1.353 0.742 0 C-N-CA 123.577 0.751 . . . . 72.420000000000002 110.976 175.872 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 16' ' ' LEU . . . . . 0.481 ' HG ' ' O ' ' A' ' 12' ' ' ILE . 21.4 mt -56.2 -43.47 78.51 Favored 'General case' 0 N--CA 1.488 1.472 0 C-N-CA 123.378 0.671 . . . . 73.400000000000006 111.35 -178.554 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -74.78 -47.53 30.4 Favored 'General case' 0 CA--C 1.544 0.749 0 C-N-CA 123.36 0.664 . . . . 40.299999999999997 111.209 -178.078 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -63.91 -23.01 67.18 Favored 'General case' 0 N--CA 1.484 1.253 0 N-CA-C 113.037 0.755 . . . . 70.439999999999998 113.037 -177.926 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 2.7 pp -90.3 -38.19 10.58 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.195 0 CA-C-N 118.151 0.432 . . . . 72.340000000000003 111.502 171.973 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -63.96 -50.31 69.1 Favored 'General case' 0 N--CA 1.487 1.401 0 C-N-CA 123.549 0.74 . . . . 70.340000000000003 112.704 -175.309 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 28.5 mt -55.44 -55.51 39.21 Favored Pre-proline 0 CA--C 1.558 1.271 0 CA-C-O 118.149 -0.929 . . . . 53.350000000000001 113.308 -175.621 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 40.4 Cg_endo -66.31 -40.77 13.91 Favored 'Trans proline' 0 C--N 1.379 2.171 0 CA-C-N 121.323 1.508 . . . . 63.119999999999997 112.991 175.979 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 21.3 tt0 -62.56 -38.03 88.44 Favored 'General case' 0 N--CA 1.486 1.366 0 C-N-CA 123.273 0.629 . . . . 74.049999999999997 111.034 -175.595 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 24' ' ' PHE . . . . . . . . . . . . . 26.7 m-85 -96.28 -32.39 12.44 Favored 'General case' 0 N--CA 1.485 1.316 0 CA-C-N 115.082 -0.963 . . . . 63.149999999999999 112.104 -173.348 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 47.0 t -62.96 -55.11 28.72 Favored 'General case' 0 N--CA 1.49 1.567 0 N-CA-C 109.853 -0.425 . . . . 74.109999999999999 109.853 171.181 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -62.18 -27.06 68.71 Favored 'General case' 0 N--CA 1.483 1.204 0 C-N-CA 123.913 0.885 . . . . 43.329999999999998 112.495 177.749 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 87.9 t80 -65.42 -54.07 33.95 Favored 'General case' 0 N--CA 1.484 1.275 0 C-N-CA 122.745 0.418 . . . . 72.230000000000004 110.726 175.053 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 49.8 mtp180 -69.99 -24.3 63.29 Favored 'General case' 0 N--CA 1.481 1.121 0 C-N-CA 123.485 0.714 . . . . 73.209999999999994 111.8 -178.578 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 24.7 t -72.48 -46.17 56.72 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.266 0 CA-C-N 116.02 -0.537 . . . . 75.319999999999993 110.6 175.471 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 18.8 ptmt -79.02 -16.9 56.23 Favored 'General case' 0 N--CA 1.48 1.029 0 CA-C-N 115.715 -0.675 . . . . 72.310000000000002 111.114 178.178 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -81.9 -29.18 32.49 Favored 'General case' 0 N--CA 1.486 1.364 0 C-N-CA 123.233 0.613 . . . . 61.109999999999999 110.129 174.013 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 62.5 t80 -62.79 -53.77 49.14 Favored 'General case' 0 C--O 1.21 -1.013 0 N-CA-C 108.945 -0.761 . . . . 72.430000000000007 108.945 168.559 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 3.4 m-20 -57.23 -43.24 82.69 Favored 'General case' 0 N--CA 1.487 1.384 0 C-N-CA 123.898 0.879 . . . . 73.409999999999997 112.334 175.477 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 35.5 t -62.54 -65.94 0.61 Allowed 'General case' 0 N--CA 1.484 1.258 0 C-N-CA 123.17 0.588 . . . . 74.329999999999998 111.11 -179.86 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -65.09 -31.36 72.54 Favored 'General case' 0 N--CA 1.481 1.081 0 N-CA-C 113.016 0.747 . . . . 73.209999999999994 113.016 -176.165 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -69.46 -60.57 2.25 Favored 'General case' 0 N--CA 1.492 1.668 0 CA-C-N 117.608 0.186 . . . . 65.140000000000001 111.248 177.29 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 48.7 m -66.37 -25.06 66.62 Favored 'General case' 0 N--CA 1.484 1.257 0 C-N-CA 123.023 0.529 . . . . 72.329999999999998 112.401 -177.909 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 42.4 t -75.98 -39.26 56.28 Favored 'General case' 0 N--CA 1.491 1.603 0 C-N-CA 123.021 0.528 . . . . 64.030000000000001 111.088 176.163 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 28.2 t70 -58.01 -50.73 72.4 Favored 'General case' 0 N--CA 1.481 1.116 0 C-N-CA 123.059 0.544 . . . . 74.129999999999995 110.369 170.186 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 95.1 mt -65.01 -38.81 92.15 Favored 'General case' 0 N--CA 1.478 0.943 0 CA-C-N 115.066 -0.97 . . . . 71.439999999999998 110.937 -176.155 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 36.4 ttt180 -71.37 -54.49 10.58 Favored 'General case' 0 CA--C 1.542 0.644 0 C-N-CA 123.385 0.674 . . . . 64.219999999999999 110.678 -179.134 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 2.8 t-20 -57.55 -41.64 81.37 Favored 'General case' 0 N--CA 1.488 1.473 0 C-N-CA 124.059 0.943 . . . . 70.0 112.348 -175.06 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 98.1 mt -72.44 -47.14 51.35 Favored 'General case' 0 N--CA 1.48 1.069 0 C-N-CA 122.924 0.49 . . . . 70.230000000000004 111.083 -179.675 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 36.4 ttpt -67.27 -46.33 73.97 Favored 'General case' 0 N--CA 1.481 1.09 0 C-N-CA 123.525 0.73 . . . . 73.430000000000007 110.967 -173.893 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 45' ' ' THR . . . . . 0.519 ' HA ' ' HG2' ' A' ' 48' ' ' GLU . 1.8 t -71.76 -33.86 68.99 Favored 'General case' 0 N--CA 1.472 0.655 0 CA-C-N 115.056 -0.974 . . . . 72.239999999999995 111.357 -173.936 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -68.81 -43.06 76.38 Favored 'General case' 0 N--CA 1.475 0.791 0 CA-C-N 115.885 -0.598 . . . . 71.519999999999996 110.492 176.513 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 1.8 pp -75.96 -32.99 59.78 Favored 'General case' 0 N--CA 1.481 1.104 0 C-N-CA 122.653 0.381 . . . . 74.400000000000006 111.61 -177.073 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 48' ' ' GLU . . . . . 0.519 ' HG2' ' HA ' ' A' ' 45' ' ' THR . 11.0 pt-20 -78.6 -36.07 44.81 Favored 'General case' 0 N--CA 1.489 1.513 0 CA-C-N 117.756 0.253 . . . . 53.049999999999997 111.314 -178.208 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 67.8 m -68.59 -35.0 76.75 Favored 'General case' 0 N--CA 1.485 1.315 0 C-N-CA 123.083 0.553 . . . . 74.530000000000001 110.326 173.334 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -65.83 -42.9 89.99 Favored 'General case' 0 N--CA 1.474 0.739 0 CA-C-N 115.397 -0.819 . . . . 73.519999999999996 110.657 172.825 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 51' ' ' PHE . . . . . . . . . . . . . 61.0 t80 . . . . . 0 N--CA 1.483 1.182 0 C-N-CA 123.783 0.833 . . . . 74.310000000000002 111.468 178.994 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 2' ' ' THR . . . . . 0.595 HG22 ' H ' ' A' ' 4' ' ' ILE . 22.1 m . . . . . 0 N--CA 1.482 1.165 0 CA-C-O 120.631 0.253 . . . . 73.340000000000003 111.3 . . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 2.8 mm? -64.63 -18.16 64.68 Favored 'General case' 0 N--CA 1.49 1.563 0 C-N-CA 123.923 0.889 . . . . 73.430000000000007 111.908 178.859 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 4' ' ' ILE . . . . . 0.595 ' H ' HG22 ' A' ' 2' ' ' THR . 50.6 mm -71.18 -39.68 73.78 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.267 0 C-N-CA 123.599 0.76 . . . . 72.219999999999999 110.276 175.223 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 43.3 mt-10 -54.82 -48.26 73.04 Favored 'General case' 0 N--CA 1.485 1.275 0 C-N-CA 123.044 0.538 . . . . 65.230000000000004 111.407 175.671 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -60.96 -37.29 81.86 Favored 'General case' 0 N--CA 1.488 1.454 0 O-C-N 123.567 0.542 . . . . 73.5 110.733 -179.311 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 34.0 tp -68.6 -34.06 75.12 Favored 'General case' 0 CA--C 1.551 1.016 0 C-N-CA 123.455 0.702 . . . . 73.299999999999997 112.222 179.77 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 89.1 mt -73.62 -45.69 50.25 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.639 0 C-N-CA 123.355 0.662 . . . . 72.049999999999997 110.943 175.392 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 73.3 t -62.1 -42.93 96.93 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.868 0 C-N-CA 123.624 0.77 . . . . 51.32 111.618 179.493 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 6.1 p -68.93 -31.45 50.59 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.074 0 O-C-N 122.205 -0.309 . . . . 74.140000000000001 111.519 177.321 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -69.07 -53.49 20.07 Favored 'General case' 0 C--N 1.361 1.087 0 C-N-CA 122.775 0.43 . . . . 73.099999999999994 111.437 178.661 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 12' ' ' ILE . . . . . 0.587 ' HA ' HD12 ' A' ' 15' ' ' ILE . 29.6 pt -65.17 -45.57 93.58 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.953 0 C-N-CA 123.306 0.643 . . . . 63.25 111.636 -178.346 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 1.7 mp -61.93 -32.89 55.6 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.532 0 C-N-CA 123.717 0.807 . . . . 74.400000000000006 110.457 174.253 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -58.91 -40.3 95.11 Favored Glycine 0 C--N 1.355 1.614 0 O-C-N 123.5 0.5 . . . . 53.109999999999999 112.618 174.146 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 15' ' ' ILE . . . . . 0.587 HD12 ' HA ' ' A' ' 12' ' ' ILE . 19.2 mt -72.13 -46.81 57.09 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.748 0 C-N-CA 124.049 0.94 . . . . 71.140000000000001 110.902 175.843 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 16' ' ' LEU . . . . . 0.527 ' HG ' ' O ' ' A' ' 12' ' ' ILE . 25.6 mt -59.74 -37.77 79.89 Favored 'General case' 0 N--CA 1.482 1.137 0 C-N-CA 123.549 0.739 . . . . 63.109999999999999 111.6 -176.749 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -75.97 -48.03 22.7 Favored 'General case' 0 N--CA 1.474 0.756 0 C-N-CA 123.103 0.561 . . . . 63.210000000000001 110.381 178.344 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -56.92 -26.85 60.09 Favored 'General case' 0 N--CA 1.481 1.087 0 N-CA-C 113.249 0.833 . . . . 70.439999999999998 113.249 -179.139 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 2.8 pp -91.18 -38.27 10.37 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.982 0 N-CA-C 111.758 0.281 . . . . 63.130000000000003 111.758 172.117 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -64.72 -50.41 67.04 Favored 'General case' 0 N--CA 1.489 1.483 0 N-CA-C 113.204 0.816 . . . . 71.129999999999995 113.204 -171.374 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 2.4 mp -63.78 -53.06 53.21 Favored Pre-proline 0 CA--C 1.563 1.451 0 CA-C-O 118.544 -0.741 . . . . 71.219999999999999 112.461 -174.035 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 36.7 Cg_endo -63.7 -35.49 57.68 Favored 'Trans proline' 0 C--N 1.38 2.194 0 C-N-CA 121.895 1.73 . . . . 70.030000000000001 113.374 175.025 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 29.9 tt0 -66.14 -38.78 88.96 Favored 'General case' 0 N--CA 1.487 1.382 0 C-N-CA 123.034 0.533 . . . . 71.319999999999993 110.259 179.899 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 24' ' ' PHE . . . . . . . . . . . . . 79.9 t80 -79.69 -38.79 32.75 Favored 'General case' 0 N--CA 1.487 1.423 0 CA-C-N 114.742 -1.117 . . . . 71.129999999999995 110.67 -176.241 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 25' ' ' SER . . . . . 0.404 ' O ' HG23 ' A' ' 29' ' ' VAL . 47.8 t -56.44 -59.19 5.33 Favored 'General case' 0 N--CA 1.475 0.798 0 C-N-CA 123.696 0.798 . . . . 75.019999999999996 109.244 172.25 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -57.56 -29.31 64.32 Favored 'General case' 0 N--CA 1.48 1.057 0 C-N-CA 124.141 0.976 . . . . 54.100000000000001 112.652 177.444 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 64.3 t80 -75.19 -47.92 26.04 Favored 'General case' 0 N--CA 1.483 1.196 0 C-N-CA 123.173 0.589 . . . . 62.32 111.361 -177.145 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 40.6 ptt180 -78.28 -21.38 49.84 Favored 'General case' 0 N--CA 1.48 1.044 0 CA-C-N 115.589 -0.732 . . . . 72.049999999999997 110.935 -178.92 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 29' ' ' VAL . . . . . 0.404 HG23 ' O ' ' A' ' 25' ' ' SER . 42.9 t -72.99 -54.42 15.83 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.027 0 N-CA-C 109.485 -0.561 . . . . 72.329999999999998 109.485 172.797 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 14.3 ptmm? -65.29 -20.27 66.33 Favored 'General case' 0 N--CA 1.489 1.519 0 C-N-CA 122.49 0.316 . . . . 64.430000000000007 111.235 178.541 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -68.62 -44.86 73.34 Favored 'General case' 0 N--CA 1.476 0.859 0 CA-C-O 121.404 0.621 . . . . 64.230000000000004 109.94 170.531 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 30.9 t80 -83.8 -12.02 56.24 Favored 'General case' 0 N--CA 1.481 1.108 0 CA-C-N 114.97 -1.013 . . . . 73.310000000000002 112.543 -177.066 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 3.6 m-20 -96.57 -54.11 3.35 Favored 'General case' 0 N--CA 1.478 0.971 0 C-N-CA 123.441 0.696 . . . . 73.340000000000003 110.432 176.874 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 46.6 t -77.7 -51.24 10.89 Favored 'General case' 0 N--CA 1.494 1.754 0 CA-C-N 115.98 -0.555 . . . . 72.019999999999996 111.658 -171.139 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -68.72 -28.73 67.09 Favored 'General case' 0 N--CA 1.483 1.182 0 C-N-CA 122.602 0.361 . . . . 53.329999999999998 111.567 179.647 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -69.98 -42.82 72.62 Favored 'General case' 0 N--CA 1.482 1.14 0 C-N-CA 122.49 0.316 . . . . 62.420000000000002 111.024 175.122 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 37' ' ' SER . . . . . 0.42 ' O ' ' HG2' ' A' ' 41' ' ' ARG . 71.1 m -59.86 -46.84 88.02 Favored 'General case' 0 N--CA 1.482 1.169 0 C-N-CA 122.807 0.443 . . . . 61.210000000000001 110.797 173.406 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 50.6 m -66.69 -31.55 72.29 Favored 'General case' 0 N--CA 1.481 1.113 0 C-N-CA 123.664 0.785 . . . . 72.430000000000007 112.031 -178.354 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 28.8 t70 -60.21 -51.03 71.29 Favored 'General case' 0 N--CA 1.477 0.882 0 C-N-CA 123.24 0.616 . . . . 75.439999999999998 110.454 171.052 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 85.7 mt -70.89 -30.93 67.42 Favored 'General case' 0 N--CA 1.481 1.119 0 C-N-CA 123.388 0.675 . . . . 51.420000000000002 111.585 -175.769 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 41' ' ' ARG . . . . . 0.42 ' HG2' ' O ' ' A' ' 37' ' ' SER . 14.7 mmt180 -78.32 -32.74 49.41 Favored 'General case' 0 N--CA 1.48 1.067 0 CA-C-N 115.777 -0.647 . . . . 72.310000000000002 110.408 177.853 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 64.1 t30 -64.93 -38.87 92.4 Favored 'General case' 0 N--CA 1.484 1.248 0 C-N-CA 123.14 0.576 . . . . 74.299999999999997 110.432 172.56 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 43' ' ' LEU . . . . . 0.491 ' O ' HD13 ' A' ' 47' ' ' LEU . 94.3 mt -70.42 -42.69 71.29 Favored 'General case' 0 N--CA 1.479 1.0 0 C-N-CA 123.304 0.641 . . . . 64.140000000000001 110.407 178.607 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 44' ' ' LYS . . . . . 0.483 ' O ' ' HG2' ' A' ' 48' ' ' GLU . 3.7 tppp? -68.84 -51.06 44.55 Favored 'General case' 0 N--CA 1.466 0.353 0 CA-C-N 115.934 -0.576 . . . . 63.130000000000003 110.074 -175.487 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 1.7 t -61.84 -33.6 74.46 Favored 'General case' 0 N--CA 1.486 1.328 0 C-N-CA 123.933 0.893 . . . . 60.32 111.786 -178.392 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -63.62 -47.69 80.35 Favored 'General case' 0 N--CA 1.482 1.165 0 C-N-CA 123.757 0.823 . . . . 72.120000000000005 111.41 174.926 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 47' ' ' LEU . . . . . 0.491 HD13 ' O ' ' A' ' 43' ' ' LEU . 9.2 mp -65.49 -41.22 93.49 Favored 'General case' 0 CA--C 1.554 1.118 0 CA-C-N 115.51 -0.768 . . . . 75.129999999999995 111.791 176.559 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 48' ' ' GLU . . . . . 0.483 ' HG2' ' O ' ' A' ' 44' ' ' LYS . 11.2 mm-40 -65.48 -41.96 92.73 Favored 'General case' 0 N--CA 1.482 1.161 0 C-N-CA 122.553 0.341 . . . . 75.239999999999995 110.839 -178.346 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 68.1 m -69.79 -28.01 65.38 Favored 'General case' 0 N--CA 1.485 1.315 0 C-N-CA 123.191 0.596 . . . . 63.32 112.037 177.725 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -75.66 -53.15 9.02 Favored 'General case' 0 N--CA 1.48 1.036 0 C-N-CA 122.891 0.476 . . . . 72.319999999999993 110.765 -178.15 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 51' ' ' PHE . . . . . . . . . . . . . 44.9 m-85 . . . . . 0 N--CA 1.482 1.15 0 CA-C-N 115.176 -0.92 . . . . 71.319999999999993 112.569 -174.868 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 66.2 p . . . . . 0 N--CA 1.494 1.751 0 N-CA-C 112.066 0.395 . . . . 72.239999999999995 112.066 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 3' ' ' LEU . . . . . 0.403 HD23 HD12 ' A' ' 6' ' ' LEU . 63.0 mt -57.33 -23.41 48.64 Favored 'General case' 0 N--CA 1.487 1.396 0 C-N-CA 123.828 0.851 . . . . 64.099999999999994 111.54 174.285 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 50.7 mm -66.79 -53.29 36.08 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.873 0 CA-C-N 115.155 -0.929 . . . . 72.329999999999998 110.339 172.83 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 48.2 mm-40 -64.45 -31.76 73.11 Favored 'General case' 0 N--CA 1.485 1.318 0 C-N-CA 123.546 0.738 . . . . 65.420000000000002 112.366 179.654 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 6' ' ' LEU . . . . . 0.403 HD12 HD23 ' A' ' 3' ' ' LEU . 92.9 mt -66.59 -45.33 79.57 Favored 'General case' 0 N--CA 1.481 1.085 0 C-N-CA 123.242 0.617 . . . . 43.43 110.923 173.935 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 40.9 tp -58.85 -43.28 90.75 Favored 'General case' 0 CA--C 1.551 1.004 0 C-N-CA 123.411 0.685 . . . . 72.109999999999999 111.488 175.378 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 96.6 mt -67.99 -47.36 79.26 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.866 0 C-N-CA 124.227 1.011 . . . . 71.340000000000003 112.927 179.626 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 8.3 p -64.67 -40.24 88.39 Favored 'Isoleucine or valine' 0 C--N 1.357 0.901 0 CA-C-N 118.44 0.563 . . . . 35.32 111.481 -177.812 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 76.6 t -66.67 -39.14 83.07 Favored 'Isoleucine or valine' 0 CA--C 1.555 1.141 0 C-N-CA 123.13 0.572 . . . . 73.109999999999999 111.026 173.827 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -64.91 -47.42 77.84 Favored 'General case' 0 N--CA 1.482 1.133 0 C-N-CA 122.941 0.497 . . . . 74.200000000000003 111.853 -179.84 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 12' ' ' ILE . . . . . 0.618 ' HA ' HD12 ' A' ' 15' ' ' ILE . 2.7 pp -68.89 -40.16 80.81 Favored 'Isoleucine or valine' 0 C--N 1.355 0.81 0 CA-C-O 119.042 -0.504 . . . . 72.319999999999993 111.416 -177.261 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 58.5 mt -60.92 -33.32 55.11 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.253 0 C-N-CA 123.564 0.746 . . . . 75.319999999999993 110.95 173.289 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -59.87 -43.44 98.01 Favored Glycine 0 C--N 1.352 1.444 0 CA-C-N 115.882 -0.599 . . . . 74.430000000000007 112.548 173.111 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 15' ' ' ILE . . . . . 0.618 HD12 ' HA ' ' A' ' 12' ' ' ILE . 18.7 mt -70.33 -43.94 77.97 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.738 0 C-N-CA 123.528 0.731 . . . . 74.019999999999996 111.066 178.455 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 16' ' ' LEU . . . . . 0.513 ' HG ' ' O ' ' A' ' 12' ' ' ILE . 23.8 mt -57.62 -41.67 81.8 Favored 'General case' 0 N--CA 1.483 1.18 0 C-N-CA 123.346 0.658 . . . . 64.439999999999998 111.121 -177.996 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -70.72 -51.16 29.22 Favored 'General case' 0 N--CA 1.474 0.757 0 CA-C-O 121.239 0.543 . . . . 60.329999999999998 110.8 178.592 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -61.35 -21.59 64.15 Favored 'General case' 0 CA--C 1.55 0.979 0 N-CA-C 113.372 0.878 . . . . 73.219999999999999 113.372 -177.266 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 2.7 pp -94.2 -39.18 10.19 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.09 0 CA-C-N 118.004 0.366 . . . . 72.010000000000005 111.782 172.387 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -69.56 -52.78 23.03 Favored 'General case' 0 N--CA 1.485 1.295 0 N-CA-C 112.42 0.526 . . . . 62.509999999999998 112.42 -171.415 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 2.4 mp -54.51 -54.97 42.72 Favored Pre-proline 0 CA--C 1.568 1.641 0 CA-C-O 118.119 -0.943 . . . . 73.120000000000005 112.272 -176.722 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 29.0 Cg_endo -63.2 -42.75 21.44 Favored 'Trans proline' 0 C--N 1.381 2.282 0 C-N-CA 121.963 1.775 . . . . 74.150000000000006 113.64 176.823 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 46.9 tt0 -62.76 -42.29 99.61 Favored 'General case' 0 N--CA 1.486 1.366 0 C-N-CA 124.061 0.944 . . . . 75.510000000000005 110.996 -175.333 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 24' ' ' PHE . . . . . . . . . . . . . 44.4 m-85 -90.62 -25.68 20.02 Favored 'General case' 0 N--CA 1.482 1.128 0 CA-C-N 114.27 -1.332 . . . . 72.329999999999998 111.136 -174.764 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 43.9 t -63.62 -59.23 4.87 Favored 'General case' 0 N--CA 1.48 1.04 0 N-CA-C 108.644 -0.872 . . . . 52.450000000000003 108.644 170.069 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -55.84 -32.65 63.81 Favored 'General case' 0 N--CA 1.479 1.019 0 C-N-CA 123.841 0.856 . . . . 72.129999999999995 112.971 177.222 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 19.6 t80 -72.74 -49.6 30.02 Favored 'General case' 0 N--CA 1.486 1.353 0 C-N-CA 123.168 0.587 . . . . 62.43 111.822 -179.6 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 70.4 mtp180 -81.36 -16.19 53.05 Favored 'General case' 0 N--CA 1.48 1.072 0 C-N-CA 123.286 0.635 . . . . 62.539999999999999 111.62 -177.076 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 73.5 t -90.17 -32.43 5.52 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.635 0 C-N-CA 122.651 0.381 . . . . 74.420000000000002 110.828 175.365 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 19.3 ptmt -74.14 -23.83 59.33 Favored 'General case' 0 N--CA 1.488 1.464 0 N-CA-C 109.279 -0.637 . . . . 72.430000000000007 109.279 170.121 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -72.74 -36.56 67.77 Favored 'General case' 0 C--N 1.359 0.988 0 C-N-CA 122.778 0.431 . . . . 63.149999999999999 110.094 171.887 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 83.1 t80 -60.02 -56.41 22.05 Favored 'General case' 0 N--CA 1.478 0.926 0 CA-C-N 115.688 -0.687 . . . . 64.200000000000003 110.02 171.71 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 5.4 m-20 -55.49 -53.71 52.92 Favored 'General case' 0 N--CA 1.48 1.057 0 C-N-CA 124.505 1.122 . . . . 71.109999999999999 112.683 177.985 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 32.1 t -66.87 -52.33 44.8 Favored 'General case' 0 N--CA 1.492 1.63 0 C-N-CA 122.92 0.488 . . . . 62.219999999999999 111.811 -173.821 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -64.0 -42.51 97.14 Favored 'General case' 0 N--CA 1.475 0.82 0 CA-C-O 119.094 -0.479 . . . . 62.32 111.832 179.347 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -66.33 -48.38 70.45 Favored 'General case' 0 N--CA 1.495 1.825 0 N-CA-C 111.942 0.349 . . . . 64.040000000000006 111.942 -177.931 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 37' ' ' SER . . . . . 0.494 ' O ' ' HG2' ' A' ' 41' ' ' ARG . 70.9 m -63.38 -49.44 73.81 Favored 'General case' 0 N--CA 1.483 1.183 0 C-N-CA 123.284 0.634 . . . . 74.319999999999993 111.612 179.689 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 47.1 t -72.78 -26.63 61.6 Favored 'General case' 0 N--CA 1.486 1.365 0 N-CA-C 112.337 0.495 . . . . 63.119999999999997 112.337 -177.678 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 27.6 t70 -62.52 -49.79 73.94 Favored 'General case' 0 N--CA 1.482 1.131 0 C-N-CA 122.758 0.423 . . . . 64.019999999999996 111.206 171.514 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 40' ' ' LEU . . . . . 0.417 ' HG ' ' O ' ' A' ' 37' ' ' SER . 4.0 pp -72.34 -21.92 61.25 Favored 'General case' 0 N--CA 1.488 1.44 0 CA-C-O 120.758 0.314 . . . . 72.310000000000002 111.315 -175.274 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 41' ' ' ARG . . . . . 0.494 ' HG2' ' O ' ' A' ' 37' ' ' SER . 27.1 mmt180 -80.1 -39.72 29.01 Favored 'General case' 0 N--CA 1.485 1.281 0 C-N-CA 123.13 0.572 . . . . 75.510000000000005 110.758 171.95 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 42' ' ' ASN . . . . . 0.411 ' O ' HG22 ' A' ' 45' ' ' THR . 61.1 t30 -68.02 -40.77 82.88 Favored 'General case' 0 N--CA 1.488 1.464 0 C-N-CA 123.534 0.734 . . . . 74.109999999999999 112.408 -178.095 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 4.3 pp -72.89 -29.87 63.49 Favored 'General case' 0 N--CA 1.485 1.318 0 O-C-N 122.083 -0.386 . . . . 52.539999999999999 110.727 177.025 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 44.5 tttm -67.86 -40.22 83.68 Favored 'General case' 0 N--CA 1.471 0.612 0 C-N-CA 123.517 0.727 . . . . 64.420000000000002 109.81 174.708 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 45' ' ' THR . . . . . 0.54 ' HA ' ' HG2' ' A' ' 48' ' ' GLU . 0.9 OUTLIER -77.97 -31.49 50.82 Favored 'General case' 0 N--CA 1.483 1.18 0 CA-C-N 115.414 -0.812 . . . . 70.109999999999999 111.258 -171.501 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -63.57 -46.77 84.36 Favored 'General case' 0 CA--C 1.547 0.836 0 C-N-CA 123.986 0.914 . . . . 51.350000000000001 110.888 171.306 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 87.2 mt -67.83 -43.6 79.18 Favored 'General case' 0 N--CA 1.481 1.123 0 C-N-CA 123.729 0.811 . . . . 73.310000000000002 112.581 179.354 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 48' ' ' GLU . . . . . 0.54 ' HG2' ' HA ' ' A' ' 45' ' ' THR . 11.3 pt-20 -71.95 -26.74 62.4 Favored 'General case' 0 N--CA 1.483 1.207 0 O-C-N 122.153 -0.342 . . . . 43.130000000000003 111.395 -176.246 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 57.1 m -73.05 -30.0 63.39 Favored 'General case' 0 N--CA 1.49 1.559 0 C-N-CA 122.954 0.501 . . . . 73.5 111.209 169.823 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -76.52 -27.7 56.1 Favored 'General case' 0 N--CA 1.482 1.17 0 C-N-CA 124.151 0.981 . . . . 55.149999999999999 112.428 -176.41 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 51' ' ' PHE . . . . . . . . . . . . . 96.5 m-85 . . . . . 0 N--CA 1.483 1.211 0 C-N-CA 123.965 0.906 . . . . 74.340000000000003 111.04 177.711 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 2' ' ' THR . . . . . 0.603 HG22 ' H ' ' A' ' 4' ' ' ILE . 16.6 m . . . . . 0 N--CA 1.487 1.385 0 N-CA-C 112.462 0.541 . . . . 73.430000000000007 112.462 . . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 49.7 tp -57.5 -26.51 61.41 Favored 'General case' 0 N--CA 1.483 1.179 0 C-N-CA 124.124 0.97 . . . . 71.540000000000006 111.808 175.649 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 4' ' ' ILE . . . . . 0.603 ' H ' HG22 ' A' ' 2' ' ' THR . 52.1 mm -67.37 -41.97 86.91 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.148 0 CA-C-N 115.959 -0.564 . . . . 75.319999999999993 110.717 175.622 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 5' ' ' GLU . . . . . 0.409 ' HA ' HD12 ' A' ' 8' ' ' ILE . 44.3 mt-10 -64.68 -36.35 84.0 Favored 'General case' 0 N--CA 1.488 1.461 0 C-N-CA 123.543 0.737 . . . . 64.129999999999995 111.123 175.854 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 6' ' ' LEU . . . . . 0.448 ' HA ' HG12 ' A' ' 9' ' ' VAL . 77.2 mt -69.11 -33.49 73.57 Favored 'General case' 0 N--CA 1.476 0.83 0 CA-C-N 115.524 -0.762 . . . . 74.219999999999999 111.296 174.289 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 26.9 tp -69.55 -33.35 72.64 Favored 'General case' 0 CA--C 1.56 1.327 0 C-N-CA 123.156 0.582 . . . . 74.420000000000002 111.346 174.522 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 8' ' ' ILE . . . . . 0.439 HG13 ' O ' ' A' ' 4' ' ' ILE . 77.8 mt -68.68 -49.39 65.0 Favored 'Isoleucine or valine' 0 C--N 1.363 1.178 0 C-N-CA 123.399 0.68 . . . . 71.150000000000006 111.412 175.935 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 9' ' ' VAL . . . . . 0.448 HG12 ' HA ' ' A' ' 6' ' ' LEU . 8.6 p -63.31 -38.1 81.23 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.972 0 C-N-CA 122.787 0.435 . . . . 61.119999999999997 111.852 -179.33 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 44.4 t -66.9 -36.57 77.49 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.064 0 C-N-CA 123.155 0.582 . . . . 75.209999999999994 111.889 172.418 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -66.94 -56.42 10.29 Favored 'General case' 0 N--CA 1.485 1.286 0 N-CA-C 111.821 0.304 . . . . 74.439999999999998 111.821 178.284 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 12' ' ' ILE . . . . . 0.526 ' O ' ' HG ' ' A' ' 16' ' ' LEU . 28.8 pt -59.9 -50.82 78.65 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.913 0 C-N-CA 122.992 0.517 . . . . 61.420000000000002 111.83 -175.473 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 81.4 mt -69.73 -31.12 47.33 Favored 'Isoleucine or valine' 0 C--N 1.36 1.064 0 C-N-CA 123.589 0.756 . . . . 63.229999999999997 110.092 -179.233 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -61.28 -34.27 87.56 Favored Glycine 0 C--N 1.349 1.284 0 CA-C-N 115.894 -0.594 . . . . 73.019999999999996 113.533 174.335 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 1.7 mp -79.85 -44.61 23.05 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.99 0 C-N-CA 122.934 0.494 . . . . 61.329999999999998 110.085 175.484 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 16' ' ' LEU . . . . . 0.526 ' HG ' ' O ' ' A' ' 12' ' ' ILE . 31.9 mt -54.52 -42.64 71.06 Favored 'General case' 0 N--CA 1.488 1.43 0 C-N-CA 123.13 0.572 . . . . 74.140000000000001 111.324 -179.463 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -77.06 -48.73 17.03 Favored 'General case' 0 CA--C 1.55 0.969 0 C-N-CA 123.356 0.662 . . . . 75.420000000000002 111.378 179.337 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -55.78 -27.19 49.79 Favored 'General case' 0 N--CA 1.493 1.711 0 N-CA-C 113.182 0.808 . . . . 44.399999999999999 113.182 -178.863 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 2.8 pp -90.54 -35.85 7.71 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.105 0 N-CA-C 112.067 0.395 . . . . 71.5 112.067 173.097 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -67.63 -45.71 74.58 Favored 'General case' 0 N--CA 1.484 1.228 0 C-N-CA 123.224 0.609 . . . . 50.509999999999998 111.972 -172.639 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 1.9 mp -59.4 -52.98 70.46 Favored Pre-proline 0 CA--C 1.571 1.766 0 CA-C-O 118.486 -0.768 . . . . 60.399999999999999 112.478 -177.141 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 40.1 Cg_endo -66.66 -36.4 25.19 Favored 'Trans proline' 0 C--N 1.381 2.27 0 C-N-CA 121.911 1.74 . . . . 71.230000000000004 113.498 173.356 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 28.8 tt0 -66.58 -30.93 71.34 Favored 'General case' 0 N--CA 1.495 1.815 0 C-N-CA 123.133 0.573 . . . . 71.030000000000001 111.16 -178.096 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 24' ' ' PHE . . . . . . . . . . . . . 75.1 t80 -91.15 -40.13 11.75 Favored 'General case' 0 N--CA 1.489 1.482 0 CA-C-N 115.179 -0.919 . . . . 65.439999999999998 110.782 -176.6 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 25' ' ' SER . . . . . 0.442 ' O ' HG23 ' A' ' 29' ' ' VAL . 48.2 t -60.41 -55.47 33.15 Favored 'General case' 0 N--CA 1.479 1.003 0 C-N-CA 123.204 0.602 . . . . 64.450000000000003 110.051 174.669 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -64.7 -22.64 67.03 Favored 'General case' 0 N--CA 1.483 1.21 0 C-N-CA 123.74 0.816 . . . . 74.340000000000003 112.525 177.252 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 80.4 t80 -66.95 -47.59 71.17 Favored 'General case' 0 N--CA 1.48 1.063 0 CA-C-O 121.088 0.471 . . . . 64.25 110.206 172.92 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 19.9 mtp180 -72.41 -23.1 61.04 Favored 'General case' 0 N--CA 1.474 0.759 0 CA-C-N 115.196 -0.911 . . . . 65.0 111.173 179.806 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 29' ' ' VAL . . . . . 0.442 HG23 ' O ' ' A' ' 25' ' ' SER . 68.7 t -69.59 -50.79 47.43 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.184 0 N-CA-C 109.909 -0.404 . . . . 63.149999999999999 109.909 173.791 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 30' ' ' LYS . . . . . 0.469 ' HA ' ' HB3' ' A' ' 33' ' ' ASN . 14.7 ptmm? -75.71 -13.96 60.33 Favored 'General case' 0 N--CA 1.484 1.246 0 C-N-CA 122.862 0.465 . . . . 71.439999999999998 111.782 178.836 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -74.14 -40.69 62.45 Favored 'General case' 0 N--CA 1.481 1.088 0 CA-C-O 121.647 0.737 . . . . 65.109999999999999 109.593 172.393 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 32' ' ' TYR . . . . . 0.444 ' O ' ' HB3' ' A' ' 36' ' ' ALA . 36.2 t80 -85.77 -18.83 31.88 Favored 'General case' 0 N--CA 1.48 1.034 0 CA-C-N 115.068 -0.969 . . . . 73.310000000000002 111.582 -179.29 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 33' ' ' ASN . . . . . 0.469 ' HB3' ' HA ' ' A' ' 30' ' ' LYS . 27.8 t-20 -84.6 -63.24 1.37 Allowed 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 115.585 -0.734 . . . . 63.329999999999998 109.971 174.965 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 20.3 m -80.45 -51.46 8.79 Favored 'General case' 0 N--CA 1.487 1.409 0 CA-C-N 115.258 -0.883 . . . . 70.349999999999994 111.379 -166.539 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -70.21 -38.64 75.34 Favored 'General case' 0 N--CA 1.481 1.097 0 N-CA-C 111.613 0.227 . . . . 63.149999999999999 111.613 -178.281 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 36' ' ' ALA . . . . . 0.444 ' HB3' ' O ' ' A' ' 32' ' ' TYR . . . -69.82 -41.11 75.42 Favored 'General case' 0 N--CA 1.482 1.17 0 N-CA-C 111.425 0.157 . . . . 71.25 111.425 -179.07 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 68.0 m -67.38 -28.76 68.2 Favored 'General case' 0 N--CA 1.487 1.377 0 C-N-CA 122.45 0.3 . . . . 72.120000000000005 111.807 172.776 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 43.0 t -72.14 -37.88 69.34 Favored 'General case' 0 N--CA 1.484 1.256 0 C-N-CA 122.69 0.396 . . . . 44.340000000000003 111.128 176.399 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 33.1 m-20 -62.85 -49.05 76.42 Favored 'General case' 0 CA--C 1.544 0.72 0 C-N-CA 123.253 0.621 . . . . 75.239999999999995 111.084 170.013 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 73.5 mt -66.56 -32.69 74.2 Favored 'General case' 0 N--CA 1.487 1.405 0 C-N-CA 122.473 0.309 . . . . 62.530000000000001 111.066 -176.139 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 33.7 ttm180 -73.08 -47.68 42.42 Favored 'General case' 0 CA--C 1.537 0.444 0 C-N-CA 123.353 0.661 . . . . 74.099999999999994 110.016 177.871 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 66.2 t30 -62.71 -33.51 75.27 Favored 'General case' 0 N--CA 1.484 1.271 0 CA-C-N 115.436 -0.802 . . . . 63.5 112.162 179.748 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 91.7 mt -79.57 -37.8 35.56 Favored 'General case' 0 N--CA 1.481 1.1 0 C-N-CA 123.0 0.52 . . . . 72.209999999999994 110.717 179.938 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 44' ' ' LYS . . . . . 0.463 ' O ' ' HG2' ' A' ' 48' ' ' GLU . 0.8 OUTLIER -74.31 -43.54 56.33 Favored 'General case' 0 N--CA 1.476 0.845 0 N-CA-C 109.645 -0.502 . . . . 63.43 109.645 -176.077 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 3.0 t -65.82 -31.12 71.91 Favored 'General case' 0 N--CA 1.483 1.201 0 C-N-CA 123.428 0.691 . . . . 60.350000000000001 110.916 178.141 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -69.36 -31.92 70.65 Favored 'General case' 0 N--CA 1.479 1.001 0 CA-C-N 115.209 -0.905 . . . . 72.319999999999993 111.477 173.605 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 97.9 mt -67.45 -50.35 59.58 Favored 'General case' 0 N--CA 1.483 1.212 0 C-N-CA 122.768 0.427 . . . . 65.120000000000005 110.779 170.842 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 48' ' ' GLU . . . . . 0.463 ' HG2' ' O ' ' A' ' 44' ' ' LYS . 5.7 mm-40 -60.76 -35.05 75.44 Favored 'General case' 0 N--CA 1.493 1.702 0 C-N-CA 122.954 0.502 . . . . 73.25 110.797 -179.438 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 37.9 t -67.41 -58.77 4.16 Favored 'General case' 0 CA--C 1.54 0.583 0 CA-C-N 115.457 -0.792 . . . . 44.530000000000001 110.499 175.272 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -60.85 -38.13 84.46 Favored 'General case' 0 N--CA 1.487 1.415 0 C-N-CA 123.813 0.845 . . . . 74.099999999999994 112.17 -172.03 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 51' ' ' PHE . . . . . . . . . . . . . 2.7 m-85 . . . . . 0 CA--C 1.542 0.65 0 CA-C-N 115.061 -0.972 . . . . 73.319999999999993 110.366 178.968 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 2' ' ' THR . . . . . 0.477 HG23 ' H ' ' A' ' 5' ' ' GLU . 4.1 t . . . . . 0 N--CA 1.488 1.449 0 CA-C-O 120.668 0.27 . . . . 73.140000000000001 110.982 . . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 4.6 pp -63.36 -18.18 63.38 Favored 'General case' 0 N--CA 1.481 1.078 0 C-N-CA 123.942 0.897 . . . . 74.129999999999995 111.391 177.423 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 50.2 mm -64.06 -54.68 28.4 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.807 0 C-N-CA 123.436 0.695 . . . . 75.120000000000005 110.325 174.702 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 5' ' ' GLU . . . . . 0.477 ' H ' HG23 ' A' ' 2' ' ' THR . 42.7 mm-40 -66.84 -29.84 69.87 Favored 'General case' 0 N--CA 1.481 1.087 0 C-N-CA 122.958 0.503 . . . . 63.130000000000003 112.113 178.476 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 95.0 mt -67.62 -42.1 82.92 Favored 'General case' 0 N--CA 1.481 1.122 0 C-N-CA 122.966 0.507 . . . . 64.239999999999995 111.403 174.068 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -60.69 -50.37 73.76 Favored 'General case' 0 CA--C 1.555 1.172 0 C-N-CA 123.817 0.847 . . . . 65.349999999999994 109.962 176.283 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 96.5 mt -63.79 -46.37 94.61 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.869 0 C-N-CA 124.207 1.003 . . . . 55.020000000000003 112.603 -178.749 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 6.4 p -65.37 -38.83 83.49 Favored 'Isoleucine or valine' 0 CA--C 1.551 1.011 0 C-N-CA 122.694 0.398 . . . . 72.150000000000006 111.181 -178.482 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 8.9 t -66.12 -37.41 79.7 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.083 0 C-N-CA 123.403 0.681 . . . . 41.43 111.578 172.485 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -66.27 -51.68 55.05 Favored 'General case' 0 N--CA 1.48 1.031 0 C-N-CA 123.02 0.528 . . . . 51.43 111.546 -179.066 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 12' ' ' ILE . . . . . 0.545 ' HA ' HD12 ' A' ' 15' ' ' ILE . 20.8 pt -67.49 -44.71 86.5 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.935 0 C-N-CA 123.231 0.613 . . . . 73.230000000000004 111.823 -176.878 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 82.4 mt -64.37 -32.67 58.59 Favored 'Isoleucine or valine' 0 C--N 1.361 1.099 0 C-N-CA 123.614 0.766 . . . . 73.150000000000006 110.427 174.35 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -61.77 -36.95 93.5 Favored Glycine 0 C--N 1.349 1.291 0 CA-C-N 115.558 -0.746 . . . . 63.140000000000001 112.914 175.169 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 15' ' ' ILE . . . . . 0.545 HD12 ' HA ' ' A' ' 12' ' ' ILE . 22.9 mt -70.76 -42.91 77.62 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.904 0 C-N-CA 123.852 0.861 . . . . 74.519999999999996 110.705 175.343 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 16' ' ' LEU . . . . . 0.508 ' HG ' ' O ' ' A' ' 12' ' ' ILE . 28.6 mt -60.99 -38.36 85.71 Favored 'General case' 0 N--CA 1.482 1.137 0 C-N-CA 123.361 0.664 . . . . 63.229999999999997 111.256 -179.948 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -74.36 -48.32 28.8 Favored 'General case' 0 CA--C 1.55 0.966 0 C-N-CA 123.218 0.607 . . . . 72.409999999999997 110.754 176.251 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -57.74 -22.83 48.85 Favored 'General case' 0 N--CA 1.487 1.379 0 N-CA-C 113.602 0.964 . . . . 61.140000000000001 113.602 -179.287 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 2.8 pp -94.79 -35.56 6.22 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.218 0 N-CA-C 112.07 0.396 . . . . 73.200000000000003 112.07 171.687 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -66.71 -46.66 74.83 Favored 'General case' 0 N--CA 1.484 1.275 0 C-N-CA 123.381 0.673 . . . . 74.25 112.471 -172.586 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 2.2 mp -61.78 -53.67 58.35 Favored Pre-proline 0 CA--C 1.574 1.881 0 CA-C-O 118.739 -0.648 . . . . 75.140000000000001 112.533 -177.053 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 34.3 Cg_endo -64.53 -37.53 37.58 Favored 'Trans proline' 0 C--N 1.384 2.411 0 C-N-CA 122.256 1.97 . . . . 74.209999999999994 113.523 175.013 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 26.0 tt0 -64.98 -38.89 92.45 Favored 'General case' 0 N--CA 1.487 1.381 0 C-N-CA 123.196 0.598 . . . . 50.229999999999997 110.502 -178.098 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 24' ' ' PHE . . . . . . . . . . . . . 72.8 t80 -81.99 -34.28 29.74 Favored 'General case' 0 N--CA 1.487 1.393 0 CA-C-N 114.998 -1.001 . . . . 72.049999999999997 110.291 -176.068 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 25' ' ' SER . . . . . 0.513 ' O ' HG23 ' A' ' 29' ' ' VAL . 48.4 t -53.76 -59.21 4.92 Favored 'General case' 0 N--CA 1.478 0.97 0 C-N-CA 123.108 0.563 . . . . 64.340000000000003 109.868 168.866 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -65.18 -21.32 66.75 Favored 'General case' 0 N--CA 1.482 1.132 0 C-N-CA 124.319 1.047 . . . . 72.200000000000003 112.784 179.302 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 57.4 t80 -72.37 -45.02 61.66 Favored 'General case' 0 N--CA 1.483 1.188 0 C-N-CA 123.06 0.544 . . . . 74.239999999999995 111.076 174.911 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 27.8 mmm180 -70.2 -25.86 63.61 Favored 'General case' 0 N--CA 1.482 1.153 0 C-N-CA 123.545 0.738 . . . . 73.319999999999993 110.334 176.366 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 29' ' ' VAL . . . . . 0.513 HG23 ' O ' ' A' ' 25' ' ' SER . 91.1 t -69.5 -48.02 68.81 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.152 0 CA-C-N 115.75 -0.659 . . . . 75.150000000000006 109.41 172.359 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 30' ' ' LYS . . . . . 0.517 ' O ' ' HB3' ' A' ' 34' ' ' SER . 55.9 mttp -66.44 -21.28 66.2 Favored 'General case' 0 N--CA 1.488 1.455 0 C-N-CA 123.293 0.637 . . . . 72.409999999999997 112.297 175.799 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -68.1 -53.05 28.23 Favored 'General case' 0 N--CA 1.473 0.685 0 O-C-N 121.893 -0.504 . . . . 75.109999999999999 109.685 171.719 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 62.9 t80 -69.2 -64.08 0.94 Allowed 'General case' 0 C--O 1.219 -0.53 0 CA-C-N 115.274 -0.875 . . . . 73.140000000000001 111.235 -177.435 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 2.8 m-20 -56.91 -55.43 34.69 Favored 'General case' 0 N--CA 1.482 1.137 0 C-N-CA 125.213 1.405 . . . . 53.32 113.518 -177.414 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 34' ' ' SER . . . . . 0.517 ' HB3' ' O ' ' A' ' 30' ' ' LYS . 44.1 t -73.76 -44.62 55.58 Favored 'General case' 0 N--CA 1.493 1.712 0 N-CA-C 111.685 0.254 . . . . 52.409999999999997 111.685 -170.486 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -68.18 -30.3 69.37 Favored 'General case' 0 N--CA 1.479 1.008 0 CA-C-O 119.596 -0.24 . . . . 71.099999999999994 111.445 176.856 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -64.48 -46.92 80.95 Favored 'General case' 0 N--CA 1.494 1.76 0 N-CA-C 111.908 0.336 . . . . 74.400000000000006 111.908 170.529 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 71.1 m -63.62 -41.94 98.24 Favored 'General case' 0 N--CA 1.489 1.504 0 C-N-CA 123.374 0.67 . . . . 45.229999999999997 111.742 -179.562 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 80.9 p -77.64 -26.45 50.47 Favored 'General case' 0 N--CA 1.48 1.043 0 C-N-CA 123.441 0.696 . . . . 50.409999999999997 111.638 -179.211 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 31.2 t70 -62.48 -51.62 66.74 Favored 'General case' 0 N--CA 1.479 0.998 0 C-N-CA 123.17 0.588 . . . . 55.340000000000003 110.011 169.265 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 95.3 mt -64.14 -36.92 85.61 Favored 'General case' 0 N--CA 1.479 1.004 0 CA-C-N 115.498 -0.774 . . . . 73.549999999999997 110.859 -178.266 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 20.6 tpt85 -66.98 -44.15 81.17 Favored 'General case' 0 CA--C 1.547 0.83 0 C-N-CA 123.788 0.835 . . . . 74.439999999999998 110.475 176.647 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 63.5 t30 -66.94 -35.46 80.04 Favored 'General case' 0 N--CA 1.482 1.132 0 C-N-CA 123.762 0.825 . . . . 74.310000000000002 111.591 179.739 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 92.2 mt -72.71 -36.9 67.91 Favored 'General case' 0 N--CA 1.482 1.171 0 C-N-CA 123.135 0.574 . . . . 73.129999999999995 110.18 177.665 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 23.2 tptm -73.59 -41.65 62.6 Favored 'General case' 0 CA--C 1.538 0.505 0 CA-C-O 121.383 0.611 . . . . 73.209999999999994 110.077 -174.18 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 5.1 t -73.62 -32.58 64.13 Favored 'General case' 0 CA--C 1.547 0.846 0 CA-C-N 115.899 -0.592 . . . . 71.129999999999995 111.876 -177.419 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -79.96 -60.67 2.25 Favored 'General case' 0 N--CA 1.482 1.169 0 C-N-CA 123.383 0.673 . . . . 74.219999999999999 111.938 179.889 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -65.14 -44.31 89.03 Favored 'General case' 0 N--CA 1.479 1.02 0 C-N-CA 123.038 0.535 . . . . 54.549999999999997 112.034 -175.616 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 56.8 mm-40 -73.9 -16.31 61.11 Favored 'General case' 0 N--CA 1.485 1.324 0 CA-C-N 118.215 0.462 . . . . 74.319999999999993 112.12 -177.837 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 36.8 t -71.13 -36.25 72.04 Favored 'General case' 0 N--CA 1.485 1.298 0 CA-C-O 121.048 0.451 . . . . 75.010000000000005 110.058 168.88 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -69.86 -40.66 75.62 Favored 'General case' 0 N--CA 1.48 1.03 0 C-N-CA 123.756 0.823 . . . . 70.530000000000001 111.152 178.681 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 51' ' ' PHE . . . . . . . . . . . . . 60.5 m-85 . . . . . 0 N--CA 1.478 0.967 0 CA-C-N 115.863 -0.608 . . . . 74.400000000000006 110.358 176.217 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 2' ' ' THR . . . . . 0.477 HG23 ' H ' ' A' ' 5' ' ' GLU . 5.7 t . . . . . 0 N--CA 1.488 1.443 0 CA-C-O 121.207 0.527 . . . . 65.430000000000007 111.732 . . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 3' ' ' LEU . . . . . 0.494 HD13 HD12 ' A' ' 6' ' ' LEU . 3.2 mm? -68.8 -17.99 64.11 Favored 'General case' 0 N--CA 1.479 0.995 0 CA-C-N 115.038 -0.983 . . . . 70.209999999999994 111.028 175.913 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 50.4 mm -65.05 -51.21 69.22 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.216 0 C-N-CA 123.194 0.598 . . . . 63.100000000000001 110.572 176.886 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 5' ' ' GLU . . . . . 0.477 ' H ' HG23 ' A' ' 2' ' ' THR . 18.9 mm-40 -62.76 -41.09 99.06 Favored 'General case' 0 N--CA 1.481 1.097 0 C-N-CA 123.001 0.52 . . . . 75.420000000000002 111.689 177.725 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 6' ' ' LEU . . . . . 0.494 HD12 HD13 ' A' ' 3' ' ' LEU . 90.9 mt -62.54 -37.33 85.69 Favored 'General case' 0 N--CA 1.489 1.524 0 C-N-CA 123.051 0.541 . . . . 73.409999999999997 111.96 174.182 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 34.4 tp -64.75 -41.15 96.13 Favored 'General case' 0 N--CA 1.476 0.861 0 C-N-CA 123.817 0.847 . . . . 51.399999999999999 111.736 178.504 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 93.4 mt -69.47 -43.81 80.44 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.768 0 C-N-CA 123.654 0.781 . . . . 74.209999999999994 111.226 178.333 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 82.9 t -61.92 -47.25 94.11 Favored 'Isoleucine or valine' 0 CA--C 1.556 1.18 0 C-N-CA 122.976 0.511 . . . . 63.329999999999998 111.465 176.041 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 2.5 p -68.07 -29.44 44.66 Favored 'Isoleucine or valine' 0 CA--C 1.556 1.179 0 C-N-CA 122.572 0.349 . . . . 74.109999999999999 111.6 179.656 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -70.75 -53.63 14.79 Favored 'General case' 0 C--N 1.365 1.258 0 C-N-CA 122.698 0.399 . . . . 70.099999999999994 111.164 177.558 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 12' ' ' ILE . . . . . 0.53 ' O ' ' HG ' ' A' ' 16' ' ' LEU . 21.4 pt -63.83 -42.14 94.87 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.101 0 C-N-CA 123.168 0.587 . . . . 65.319999999999993 111.794 -176.554 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 65.7 mt -66.08 -32.76 59.55 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.047 0 C-N-CA 123.697 0.799 . . . . 74.140000000000001 110.275 173.809 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -63.75 -32.78 85.32 Favored Glycine 0 C--N 1.351 1.412 0 CA-C-N 116.029 -0.532 . . . . 22.34 113.179 172.23 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 18.8 mm -72.55 -44.91 60.39 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.202 0 N-CA-C 109.216 -0.661 . . . . 73.340000000000003 109.216 175.116 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 16' ' ' LEU . . . . . 0.53 ' HG ' ' O ' ' A' ' 12' ' ' ILE . 26.3 mt -59.77 -36.09 75.95 Favored 'General case' 0 N--CA 1.484 1.25 0 C-N-CA 123.655 0.782 . . . . 61.43 111.257 -179.316 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -70.62 -51.96 24.59 Favored 'General case' 0 N--CA 1.476 0.872 0 C-N-CA 123.232 0.613 . . . . 60.240000000000002 110.808 174.48 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -61.84 -22.9 65.9 Favored 'General case' 0 N--CA 1.481 1.095 0 N-CA-C 113.618 0.97 . . . . 60.32 113.618 -176.635 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 19' ' ' ILE . . . . . 0.404 HD12 ' N ' ' A' ' 20' ' ' ALA . 2.8 pp -92.4 -38.87 10.76 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.292 0 N-CA-C 111.835 0.309 . . . . 74.010000000000005 111.835 173.907 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 20' ' ' ALA . . . . . 0.404 ' N ' HD12 ' A' ' 19' ' ' ILE . . . -67.86 -43.39 79.55 Favored 'General case' 0 N--CA 1.485 1.323 0 N-CA-C 112.726 0.639 . . . . 65.230000000000004 112.726 -173.613 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 27.9 mt -61.06 -52.83 69.1 Favored Pre-proline 0 CA--C 1.563 1.454 0 CA-C-O 118.09 -0.957 . . . . 64.450000000000003 113.194 -177.071 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 46.2 Cg_endo -67.39 -35.78 22.58 Favored 'Trans proline' 0 C--N 1.377 2.077 0 CA-C-N 121.521 1.579 . . . . 74.409999999999997 112.956 173.765 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 29.3 tt0 -69.84 -31.08 68.75 Favored 'General case' 0 N--CA 1.483 1.201 0 CA-C-O 121.13 0.49 . . . . 63.520000000000003 111.106 -177.067 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 24' ' ' PHE . . . . . . . . . . . . . 16.4 t80 -95.22 -30.61 13.91 Favored 'General case' 0 N--CA 1.491 1.58 0 CA-C-N 115.796 -0.638 . . . . 74.409999999999997 110.781 -176.668 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 25' ' ' SER . . . . . 0.438 ' O ' HG23 ' A' ' 29' ' ' VAL . 41.6 t -57.02 -56.88 16.07 Favored 'General case' 0 N--CA 1.486 1.337 0 N-CA-C 109.87 -0.418 . . . . 70.219999999999999 109.87 165.446 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -67.26 -17.55 64.84 Favored 'General case' 0 N--CA 1.486 1.362 0 C-N-CA 123.965 0.906 . . . . 65.319999999999993 112.843 177.996 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 93.2 t80 -67.01 -46.71 73.69 Favored 'General case' 0 N--CA 1.485 1.306 0 C-N-CA 123.286 0.634 . . . . 73.219999999999999 110.273 171.422 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 39.9 mtt180 -70.91 -29.64 65.75 Favored 'General case' 0 N--CA 1.478 0.966 0 CA-C-N 115.716 -0.675 . . . . 71.340000000000003 110.591 177.225 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 29' ' ' VAL . . . . . 0.438 HG23 ' O ' ' A' ' 25' ' ' SER . 73.2 t -67.65 -54.08 26.09 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.409 0 CA-C-N 116.033 -0.53 . . . . 71.329999999999998 110.398 177.4 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 12.4 ptmm? -68.96 -21.45 64.18 Favored 'General case' 0 N--CA 1.479 0.999 0 CA-C-N 115.659 -0.701 . . . . 61.32 110.803 177.645 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -69.1 -39.27 79.08 Favored 'General case' 0 N--CA 1.482 1.171 0 O-C-N 121.931 -0.481 . . . . 75.519999999999996 110.114 173.551 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 92.9 t80 -66.42 -43.72 84.9 Favored 'General case' 0 N--CA 1.474 0.727 0 CA-C-N 115.539 -0.755 . . . . 65.430000000000007 111.769 -179.552 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 52.2 m-80 -83.87 -45.83 12.81 Favored 'General case' 0 N--CA 1.476 0.851 0 C-N-CA 123.627 0.771 . . . . 62.229999999999997 112.701 -175.233 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 30.3 t -77.6 -47.01 20.43 Favored 'General case' 0 N--CA 1.494 1.739 0 N-CA-C 111.49 0.182 . . . . 65.319999999999993 111.49 -171.506 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -62.28 -35.51 79.23 Favored 'General case' 0 N--CA 1.481 1.077 0 C-N-CA 122.473 0.309 . . . . 72.349999999999994 111.203 174.915 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -63.01 -49.89 72.88 Favored 'General case' 0 N--CA 1.486 1.343 0 O-C-N 123.418 0.449 . . . . 75.209999999999994 111.619 175.348 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 71.2 m -57.1 -38.68 73.74 Favored 'General case' 0 N--CA 1.491 1.59 0 C-N-CA 122.871 0.468 . . . . 71.030000000000001 112.2 -178.688 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 33.5 t -85.96 -31.59 22.0 Favored 'General case' 0 N--CA 1.487 1.397 0 C-N-CA 123.625 0.77 . . . . 61.240000000000002 112.648 -177.619 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 38.8 t70 -70.07 -44.61 68.77 Favored 'General case' 0 N--CA 1.48 1.052 0 CA-C-O 120.846 0.355 . . . . 71.109999999999999 110.616 176.406 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 97.0 mt -71.99 -27.53 62.81 Favored 'General case' 0 N--CA 1.475 0.79 0 CA-C-N 115.702 -0.681 . . . . 71.129999999999995 110.242 -178.732 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 20.5 tpp180 -71.63 -43.13 66.68 Favored 'General case' 0 N--CA 1.475 0.787 0 C-N-CA 123.604 0.762 . . . . 70.430000000000007 110.483 173.319 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 58.2 t30 -61.66 -44.07 97.65 Favored 'General case' 0 N--CA 1.486 1.335 0 C-N-CA 124.076 0.95 . . . . 72.5 111.944 177.218 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 94.6 mt -75.15 -33.11 61.48 Favored 'General case' 0 N--CA 1.479 1.001 0 CA-C-N 115.923 -0.581 . . . . 75.209999999999994 111.142 -179.05 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 44' ' ' LYS . . . . . 0.413 ' O ' ' HG2' ' A' ' 48' ' ' GLU . 22.4 ttmm -71.44 -48.1 51.63 Favored 'General case' 0 N--CA 1.475 0.799 0 N-CA-C 109.747 -0.464 . . . . 71.109999999999999 109.747 179.789 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 3.4 t -61.76 -36.0 79.76 Favored 'General case' 0 N--CA 1.484 1.256 0 C-N-CA 123.025 0.53 . . . . 55.100000000000001 111.197 -176.354 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -63.71 -50.49 68.96 Favored 'General case' 0 N--CA 1.477 0.879 0 C-N-CA 123.586 0.754 . . . . 60.210000000000001 111.634 175.397 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 8.3 mp -66.91 -42.05 86.08 Favored 'General case' 0 N--CA 1.488 1.473 0 C-N-CA 123.503 0.721 . . . . 73.299999999999997 112.715 -179.024 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 48' ' ' GLU . . . . . 0.413 ' HG2' ' O ' ' A' ' 44' ' ' LYS . 36.9 mm-40 -67.85 -45.8 73.57 Favored 'General case' 0 N--CA 1.477 0.886 0 C-N-CA 123.363 0.665 . . . . 73.010000000000005 110.755 -178.596 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 62.3 m -66.07 -37.16 85.11 Favored 'General case' 0 N--CA 1.482 1.165 0 C-N-CA 122.626 0.37 . . . . 74.319999999999993 111.599 179.439 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -68.02 -49.63 60.31 Favored 'General case' 0 N--CA 1.489 1.512 0 C-N-CA 123.264 0.626 . . . . 73.209999999999994 112.135 179.113 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 51' ' ' PHE . . . . . . . . . . . . . 28.9 t80 . . . . . 0 N--CA 1.484 1.263 0 C-N-CA 123.491 0.717 . . . . 72.120000000000005 111.563 -176.948 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 2' ' ' THR . . . . . 0.632 HG22 ' H ' ' A' ' 4' ' ' ILE . 36.7 m . . . . . 0 N--CA 1.484 1.226 0 CA-C-O 120.543 0.211 . . . . 70.239999999999995 110.93 . . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 2.5 pt? -61.22 -17.46 53.36 Favored 'General case' 0 N--CA 1.49 1.57 0 C-N-CA 124.123 0.969 . . . . 75.010000000000005 113.202 179.175 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 4' ' ' ILE . . . . . 0.632 ' H ' HG22 ' A' ' 2' ' ' THR . 50.6 mm -86.17 -45.05 16.88 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.735 0 C-N-CA 123.369 0.668 . . . . 60.109999999999999 110.322 179.461 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 20.1 mm-40 -64.16 -33.77 76.55 Favored 'General case' 0 N--CA 1.481 1.08 0 C-N-CA 123.304 0.642 . . . . 72.209999999999994 111.799 -179.812 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 6' ' ' LEU . . . . . 0.4 ' HA ' HG12 ' A' ' 9' ' ' VAL . 3.5 pp -70.07 -34.0 72.64 Favored 'General case' 0 N--CA 1.477 0.921 0 O-C-N 123.156 0.285 . . . . 53.520000000000003 111.332 174.245 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -67.7 -37.69 82.63 Favored 'General case' 0 CA--C 1.561 1.398 0 C-N-CA 123.814 0.846 . . . . 74.120000000000005 110.904 176.759 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 87.4 mt -70.39 -49.37 54.09 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.707 0 C-N-CA 123.292 0.637 . . . . 62.399999999999999 111.99 178.996 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 9' ' ' VAL . . . . . 0.4 HG12 ' HA ' ' A' ' 6' ' ' LEU . 9.7 p -64.52 -39.66 86.36 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.901 0 C-N-CA 122.684 0.394 . . . . 74.329999999999998 111.789 -179.527 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 2.0 p -67.28 -30.0 47.71 Favored 'Isoleucine or valine' 0 CA--C 1.56 1.351 0 C-N-CA 122.435 0.294 . . . . 72.230000000000004 111.3 175.697 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -69.15 -52.76 24.89 Favored 'General case' 0 N--CA 1.483 1.219 0 C-N-CA 122.652 0.381 . . . . 54.130000000000003 111.583 177.533 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 12' ' ' ILE . . . . . 0.524 ' O ' ' HG ' ' A' ' 16' ' ' LEU . 21.3 pt -62.54 -41.5 92.24 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.967 0 C-N-CA 122.723 0.409 . . . . 71.129999999999995 111.46 -179.117 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 56.0 mt -62.15 -36.21 73.09 Favored 'Isoleucine or valine' 0 C--N 1.362 1.139 0 C-N-CA 124.277 1.031 . . . . 75.219999999999999 111.097 174.382 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -58.13 -36.43 81.94 Favored Glycine 0 C--N 1.355 1.596 0 O-C-N 123.553 0.533 . . . . 74.409999999999997 113.198 174.856 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 1.7 mp -75.98 -42.81 39.12 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.877 0 C-N-CA 123.06 0.544 . . . . 72.409999999999997 109.995 175.768 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 16' ' ' LEU . . . . . 0.524 ' HG ' ' O ' ' A' ' 12' ' ' ILE . 37.9 mt -59.52 -36.59 76.4 Favored 'General case' 0 N--CA 1.489 1.488 0 C-N-CA 122.975 0.51 . . . . 71.530000000000001 112.006 -176.623 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -73.73 -52.43 13.23 Favored 'General case' 0 CA--C 1.546 0.826 0 C-N-CA 122.738 0.415 . . . . 62.020000000000003 110.228 175.143 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -53.87 -30.05 44.08 Favored 'General case' 0 N--CA 1.488 1.431 0 C-N-CA 124.226 1.01 . . . . 35.520000000000003 113.444 -178.168 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 19' ' ' ILE . . . . . 0.516 ' O ' ' HB3' ' A' ' 23' ' ' GLN . 2.8 pp -88.47 -35.94 8.55 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.297 0 N-CA-C 112.177 0.436 . . . . 73.040000000000006 112.177 175.501 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -71.74 -42.98 66.62 Favored 'General case' 0 N--CA 1.481 1.092 0 N-CA-C 112.872 0.693 . . . . 72.310000000000002 112.872 -170.985 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 1.9 mp -57.07 -54.13 57.83 Favored Pre-proline 0 CA--C 1.567 1.624 0 CA-C-O 118.723 -0.656 . . . . 64.530000000000001 111.591 -178.286 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 36.3 Cg_endo -64.72 -39.64 25.77 Favored 'Trans proline' 0 C--N 1.386 2.515 0 C-N-CA 121.493 1.462 . . . . 75.150000000000006 113.441 173.226 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 23' ' ' GLN . . . . . 0.516 ' HB3' ' O ' ' A' ' 19' ' ' ILE . 0.1 OUTLIER -64.94 -29.88 70.85 Favored 'General case' 0 N--CA 1.496 1.841 0 C-N-CA 122.77 0.428 . . . . 75.530000000000001 110.685 -175.669 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 24' ' ' PHE . . . . . . . . . . . . . 73.7 t80 -96.59 -37.94 10.17 Favored 'General case' 0 N--CA 1.485 1.276 0 CA-C-N 115.533 -0.758 . . . . 70.310000000000002 111.135 -173.61 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 25' ' ' SER . . . . . 0.456 ' O ' HG23 ' A' ' 29' ' ' VAL . 46.2 t -61.09 -57.51 12.25 Favored 'General case' 0 N--CA 1.477 0.884 0 N-CA-C 109.167 -0.679 . . . . 60.43 109.167 174.524 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -63.34 -22.02 66.62 Favored 'General case' 0 N--CA 1.482 1.159 0 C-N-CA 123.632 0.773 . . . . 64.230000000000004 112.658 177.275 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 27' ' ' TYR . . . . . 0.442 ' HB2' ' O ' ' A' ' 23' ' ' GLN . 75.7 t80 -67.23 -48.73 66.93 Favored 'General case' 0 N--CA 1.489 1.497 0 CA-C-O 121.278 0.561 . . . . 74.349999999999994 110.502 173.488 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 74.4 mtp180 -73.28 -27.27 61.46 Favored 'General case' 0 N--CA 1.472 0.643 0 CA-C-N 115.612 -0.722 . . . . 74.200000000000003 111.617 178.26 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 29' ' ' VAL . . . . . 0.456 HG23 ' O ' ' A' ' 25' ' ' SER . 55.5 t -73.62 -42.65 55.29 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.4 0 O-C-N 123.347 0.404 . . . . 73.519999999999996 110.494 178.636 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 30' ' ' LYS . . . . . 0.438 ' HG2' ' O ' ' A' ' 27' ' ' TYR . 11.7 ptmm? -68.59 -30.32 69.05 Favored 'General case' 0 N--CA 1.476 0.869 0 CA-C-N 116.311 -0.404 . . . . 74.109999999999999 110.147 177.29 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -80.09 -34.83 37.66 Favored 'General case' 0 N--CA 1.482 1.138 0 C-N-CA 122.903 0.481 . . . . 74.099999999999994 110.837 -179.3 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 39.8 t80 -72.26 -21.56 61.35 Favored 'General case' 0 N--CA 1.485 1.291 0 C-N-CA 123.544 0.738 . . . . 74.25 110.922 -179.282 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 2.9 m-20 -94.49 -45.72 7.3 Favored 'General case' 0 N--CA 1.478 0.929 0 C-N-CA 123.872 0.869 . . . . 75.109999999999999 111.658 175.025 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 42.4 t -65.33 -55.33 18.82 Favored 'General case' 0 N--CA 1.495 1.817 0 C-N-CA 122.835 0.454 . . . . 61.140000000000001 111.75 -176.63 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -62.23 -39.29 92.31 Favored 'General case' 0 N--CA 1.474 0.747 0 CA-C-N 115.954 -0.566 . . . . 61.219999999999999 111.578 179.152 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -61.29 -60.57 3.54 Favored 'General case' 0 N--CA 1.485 1.318 0 C-N-CA 123.158 0.583 . . . . 51.340000000000003 111.569 178.695 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 37.7 t -53.26 -50.54 64.62 Favored 'General case' 0 N--CA 1.479 1.007 0 C-N-CA 123.937 0.895 . . . . 50.140000000000001 111.913 -179.713 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 30.5 t -72.01 -29.8 64.56 Favored 'General case' 0 N--CA 1.478 0.952 0 N-CA-C 112.621 0.6 . . . . 62.229999999999997 112.621 -175.967 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 37.0 t70 -63.93 -49.73 71.44 Favored 'General case' 0 N--CA 1.484 1.245 0 C-N-CA 122.64 0.376 . . . . 74.450000000000003 111.075 172.69 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 88.3 mt -67.78 -35.48 78.75 Favored 'General case' 0 N--CA 1.481 1.118 0 CA-C-N 115.622 -0.717 . . . . 74.430000000000007 110.782 -174.981 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 99.6 mtt180 -70.66 -42.24 71.03 Favored 'General case' 0 N--CA 1.48 1.064 0 CA-C-N 115.054 -0.976 . . . . 73.439999999999998 110.681 175.363 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 65.2 t30 -64.75 -36.13 83.31 Favored 'General case' 0 N--CA 1.489 1.516 0 C-N-CA 123.462 0.705 . . . . 43.350000000000001 111.671 179.774 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 43' ' ' LEU . . . . . 0.447 ' O ' HD13 ' A' ' 47' ' ' LEU . 93.6 mt -76.64 -34.77 58.28 Favored 'General case' 0 N--CA 1.478 0.97 0 C-N-CA 122.976 0.511 . . . . 71.510000000000005 110.974 179.632 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 79.4 tttt -70.98 -48.29 54.13 Favored 'General case' 0 N--CA 1.472 0.658 0 N-CA-C 109.822 -0.436 . . . . 64.409999999999997 109.822 -178.396 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 6.2 t -65.47 -31.76 73.01 Favored 'General case' 0 N--CA 1.478 0.973 0 C-N-CA 123.863 0.865 . . . . 75.409999999999997 111.674 -177.481 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -61.63 -46.48 89.62 Favored 'General case' 0 N--CA 1.481 1.121 0 C-N-CA 124.024 0.93 . . . . 64.439999999999998 111.243 172.149 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 47' ' ' LEU . . . . . 0.447 HD13 ' O ' ' A' ' 43' ' ' LEU . 8.4 mp -66.92 -39.15 87.3 Favored 'General case' 0 N--CA 1.479 1.002 0 CA-C-N 115.622 -0.717 . . . . 72.219999999999999 111.675 176.326 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 49.8 mt-10 -66.95 -38.2 85.7 Favored 'General case' 0 N--CA 1.484 1.247 0 C-N-CA 122.872 0.469 . . . . 61.140000000000001 111.147 179.647 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 34.2 t -69.04 -27.61 65.81 Favored 'General case' 0 N--CA 1.479 1.011 0 C-N-CA 123.509 0.723 . . . . 41.310000000000002 111.145 175.393 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -74.83 -53.58 8.86 Favored 'General case' 0 N--CA 1.477 0.881 0 C-N-CA 123.283 0.633 . . . . 62.509999999999998 110.341 178.057 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 51' ' ' PHE . . . . . . . . . . . . . 57.9 m-85 . . . . . 0 N--CA 1.487 1.377 0 C-N-CA 123.961 0.905 . . . . 63.5 112.466 -177.404 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 1' ' ' PHE . . . . . . . . . . . . . 46.8 p90 . . . . . 0 N--CA 1.484 1.228 0 N-CA-C 112.393 0.516 . . . . 73.400000000000006 112.393 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 2' ' ' THR . . . . . 0.57 HG23 ' H ' ' A' ' 5' ' ' GLU . 7.2 t -90.26 144.39 25.88 Favored 'General case' 0 N--CA 1.492 1.659 0 CA-C-N 118.526 0.603 . . . . 73.510000000000005 111.834 -176.164 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 3' ' ' LEU . . . . . 0.577 HD13 HD12 ' A' ' 6' ' ' LEU . 4.3 mm? -61.23 -22.72 65.06 Favored 'General case' 0 N--CA 1.482 1.139 0 CA-C-N 115.743 -0.662 . . . . 72.299999999999997 111.147 174.802 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 1.5 mp -62.14 -45.73 98.08 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.427 0 C-N-CA 123.596 0.758 . . . . 54.539999999999999 110.474 177.338 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 5' ' ' GLU . . . . . 0.57 ' H ' HG23 ' A' ' 2' ' ' THR . 14.4 mm-40 -56.23 -47.32 78.7 Favored 'General case' 0 N--CA 1.484 1.244 0 C-N-CA 123.021 0.528 . . . . 74.140000000000001 111.422 174.856 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 6' ' ' LEU . . . . . 0.577 HD12 HD13 ' A' ' 3' ' ' LEU . 85.5 mt -64.08 -41.66 97.24 Favored 'General case' 0 N--CA 1.478 0.953 0 C-N-CA 123.436 0.694 . . . . 75.430000000000007 111.956 -179.759 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 90.9 mt -61.75 -45.43 93.94 Favored 'General case' 0 N--CA 1.48 1.067 0 C-N-CA 123.174 0.589 . . . . 73.209999999999994 111.82 177.672 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 87.1 mt -63.77 -47.94 88.73 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.801 0 C-N-CA 123.324 0.65 . . . . 63.210000000000001 112.235 176.998 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 50.3 t -62.01 -44.57 99.13 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.834 0 C-N-CA 123.38 0.672 . . . . 71.25 111.379 -178.953 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 40.2 t -67.82 -31.64 53.07 Favored 'Isoleucine or valine' 0 CA--C 1.555 1.173 0 C-N-CA 123.041 0.536 . . . . 54.119999999999997 111.355 176.427 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -68.5 -58.91 3.6 Favored 'General case' 0 N--CA 1.481 1.086 0 C-N-CA 122.44 0.296 . . . . 62.530000000000001 111.274 177.855 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 12' ' ' ILE . . . . . 0.545 ' O ' ' HG ' ' A' ' 16' ' ' LEU . 20.9 pt -60.58 -49.21 85.32 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.955 0 C-N-CA 123.464 0.706 . . . . 43.329999999999998 111.83 -176.387 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 71.3 mt -68.47 -30.41 47.4 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.934 0 C-N-CA 123.613 0.765 . . . . 73.209999999999994 110.665 178.994 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -61.04 -36.39 92.24 Favored Glycine 0 C--N 1.351 1.369 0 CA-C-N 115.938 -0.574 . . . . 42.539999999999999 112.968 175.256 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 17.4 mt -75.79 -45.92 36.9 Favored 'Isoleucine or valine' 0 C--N 1.354 0.795 0 C-N-CA 123.289 0.636 . . . . 62.520000000000003 110.11 176.194 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.545 ' HG ' ' O ' ' A' ' 12' ' ' ILE . 36.5 mt -55.17 -43.25 74.13 Favored 'General case' 0 N--CA 1.485 1.294 0 O-C-N 124.055 0.847 . . . . 70.409999999999997 111.501 -178.81 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -75.1 -49.81 18.42 Favored 'General case' 0 N--CA 1.476 0.861 0 C-N-CA 123.071 0.548 . . . . 61.109999999999999 111.33 -177.857 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -55.28 -30.18 59.64 Favored 'General case' 0 N--CA 1.482 1.148 0 C-N-CA 123.665 0.786 . . . . 74.109999999999999 112.921 -178.037 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 2.8 pp -89.1 -37.52 10.11 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.974 0 N-CA-C 112.155 0.428 . . . . 71.230000000000004 112.155 173.624 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -65.96 -53.04 44.12 Favored 'General case' 0 N--CA 1.487 1.388 0 N-CA-C 113.052 0.76 . . . . 64.239999999999995 113.052 -171.093 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 2.4 mp -54.64 -56.3 28.65 Favored Pre-proline 0 CA--C 1.566 1.562 0 CA-C-O 118.629 -0.7 . . . . 72.299999999999997 112.494 -174.759 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 37.2 Cg_endo -65.31 -41.05 17.05 Favored 'Trans proline' 0 C--N 1.38 2.224 0 C-N-CA 121.576 1.517 . . . . 70.239999999999995 113.493 177.624 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 28.2 tt0 -63.87 -36.47 84.04 Favored 'General case' 0 N--CA 1.488 1.464 0 C-N-CA 123.369 0.668 . . . . 71.040000000000006 111.098 -176.13 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 24' ' ' PHE . . . . . . . . . . . . . 37.5 t80 -88.33 -36.24 16.74 Favored 'General case' 0 N--CA 1.485 1.31 0 CA-C-N 114.837 -1.074 . . . . 55.439999999999998 111.023 -174.84 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 31.3 t -60.3 -51.18 70.65 Favored 'General case' 0 N--CA 1.478 0.943 0 C-N-CA 122.991 0.517 . . . . 75.430000000000007 110.411 173.612 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -69.99 -21.29 63.24 Favored 'General case' 0 CA--C 1.551 0.998 0 CA-C-N 115.486 -0.779 . . . . 74.150000000000006 112.644 176.789 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 79.7 t80 -71.19 -48.47 51.41 Favored 'General case' 0 N--CA 1.488 1.427 0 C-N-CA 122.686 0.395 . . . . 54.409999999999997 110.995 175.361 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 73.5 mtp180 -67.62 -27.14 66.64 Favored 'General case' 0 N--CA 1.477 0.886 0 C-N-CA 123.015 0.526 . . . . 72.030000000000001 111.106 177.62 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 24.0 t -71.17 -49.03 51.37 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.892 0 CA-C-N 115.694 -0.685 . . . . 45.049999999999997 110.69 174.214 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 18.9 ptmt -70.73 -22.39 62.43 Favored 'General case' 0 N--CA 1.476 0.861 0 CA-C-O 119.427 -0.32 . . . . 71.109999999999999 111.024 -179.099 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -78.19 -36.57 47.21 Favored 'General case' 0 N--CA 1.48 1.052 0 CA-C-O 120.909 0.385 . . . . 72.409999999999997 110.132 176.501 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 88.6 t80 -63.76 -43.87 95.13 Favored 'General case' 0 C--O 1.218 -0.559 0 CA-C-N 115.059 -0.973 . . . . 75.400000000000006 109.935 174.652 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 82.5 m-20 -80.0 -31.82 39.72 Favored 'General case' 0 N--CA 1.484 1.247 0 C-N-CA 124.075 0.95 . . . . 70.409999999999997 112.608 -176.667 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 39.7 t -66.01 -51.56 57.19 Favored 'General case' 0 N--CA 1.492 1.662 0 C-N-CA 122.521 0.329 . . . . 64.549999999999997 110.235 173.907 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -65.91 -38.52 88.93 Favored 'General case' 0 CA--C 1.541 0.596 0 CA-C-N 115.596 -0.729 . . . . 53.149999999999999 111.706 177.505 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -61.95 -53.56 53.97 Favored 'General case' 0 N--CA 1.497 1.921 0 N-CA-C 112.3 0.481 . . . . 73.5 112.3 177.169 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 44.1 t -61.15 -49.48 77.07 Favored 'General case' 0 N--CA 1.483 1.186 0 C-N-CA 122.855 0.462 . . . . 52.530000000000001 111.282 179.466 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 64.4 m -66.4 -27.67 68.03 Favored 'General case' 0 N--CA 1.483 1.189 0 C-N-CA 123.312 0.645 . . . . 72.200000000000003 112.681 -178.621 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 32.1 t70 -63.17 -47.2 83.68 Favored 'General case' 0 N--CA 1.483 1.221 0 CA-C-O 121.336 0.589 . . . . 74.239999999999995 110.815 170.027 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 90.9 mt -74.28 -22.48 59.27 Favored 'General case' 0 N--CA 1.481 1.106 0 CA-C-N 115.274 -0.875 . . . . 74.230000000000004 112.188 -178.042 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 61.6 mtp180 -83.99 -60.8 1.99 Allowed 'General case' 0 N--CA 1.479 1.006 0 C-N-CA 123.457 0.703 . . . . 74.299999999999997 111.488 177.194 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 7.3 t30 -61.16 -38.46 86.54 Favored 'General case' 0 N--CA 1.483 1.223 0 C-N-CA 123.916 0.886 . . . . 61.109999999999999 112.988 -171.038 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 83.9 mt -78.22 -31.95 49.63 Favored 'General case' 0 N--CA 1.486 1.336 0 N-CA-C 111.654 0.242 . . . . 74.239999999999995 111.654 -178.99 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 40.6 ttmt -76.05 -44.96 36.68 Favored 'General case' 0 N--CA 1.474 0.76 0 C-N-CA 122.844 0.457 . . . . 45.43 110.519 -177.286 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 5.8 t -66.77 -32.84 74.4 Favored 'General case' 0 N--CA 1.478 0.951 0 CA-C-N 115.305 -0.861 . . . . 73.319999999999993 110.853 -179.736 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -67.2 -40.19 86.45 Favored 'General case' 0 N--CA 1.475 0.819 0 CA-C-N 114.98 -1.009 . . . . 74.030000000000001 111.557 172.964 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 8.0 tt -64.58 -47.01 80.27 Favored 'General case' 0 N--CA 1.482 1.14 0 C-N-CA 123.724 0.81 . . . . 70.200000000000003 110.465 176.218 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 40.3 mt-10 -65.55 -30.58 71.35 Favored 'General case' 0 N--CA 1.479 1.02 0 C-N-CA 123.54 0.736 . . . . 73.420000000000002 111.523 -179.444 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 23.5 t -81.01 -39.15 26.33 Favored 'General case' 0 N--CA 1.479 0.975 0 C-N-CA 123.012 0.525 . . . . 70.230000000000004 111.591 179.122 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -74.44 -36.72 63.39 Favored 'General case' 0 N--CA 1.486 1.344 0 C-N-CA 123.33 0.652 . . . . 71.019999999999996 111.724 -175.272 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 51' ' ' PHE . . . . . . . . . . . . . 88.4 m-85 -94.19 -10.48 32.96 Favored 'General case' 0 N--CA 1.479 1.015 0 C-N-CA 124.044 0.938 . . . . 72.430000000000007 110.671 177.983 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . 64.04 30.66 13.92 Favored 'General case' 0 C--N 1.362 1.145 0 C-N-CA 124.476 1.11 . . . . 74.25 111.911 178.025 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 38.2 t70 -45.3 -38.18 5.43 Favored 'General case' 0 N--CA 1.489 1.482 0 C-N-CA 126.932 2.093 . . . . 64.019999999999996 115.392 -168.31 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 5.3 m-20 -55.21 -19.8 8.98 Favored 'General case' 0 N--CA 1.495 1.78 0 C-N-CA 124.464 1.106 . . . . 64.420000000000002 113.797 -179.408 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 28.4 pt20 -54.9 -32.91 61.51 Favored 'General case' 0 N--CA 1.489 1.504 0 C-N-CA 124.99 1.316 . . . . 65.319999999999993 113.648 177.054 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 4.8 m -95.83 -0.67 50.86 Favored 'General case' 0 N--CA 1.488 1.436 0 C-N-CA 123.398 0.679 . . . . 72.510000000000005 111.871 -174.305 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 88.0 m-85 -116.12 149.71 43.91 Favored Pre-proline 0 N--CA 1.491 1.588 0 C-N-CA 123.193 0.597 . . . . 74.010000000000005 111.435 -178.134 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 87.4 Cg_endo -77.04 160.5 33.37 Favored 'Trans proline' 0 C--N 1.375 1.963 0 C-N-CA 122.822 2.348 . . . . 72.019999999999996 112.77 175.499 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 47.5 Cg_exo -57.85 126.36 21.49 Favored 'Trans proline' 0 C--N 1.38 2.197 0 C-N-CA 122.651 2.234 . . . . 54.109999999999999 112.798 178.173 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 11.6 pt-20 41.73 76.91 0.06 Allowed 'General case' 0 N--CA 1.492 1.631 0 C-N-CA 125.692 1.597 . . . . 70.219999999999999 113.035 -174.488 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 62.0 p . . . . . 0 N--CA 1.486 1.328 0 CA-C-N 115.416 -0.811 . . . . 72.530000000000001 111.828 -176.658 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 1' ' ' PHE . . . . . 0.426 ' HB3' HD11 ' A' ' 6' ' ' LEU . 90.2 m-85 . . . . . 0 N--CA 1.495 1.802 0 N-CA-C 110.304 -0.258 . . . . 60.5 110.304 . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 2.7 t -117.41 137.64 52.35 Favored 'General case' 0 N--CA 1.48 1.068 0 C-N-CA 123.082 0.553 . . . . 74.019999999999996 110.207 175.666 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 83.1 mt -55.57 -25.24 37.05 Favored 'General case' 0 N--CA 1.482 1.173 0 C-N-CA 124.11 0.964 . . . . 73.340000000000003 112.168 -179.173 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 49.0 mm -64.72 -58.42 7.22 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.767 0 O-C-N 124.007 0.817 . . . . 62.350000000000001 110.798 178.733 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 18.3 mm-40 -67.95 -37.9 82.15 Favored 'General case' 0 N--CA 1.478 0.951 0 N-CA-C 111.912 0.338 . . . . 60.109999999999999 111.912 -176.359 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 6' ' ' LEU . . . . . 0.426 HD11 ' HB3' ' A' ' 1' ' ' PHE . 70.6 mt -62.42 -41.6 98.81 Favored 'General case' 0 N--CA 1.485 1.296 0 C-N-CA 123.152 0.581 . . . . 63.210000000000001 111.973 176.249 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 37.6 tp -66.35 -39.45 89.2 Favored 'General case' 0 CA--C 1.549 0.939 0 C-N-CA 123.252 0.621 . . . . 62.109999999999999 111.82 178.165 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 83.4 mt -67.85 -44.03 85.66 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.873 0 C-N-CA 122.843 0.457 . . . . 75.010000000000005 111.789 176.957 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 53.6 t -60.44 -47.84 90.9 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.974 0 C-N-CA 123.157 0.583 . . . . 55.409999999999997 111.76 177.028 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 4.0 p -66.9 -29.24 45.64 Favored 'Isoleucine or valine' 0 CA--C 1.561 1.383 0 N-CA-C 111.636 0.235 . . . . 63.109999999999999 111.636 178.021 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -71.93 -51.8 20.34 Favored 'General case' 0 N--CA 1.483 1.177 0 C-N-CA 123.074 0.55 . . . . 62.450000000000003 111.899 178.515 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 12' ' ' ILE . . . . . 0.555 ' HA ' HD12 ' A' ' 15' ' ' ILE . 27.3 pt -64.69 -46.26 92.81 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.921 0 C-N-CA 123.141 0.577 . . . . 71.430000000000007 111.273 -175.805 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 81.9 mt -64.67 -29.31 47.0 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.093 0 C-N-CA 123.72 0.808 . . . . 75.200000000000003 110.642 176.405 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -61.26 -39.68 97.54 Favored Glycine 0 C--N 1.354 1.553 0 CA-C-N 116.0 -0.546 . . . . 44.32 112.843 172.515 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 15' ' ' ILE . . . . . 0.555 HD12 ' HA ' ' A' ' 12' ' ' ILE . 16.3 mt -73.38 -44.94 53.8 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.914 0 C-N-CA 123.618 0.767 . . . . 72.239999999999995 110.807 176.644 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.52 ' HG ' ' O ' ' A' ' 12' ' ' ILE . 24.9 mt -59.06 -36.81 75.69 Favored 'General case' 0 N--CA 1.485 1.309 0 C-N-CA 123.4 0.68 . . . . 75.030000000000001 111.249 -177.315 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -70.53 -54.3 12.72 Favored 'General case' 0 CA--C 1.548 0.883 0 C-N-CA 123.131 0.572 . . . . 74.230000000000004 110.253 174.518 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -57.92 -21.35 43.26 Favored 'General case' 0 N--CA 1.48 1.035 0 N-CA-C 114.066 1.136 . . . . 51.340000000000003 114.066 -177.46 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 2.7 pp -97.54 -36.23 5.88 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.06 0 N-CA-C 112.283 0.475 . . . . 73.0 112.283 174.202 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -69.65 -45.87 67.44 Favored 'General case' 0 N--CA 1.49 1.538 0 N-CA-C 112.639 0.607 . . . . 74.010000000000005 112.639 -172.519 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 2.3 mp -57.93 -55.02 49.49 Favored Pre-proline 0 CA--C 1.571 1.759 0 CA-C-O 118.619 -0.705 . . . . 72.219999999999999 112.298 -179.177 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 55.6 Cg_endo -68.51 -34.98 18.68 Favored 'Trans proline' 0 C--N 1.383 2.382 0 C-N-CA 122.277 1.984 . . . . 74.099999999999994 114.025 177.538 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 26.5 tt0 -64.75 -36.93 85.89 Favored 'General case' 0 N--CA 1.49 1.568 0 CA-C-O 121.455 0.645 . . . . 71.150000000000006 110.274 -179.143 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 24' ' ' PHE . . . . . . . . . . . . . 58.4 t80 -86.55 -35.22 19.65 Favored 'General case' 0 N--CA 1.484 1.245 0 CA-C-N 114.636 -1.165 . . . . 75.129999999999995 110.763 -175.477 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 25' ' ' SER . . . . . 0.446 ' O ' HG23 ' A' ' 29' ' ' VAL . 44.5 t -56.89 -55.28 36.52 Favored 'General case' 0 N--CA 1.478 0.93 0 C-N-CA 123.225 0.61 . . . . 74.420000000000002 110.319 169.985 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -61.65 -30.46 70.73 Favored 'General case' 0 N--CA 1.484 1.249 0 C-N-CA 124.26 1.024 . . . . 64.420000000000002 112.483 177.252 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 69.0 t80 -64.15 -51.69 62.66 Favored 'General case' 0 N--CA 1.478 0.926 0 C-N-CA 122.816 0.446 . . . . 71.430000000000007 110.154 175.342 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 28' ' ' ARG . . . . . 0.418 ' O ' ' HB2' ' A' ' 32' ' ' TYR . 80.7 mtp180 -67.49 -25.25 65.77 Favored 'General case' 0 N--CA 1.476 0.861 0 CA-C-N 115.429 -0.805 . . . . 74.530000000000001 111.796 179.709 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 29' ' ' VAL . . . . . 0.446 HG23 ' O ' ' A' ' 25' ' ' SER . 41.9 t -68.19 -54.49 21.71 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.393 0 O-C-N 123.43 0.456 . . . . 63.100000000000001 110.459 176.55 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.17 -24.38 64.06 Favored 'General case' 0 N--CA 1.478 0.926 0 CA-C-N 115.725 -0.671 . . . . 74.409999999999997 111.097 179.099 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -80.8 -31.39 35.68 Favored 'General case' 0 N--CA 1.484 1.24 0 C-N-CA 122.925 0.49 . . . . 70.239999999999995 110.783 -179.884 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 32' ' ' TYR . . . . . 0.418 ' HB2' ' O ' ' A' ' 28' ' ' ARG . 4.9 t80 -74.27 -19.19 60.58 Favored 'General case' 0 N--CA 1.484 1.268 0 C-N-CA 123.181 0.592 . . . . 71.439999999999998 110.372 177.897 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 17.9 m120 -91.94 -52.76 4.57 Favored 'General case' 0 N--CA 1.473 0.707 0 C-N-CA 123.721 0.808 . . . . 63.229999999999997 110.86 175.063 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 44.0 t -65.43 -59.37 4.08 Favored 'General case' 0 N--CA 1.484 1.259 0 C-N-CA 123.313 0.645 . . . . 65.340000000000003 111.683 -174.096 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -61.58 -40.54 95.14 Favored 'General case' 0 N--CA 1.479 0.977 0 N-CA-C 112.135 0.42 . . . . 74.420000000000002 112.135 -179.09 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -64.18 -46.42 84.06 Favored 'General case' 0 N--CA 1.485 1.294 0 C-N-CA 122.427 0.291 . . . . 62.240000000000002 111.015 -178.201 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 73.0 m -65.14 -44.01 90.01 Favored 'General case' 0 N--CA 1.476 0.839 0 CA-C-N 116.184 -0.462 . . . . 73.439999999999998 111.663 175.659 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 64.1 m -72.23 -35.36 68.84 Favored 'General case' 0 N--CA 1.484 1.256 0 N-CA-C 113.06 0.763 . . . . 72.239999999999995 113.06 -171.535 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 17.4 m-20 -64.1 -51.42 64.1 Favored 'General case' 0 N--CA 1.476 0.86 0 O-C-N 123.474 0.484 . . . . 63.450000000000003 110.339 170.53 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -64.24 -32.47 74.07 Favored 'General case' 0 N--CA 1.483 1.21 0 C-N-CA 123.021 0.529 . . . . 50.0 111.95 -176.115 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 88.6 mtm180 -79.78 -38.12 33.82 Favored 'General case' 0 N--CA 1.486 1.366 0 C-N-CA 122.787 0.435 . . . . 72.310000000000002 110.787 178.712 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 62.4 t30 -64.55 -35.91 82.51 Favored 'General case' 0 N--CA 1.49 1.536 0 C-N-CA 122.967 0.507 . . . . 72.519999999999996 111.192 175.425 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 96.2 mt -78.02 -35.99 49.22 Favored 'General case' 0 N--CA 1.48 1.043 0 C-N-CA 123.402 0.681 . . . . 74.450000000000003 110.985 179.058 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 6.2 tmmm? -72.02 -43.77 64.47 Favored 'General case' 0 N--CA 1.478 0.962 0 C-N-CA 122.74 0.416 . . . . 74.109999999999999 110.177 -177.955 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 2.0 t -67.22 -30.92 70.97 Favored 'General case' 0 N--CA 1.479 0.984 0 C-N-CA 123.781 0.832 . . . . 62.509999999999998 111.569 -179.892 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -63.59 -53.18 55.68 Favored 'General case' 0 N--CA 1.478 0.969 0 CA-C-N 115.37 -0.832 . . . . 61.409999999999997 111.038 173.817 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 10.8 mp -68.61 -27.02 65.66 Favored 'General case' 0 N--CA 1.487 1.418 0 C-N-CA 123.432 0.693 . . . . 74.230000000000004 112.111 177.297 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 9.5 tp10 -69.89 -51.44 33.13 Favored 'General case' 0 C--N 1.35 0.624 0 C-N-CA 124.348 1.059 . . . . 53.509999999999998 110.365 179.142 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 47.1 t -62.83 -36.58 83.67 Favored 'General case' 0 N--CA 1.481 1.092 0 C-N-CA 124.091 0.956 . . . . 65.349999999999994 111.756 177.207 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -61.97 -50.56 71.61 Favored 'General case' 0 N--CA 1.479 1.006 0 C-N-CA 123.638 0.775 . . . . 64.120000000000005 111.798 177.919 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 51' ' ' PHE . . . . . . . . . . . . . 32.5 t80 -75.32 -23.3 57.27 Favored 'General case' 0 CA--C 1.56 1.331 0 C-N-CA 122.819 0.447 . . . . 73.409999999999997 111.348 178.552 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -71.91 -24.67 61.68 Favored 'General case' 0 N--CA 1.487 1.405 0 C-N-CA 123.464 0.705 . . . . 64.099999999999994 112.095 175.148 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 23.6 t70 -63.48 -33.45 75.6 Favored 'General case' 0 N--CA 1.482 1.169 0 C-N-CA 123.349 0.66 . . . . 72.25 110.922 174.769 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 36.2 t70 -72.21 -25.23 61.57 Favored 'General case' 0 CA--C 1.557 1.242 0 C-N-CA 123.643 0.777 . . . . 74.299999999999997 111.908 176.526 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 12.0 pt20 -127.16 39.47 3.9 Favored 'General case' 0 N--CA 1.49 1.56 0 C-N-CA 123.465 0.706 . . . . 72.329999999999998 111.93 -173.708 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 82.7 p -55.66 -41.33 73.49 Favored 'General case' 0 N--CA 1.501 2.088 0 C-N-CA 123.018 0.527 . . . . 64.239999999999995 112.352 -179.063 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 45.9 t80 -145.22 96.09 4.98 Favored Pre-proline 0 N--CA 1.481 1.105 0 C-N-CA 123.31 0.644 . . . . 74.510000000000005 110.032 168.831 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 15.0 Cg_exo -71.55 168.79 22.62 Favored 'Trans proline' 0 CA--C 1.565 2.039 0 C-N-CA 123.182 2.588 . . . . 74.010000000000005 112.265 171.596 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 31.7 Cg_exo -60.06 97.33 0.11 Allowed 'Trans proline' 0 C--N 1.381 2.282 0 C-N-CA 122.403 2.069 . . . . 55.409999999999997 112.053 173.527 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 1.2 tm-20 -67.53 103.66 1.39 Allowed 'General case' 0 CA--C 1.551 1.013 0 C-N-CA 123.567 0.747 . . . . 51.240000000000002 111.198 -176.024 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 62.2 m . . . . . 0 N--CA 1.484 1.261 0 C-N-CA 124.261 1.025 . . . . 72.209999999999994 109.926 179.638 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 1' ' ' PHE . . . . . . . . . . . . . 97.5 m-85 . . . . . 0 N--CA 1.488 1.43 0 N-CA-C 110.549 -0.167 . . . . 60.539999999999999 110.549 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 2' ' ' THR . . . . . 0.544 HG23 ' H ' ' A' ' 5' ' ' GLU . 6.7 t -152.63 150.11 29.16 Favored 'General case' 0 N--CA 1.482 1.16 0 C-N-CA 123.66 0.784 . . . . 70.230000000000004 110.696 178.002 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 3' ' ' LEU . . . . . 0.468 ' HA ' HD12 ' A' ' 6' ' ' LEU . 9.2 mp -65.84 -17.43 64.64 Favored 'General case' 0 N--CA 1.478 0.958 0 CA-C-N 115.331 -0.849 . . . . 62.229999999999997 111.247 176.858 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 45.8 mm -67.86 -43.86 85.76 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.141 0 C-N-CA 123.136 0.574 . . . . 64.420000000000002 110.894 175.398 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 5' ' ' GLU . . . . . 0.544 ' H ' HG23 ' A' ' 2' ' ' THR . 25.6 mm-40 -58.86 -41.26 86.62 Favored 'General case' 0 N--CA 1.49 1.545 0 C-N-CA 123.089 0.555 . . . . 62.329999999999998 111.372 174.308 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 6' ' ' LEU . . . . . 0.468 HD12 ' HA ' ' A' ' 3' ' ' LEU . 71.5 mt -61.2 -47.48 85.95 Favored 'General case' 0 N--CA 1.482 1.134 0 C-N-CA 123.368 0.667 . . . . 72.519999999999996 111.223 175.13 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 60.4 tp -54.93 -42.94 72.88 Favored 'General case' 0 CA--C 1.554 1.104 0 C-N-CA 124.59 1.156 . . . . 74.239999999999995 112.238 176.305 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 94.8 mt -70.69 -40.54 77.07 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.091 0 C-N-CA 124.308 1.043 . . . . 73.310000000000002 111.993 178.88 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 46.1 t -62.52 -45.7 98.16 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.959 0 C-N-CA 123.325 0.65 . . . . 72.409999999999997 111.095 175.718 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 69.1 t -62.07 -36.79 76.16 Favored 'Isoleucine or valine' 0 CA--C 1.561 1.387 0 C-N-CA 123.281 0.633 . . . . 74.150000000000006 111.379 174.664 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -65.95 -51.6 57.12 Favored 'General case' 0 CA--C 1.553 1.081 0 C-N-CA 123.099 0.559 . . . . 73.329999999999998 112.276 178.688 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 12' ' ' ILE . . . . . 0.609 ' HA ' HD12 ' A' ' 15' ' ' ILE . 23.5 pt -68.41 -42.42 84.04 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.089 0 C-N-CA 123.159 0.584 . . . . 71.430000000000007 111.978 -175.199 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 79.3 mt -65.14 -32.68 59.34 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.028 0 C-N-CA 123.307 0.643 . . . . 75.030000000000001 110.51 174.807 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -60.82 -38.25 94.99 Favored Glycine 0 C--N 1.354 1.573 0 CA-C-N 115.831 -0.622 . . . . 71.439999999999998 112.833 174.992 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 15' ' ' ILE . . . . . 0.609 HD12 ' HA ' ' A' ' 12' ' ' ILE . 24.7 mt -69.87 -43.05 79.96 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.975 0 C-N-CA 123.877 0.871 . . . . 64.0 111.173 175.569 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.492 ' HG ' ' O ' ' A' ' 12' ' ' ILE . 20.7 mt -63.95 -35.73 81.65 Favored 'General case' 0 N--CA 1.486 1.37 0 C-N-CA 122.969 0.508 . . . . 74.25 111.366 -178.766 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -73.24 -44.58 59.22 Favored 'General case' 0 N--CA 1.479 1.014 0 C-N-CA 123.216 0.606 . . . . 75.209999999999994 110.673 175.564 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -60.38 -28.56 68.31 Favored 'General case' 0 N--CA 1.483 1.209 0 C-N-CA 124.166 0.986 . . . . 55.299999999999997 113.267 -179.843 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 2.8 pp -89.75 -38.38 11.03 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.327 0 CA-C-N 118.101 0.41 . . . . 63.450000000000003 111.607 173.656 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -67.8 -54.42 19.22 Favored 'General case' 0 N--CA 1.487 1.386 0 N-CA-C 112.724 0.639 . . . . 63.43 112.724 -172.779 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 21.7 mt -53.07 -54.19 47.06 Favored Pre-proline 0 CA--C 1.566 1.576 0 N-CA-C 113.902 1.075 . . . . 73.150000000000006 113.902 -176.587 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 38.2 Cg_endo -65.66 -38.83 22.97 Favored 'Trans proline' 0 C--N 1.381 2.24 0 CA-C-N 121.636 1.62 . . . . 73.120000000000005 113.166 175.118 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 20.1 tt0 -62.98 -38.16 90.03 Favored 'General case' 0 N--CA 1.489 1.525 0 C-N-CA 123.462 0.705 . . . . 75.310000000000002 110.95 -177.102 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 24' ' ' PHE . . . . . . . . . . . . . 32.8 m-85 -91.9 -36.99 13.15 Favored 'General case' 0 N--CA 1.486 1.348 0 CA-C-N 115.046 -0.979 . . . . 72.409999999999997 111.746 -174.663 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 47.3 t -63.59 -46.75 84.41 Favored 'General case' 0 N--CA 1.492 1.639 0 CA-C-N 117.774 0.261 . . . . 70.140000000000001 111.189 173.777 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -67.14 -26.44 66.67 Favored 'General case' 0 N--CA 1.483 1.207 0 C-N-CA 122.909 0.484 . . . . 62.329999999999998 111.834 174.796 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 68.8 t80 -66.42 -55.15 17.14 Favored 'General case' 0 N--CA 1.485 1.284 0 C-N-CA 122.995 0.518 . . . . 74.439999999999998 111.131 178.897 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 35.6 ptt180 -65.45 -28.93 69.57 Favored 'General case' 0 N--CA 1.475 0.817 0 C-N-CA 123.473 0.709 . . . . 74.329999999999998 111.488 -175.841 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 78.6 t -77.35 -48.32 24.79 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.843 0 CA-C-N 115.976 -0.556 . . . . 63.030000000000001 110.422 179.085 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 15.1 pttp -67.79 -27.52 66.81 Favored 'General case' 0 N--CA 1.476 0.848 0 CA-C-N 116.171 -0.468 . . . . 72.400000000000006 110.557 178.709 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -81.28 -30.01 34.13 Favored 'General case' 0 C--N 1.366 1.292 0 N-CA-C 110.086 -0.339 . . . . 74.439999999999998 110.086 -179.798 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 62.2 t80 -62.75 -54.29 41.41 Favored 'General case' 0 C--N 1.352 0.7 0 CA-C-N 115.957 -0.565 . . . . 73.239999999999995 109.724 174.72 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 52.1 m-80 -69.35 -37.7 77.78 Favored 'General case' 0 N--CA 1.479 0.993 0 C-N-CA 123.637 0.775 . . . . 75.310000000000002 113.064 179.512 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 33.7 t -63.42 -55.89 20.65 Favored 'General case' 0 N--CA 1.498 1.953 0 CA-C-O 120.964 0.411 . . . . 34.210000000000001 111.502 178.734 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -68.12 -38.01 81.78 Favored 'General case' 0 CA--C 1.542 0.637 0 CA-C-N 115.435 -0.802 . . . . 74.129999999999995 112.027 -179.205 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -66.35 -52.79 43.42 Favored 'General case' 0 N--CA 1.499 1.983 0 N-CA-C 112.242 0.46 . . . . 62.439999999999998 112.242 179.735 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 50.7 m -58.16 -43.45 87.4 Favored 'General case' 0 N--CA 1.488 1.431 0 C-N-CA 123.1 0.56 . . . . 75.540000000000006 111.465 179.689 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 41.7 t -74.37 -32.08 62.62 Favored 'General case' 0 N--CA 1.481 1.121 0 CA-C-N 116.022 -0.535 . . . . 73.230000000000004 112.038 -179.275 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 24.1 t70 -59.09 -54.92 41.59 Favored 'General case' 0 N--CA 1.48 1.062 0 C-N-CA 122.926 0.49 . . . . 63.409999999999997 111.21 175.44 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 4.0 pp -75.4 -26.46 58.43 Favored 'General case' 0 N--CA 1.49 1.567 0 CA-C-N 116.125 -0.488 . . . . 74.129999999999995 111.455 -172.119 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 59.1 ttp180 -75.76 -40.99 54.41 Favored 'General case' 0 CA--C 1.545 0.785 0 C-N-CA 123.554 0.742 . . . . 75.030000000000001 110.87 175.788 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 64.1 t30 -67.62 -36.93 81.73 Favored 'General case' 0 N--CA 1.487 1.409 0 C-N-CA 123.301 0.641 . . . . 60.149999999999999 111.11 178.945 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 81.0 mt -73.3 -27.97 61.84 Favored 'General case' 0 N--CA 1.482 1.168 0 C-N-CA 122.891 0.476 . . . . 75.200000000000003 111.33 178.443 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 44' ' ' LYS . . . . . 0.463 ' HE3' ' HA ' ' A' ' 44' ' ' LYS . 0.1 OUTLIER -79.34 -44.72 21.01 Favored 'General case' 0 N--CA 1.469 0.506 0 C-N-CA 122.723 0.409 . . . . 61.340000000000003 110.215 -179.887 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 4.9 t -69.53 -34.43 74.24 Favored 'General case' 0 N--CA 1.48 1.033 0 O-C-N 123.715 0.634 . . . . 72.409999999999997 111.17 -177.637 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -69.1 -41.79 76.98 Favored 'General case' 0 N--CA 1.477 0.887 0 C-N-CA 123.718 0.807 . . . . 62.439999999999998 111.304 174.06 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 42.9 tp -66.32 -43.98 84.67 Favored 'General case' 0 N--CA 1.477 0.899 0 C-N-CA 123.481 0.712 . . . . 74.200000000000003 112.165 -179.78 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 12.9 pt-20 -74.05 -34.05 63.93 Favored 'General case' 0 N--CA 1.484 1.254 0 C-N-CA 122.798 0.439 . . . . 73.340000000000003 111.624 -177.199 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 79.4 p -72.32 -33.95 67.74 Favored 'General case' 0 N--CA 1.489 1.484 0 C-N-CA 122.725 0.41 . . . . 55.119999999999997 110.896 175.561 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -70.38 -41.91 72.44 Favored 'General case' 0 N--CA 1.479 0.986 0 CA-C-N 115.646 -0.706 . . . . 72.319999999999993 111.074 177.696 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 51' ' ' PHE . . . . . . . . . . . . . 69.7 t80 -79.6 -15.85 56.9 Favored 'General case' 0 CA--C 1.553 1.059 0 C-N-CA 123.256 0.622 . . . . 74.439999999999998 110.67 179.998 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -67.54 -40.76 85.02 Favored 'General case' 0 N--CA 1.478 0.929 0 C-N-CA 123.25 0.62 . . . . 71.109999999999999 110.515 179.688 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 3.0 p30 -78.01 -26.8 48.73 Favored 'General case' 0 CA--C 1.555 1.155 0 CA-C-N 116.039 -0.528 . . . . 63.119999999999997 111.595 178.857 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -62.95 -53.83 47.94 Favored 'General case' 0 N--CA 1.488 1.447 0 C-N-CA 123.181 0.592 . . . . 73.120000000000005 111.451 171.265 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 10.5 pt20 -68.92 -33.96 74.6 Favored 'General case' 0 N--CA 1.481 1.124 0 C-N-CA 122.58 0.352 . . . . 72.349999999999994 111.948 -176.572 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 81.7 p -92.98 73.17 4.76 Favored 'General case' 0 N--CA 1.485 1.319 0 CA-C-O 122.153 0.978 . . . . 62.020000000000003 109.936 172.627 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 36.6 p90 -101.21 151.38 37.7 Favored Pre-proline 0 CA--C 1.557 1.215 0 CA-C-N 114.725 -1.125 . . . . 72.030000000000001 110.34 179.129 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 45.3 Cg_exo -57.58 134.17 61.47 Favored 'Trans proline' 0 C--N 1.379 2.148 0 C-N-CA 122.319 2.013 . . . . 71.319999999999993 112.062 175.157 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 50.0 Cg_exo -56.7 140.76 91.36 Favored 'Trans proline' 0 C--N 1.378 2.08 0 C-N-CA 123.128 2.552 . . . . 43.299999999999997 113.664 179.167 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 11.5 pt-20 -56.22 -43.4 78.54 Favored 'General case' 0 CA--C 1.561 1.38 0 C-N-CA 124.175 0.99 . . . . 62.219999999999999 112.776 -178.772 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 63.5 m . . . . . 0 N--CA 1.488 1.456 0 C-N-CA 124.78 1.232 . . . . 73.25 109.434 179.26 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 1' ' ' PHE . . . . . . . . . . . . . 86.3 m-85 . . . . . 0 N--CA 1.487 1.411 0 N-CA-C 110.295 -0.261 . . . . 61.450000000000003 110.295 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 55.1 m -78.45 123.01 26.57 Favored 'General case' 0 N--CA 1.476 0.845 0 N-CA-C 109.023 -0.732 . . . . 64.200000000000003 109.023 179.339 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 3' ' ' LEU . . . . . 0.506 HD13 HD12 ' A' ' 6' ' ' LEU . 3.3 mm? -62.27 -23.04 66.47 Favored 'General case' 0 N--CA 1.487 1.391 0 C-N-CA 123.192 0.597 . . . . 60.140000000000001 111.755 -177.594 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 47.8 mm -69.75 -49.37 58.42 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.118 0 C-N-CA 123.165 0.586 . . . . 72.319999999999993 110.475 171.397 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 40.8 mm-40 -59.35 -38.32 80.08 Favored 'General case' 0 N--CA 1.491 1.614 0 C-N-CA 123.337 0.655 . . . . 74.450000000000003 112.166 176.062 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 6' ' ' LEU . . . . . 0.506 HD12 HD13 ' A' ' 3' ' ' LEU . 78.6 mt -69.95 -39.75 75.84 Favored 'General case' 0 N--CA 1.48 1.033 0 C-N-CA 123.001 0.521 . . . . 72.450000000000003 111.31 176.883 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 2.1 tm? -60.01 -48.46 81.62 Favored 'General case' 0 CA--C 1.552 1.028 0 C-N-CA 123.632 0.773 . . . . 63.399999999999999 110.432 176.958 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 77.6 mt -68.84 -48.29 71.57 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.732 0 C-N-CA 123.997 0.919 . . . . 75.519999999999996 112.227 -177.568 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 7.1 p -60.57 -40.62 85.07 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.158 0 CA-C-N 118.22 0.463 . . . . 64.310000000000002 111.823 -178.29 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 54.0 t -67.16 -41.52 87.02 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.027 0 C-N-CA 123.328 0.651 . . . . 64.239999999999995 110.903 173.572 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -64.03 -52.43 59.5 Favored 'General case' 0 N--CA 1.484 1.242 0 C-N-CA 122.946 0.498 . . . . 63.350000000000001 111.987 -178.581 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 12' ' ' ILE . . . . . 0.51 ' O ' ' HG ' ' A' ' 16' ' ' LEU . 28.6 pt -64.09 -47.21 91.23 Favored 'Isoleucine or valine' 0 C--N 1.355 0.815 0 C-N-CA 123.362 0.665 . . . . 70.030000000000001 111.474 -175.817 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 79.0 mt -64.21 -31.04 51.8 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.054 0 C-N-CA 123.322 0.649 . . . . 63.039999999999999 110.443 177.929 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -65.26 -40.52 96.69 Favored Glycine 0 C--N 1.352 1.445 0 CA-C-N 115.714 -0.675 . . . . 74.140000000000001 112.9 174.084 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 22.4 mt -69.05 -44.77 80.91 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.052 0 C-N-CA 123.63 0.772 . . . . 61.030000000000001 110.833 175.382 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.51 ' HG ' ' O ' ' A' ' 12' ' ' ILE . 16.3 mt -60.99 -37.14 81.44 Favored 'General case' 0 N--CA 1.48 1.047 0 C-N-CA 123.345 0.658 . . . . 72.340000000000003 111.043 -178.314 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -74.24 -49.33 23.73 Favored 'General case' 0 CA--C 1.551 1.002 0 C-N-CA 122.959 0.504 . . . . 74.329999999999998 110.944 176.352 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -55.82 -29.94 60.6 Favored 'General case' 0 N--CA 1.491 1.594 0 C-N-CA 124.017 0.927 . . . . 74.310000000000002 113.248 -178.787 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 2.8 pp -86.97 -37.66 11.44 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.833 0 CA-C-O 119.601 -0.237 . . . . 74.5 111.472 172.432 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -61.95 -53.98 48.06 Favored 'General case' 0 N--CA 1.487 1.411 0 C-N-CA 124.009 0.924 . . . . 75.120000000000005 113.274 -172.098 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 3.0 mp -56.46 -54.62 51.35 Favored Pre-proline 0 CA--C 1.572 1.817 0 CA-C-O 118.444 -0.789 . . . . 54.130000000000003 112.614 -175.094 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 36.7 Cg_endo -64.85 -39.33 26.0 Favored 'Trans proline' 0 C--N 1.381 2.268 0 C-N-CA 122.166 1.911 . . . . 75.219999999999999 113.305 176.385 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 38.5 tt0 -60.05 -43.55 95.3 Favored 'General case' 0 N--CA 1.489 1.512 0 C-N-CA 123.944 0.898 . . . . 65.510000000000005 110.523 -179.075 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 24' ' ' PHE . . . . . . . . . . . . . 16.0 m-85 -87.67 -28.28 21.92 Favored 'General case' 0 N--CA 1.485 1.324 0 CA-C-N 114.819 -1.082 . . . . 74.319999999999993 111.319 -172.281 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 74.3 m -59.62 -59.41 5.48 Favored 'General case' 0 N--CA 1.481 1.122 0 N-CA-C 109.549 -0.537 . . . . 74.219999999999999 109.549 167.264 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -62.0 -26.95 68.52 Favored 'General case' 0 N--CA 1.485 1.289 0 C-N-CA 124.02 0.928 . . . . 51.310000000000002 112.715 -179.714 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 27' ' ' TYR . . . . . 0.428 ' O ' ' HG2' ' A' ' 30' ' ' LYS . 57.3 t80 -70.03 -52.92 20.2 Favored 'General case' 0 N--CA 1.484 1.252 0 C-N-CA 123.476 0.71 . . . . 65.409999999999997 110.885 176.21 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 82.4 mtp180 -71.84 -20.68 61.79 Favored 'General case' 0 N--CA 1.475 0.81 0 CA-C-N 115.812 -0.631 . . . . 73.099999999999994 111.524 179.505 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 38.9 t -76.82 -44.51 32.68 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.445 0 C-N-CA 122.744 0.418 . . . . 64.209999999999994 110.397 174.996 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 30' ' ' LYS . . . . . 0.428 ' HG2' ' O ' ' A' ' 27' ' ' TYR . 17.1 ptmt -71.15 -26.79 63.14 Favored 'General case' 0 N--CA 1.479 1.001 0 O-C-N 123.391 0.432 . . . . 73.510000000000005 110.34 178.57 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -81.81 -32.88 31.07 Favored 'General case' 0 C--N 1.362 1.111 0 C-N-CA 123.059 0.544 . . . . 54.25 110.453 178.176 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 41.5 t80 -65.39 -46.23 80.89 Favored 'General case' 0 C--O 1.21 -0.996 0 N-CA-C 108.888 -0.782 . . . . 75.420000000000002 108.888 174.772 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 8.2 t30 -66.64 -45.07 80.22 Favored 'General case' 0 CA--C 1.547 0.832 0 C-N-CA 125.034 1.334 . . . . 74.400000000000006 111.982 177.294 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 42.4 t -63.99 -56.7 13.17 Favored 'General case' 0 N--CA 1.491 1.618 0 C-N-CA 123.27 0.628 . . . . 55.109999999999999 111.877 -179.094 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -65.91 -36.42 83.34 Favored 'General case' 0 N--CA 1.475 0.779 0 C-N-CA 123.139 0.576 . . . . 51.240000000000002 111.992 -179.248 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -69.47 -40.75 76.91 Favored 'General case' 0 N--CA 1.496 1.83 0 CA-C-N 117.764 0.256 . . . . 71.109999999999999 111.639 177.954 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 47.2 t -62.59 -44.58 95.96 Favored 'General case' 0 N--CA 1.484 1.242 0 C-N-CA 123.155 0.582 . . . . 72.219999999999999 110.816 175.375 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 70.9 m -71.04 -26.4 63.07 Favored 'General case' 0 N--CA 1.483 1.207 0 C-N-CA 122.942 0.497 . . . . 72.200000000000003 111.853 178.303 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 28.2 t70 -66.31 -51.17 60.05 Favored 'General case' 0 CA--C 1.551 0.993 0 C-N-CA 123.252 0.621 . . . . 73.140000000000001 110.416 172.929 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 4.0 pp -78.25 -18.34 55.48 Favored 'General case' 0 N--CA 1.49 1.569 0 N-CA-C 112.082 0.401 . . . . 63.439999999999998 112.082 -174.853 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 41' ' ' ARG . . . . . 0.413 ' HA ' ' HD3' ' A' ' 41' ' ' ARG . 26.9 mmt180 -84.13 -59.49 2.39 Favored 'General case' 0 N--CA 1.48 1.06 0 CA-C-O 118.93 -0.557 . . . . 74.530000000000001 112.113 172.695 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 49.5 t-20 -60.56 -42.6 96.95 Favored 'General case' 0 N--CA 1.497 1.887 0 C-N-CA 123.034 0.534 . . . . 62.350000000000001 111.824 -174.432 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 43' ' ' LEU . . . . . 0.439 ' O ' HD23 ' A' ' 47' ' ' LEU . 96.7 mt -75.08 -28.25 60.24 Favored 'General case' 0 N--CA 1.486 1.335 0 C-N-CA 122.43 0.292 . . . . 73.510000000000005 111.471 -175.312 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 29.4 ttpp -79.42 -48.1 14.56 Favored 'General case' 0 N--CA 1.474 0.765 0 N-CA-C 109.664 -0.495 . . . . 74.340000000000003 109.664 178.613 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 3.9 t -70.22 -27.21 64.29 Favored 'General case' 0 N--CA 1.487 1.424 0 C-N-CA 124.174 0.99 . . . . 71.109999999999999 112.071 -174.455 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -60.92 -50.77 72.08 Favored 'General case' 0 N--CA 1.478 0.97 0 O-C-N 123.74 0.65 . . . . 72.239999999999995 110.914 173.146 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 47' ' ' LEU . . . . . 0.439 HD23 ' O ' ' A' ' 43' ' ' LEU . 4.2 mm? -65.68 -36.16 82.84 Favored 'General case' 0 N--CA 1.487 1.41 0 C-N-CA 123.609 0.763 . . . . 73.510000000000005 111.569 175.98 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 48.7 mt-10 -68.04 -33.75 75.16 Favored 'General case' 0 N--CA 1.483 1.211 0 C-N-CA 122.968 0.507 . . . . 74.109999999999999 111.499 176.579 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 44.1 t -83.08 -23.16 33.22 Favored 'General case' 0 N--CA 1.485 1.302 0 C-N-CA 123.313 0.645 . . . . 43.329999999999998 111.84 177.736 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -79.0 -30.13 44.09 Favored 'General case' 0 N--CA 1.486 1.331 0 C-N-CA 123.6 0.76 . . . . 51.509999999999998 112.551 -175.268 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 51' ' ' PHE . . . . . . . . . . . . . 78.1 t80 -115.83 -22.36 9.13 Favored 'General case' 0 N--CA 1.477 0.898 0 C-N-CA 123.434 0.694 . . . . 64.420000000000002 110.135 -177.966 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . 70.81 89.95 0.1 Allowed 'General case' 0 CA--C 1.55 0.965 0 C-N-CA 125.008 1.323 . . . . 72.129999999999995 109.575 -165.058 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 18.7 t70 -40.14 -52.52 2.56 Favored 'General case' 0 N--CA 1.499 1.991 0 C-N-CA 125.497 1.519 . . . . 74.239999999999995 113.569 -174.653 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 15.0 t70 -114.28 126.42 55.01 Favored 'General case' 0 N--CA 1.48 1.026 0 N-CA-C 108.918 -0.771 . . . . 65.340000000000003 108.918 171.512 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 77.1 mm-40 -81.89 -14.52 56.07 Favored 'General case' 0 N--CA 1.486 1.353 0 N-CA-C 112.849 0.685 . . . . 64.219999999999999 112.849 -174.639 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 40.9 p -119.0 5.44 11.35 Favored 'General case' 0 N--CA 1.493 1.703 0 N-CA-C 113.3 0.852 . . . . 72.430000000000007 113.3 -171.687 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 71.5 t80 -53.85 110.16 1.92 Allowed Pre-proline 0 N--CA 1.489 1.494 0 C-N-CA 124.112 0.965 . . . . 62.039999999999999 112.925 -173.638 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 37.7 Cg_endo -87.89 167.84 6.93 Favored 'Trans proline' 0 CA--C 1.563 1.941 0 C-N-CA 122.713 2.275 . . . . 72.25 112.796 176.373 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 24.5 Cg_exo -66.7 153.06 79.27 Favored 'Trans proline' 0 C--N 1.373 1.841 0 C-N-CA 122.491 2.128 . . . . 74.439999999999998 111.883 163.876 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 2.6 mp0 -68.91 111.38 4.91 Favored 'General case' 0 N--CA 1.481 1.116 0 C-N-CA 123.074 0.55 . . . . 74.340000000000003 110.087 178.791 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 38.3 t . . . . . 0 CA--C 1.563 1.448 0 C-N-CA 123.571 0.748 . . . . 64.439999999999998 111.822 -178.726 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 1' ' ' PHE . . . . . . . . . . . . . 98.9 m-85 . . . . . 0 N--CA 1.487 1.393 0 CA-C-O 120.877 0.37 . . . . 74.010000000000005 110.697 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 31.4 p -75.43 156.14 35.62 Favored 'General case' 0 N--CA 1.483 1.201 0 C-N-CA 123.22 0.608 . . . . 72.010000000000005 111.822 -179.586 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 3.3 mm? -64.63 -19.29 65.6 Favored 'General case' 0 N--CA 1.484 1.255 0 CA-C-N 115.574 -0.739 . . . . 62.399999999999999 111.05 171.931 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 49.6 mm -73.64 -48.57 39.93 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.026 0 C-N-CA 123.163 0.585 . . . . 54.030000000000001 110.668 178.878 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 47.1 mt-10 -56.64 -44.35 81.18 Favored 'General case' 0 N--CA 1.489 1.49 0 C-N-CA 123.396 0.679 . . . . 74.310000000000002 111.267 175.971 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 82.3 mt -59.18 -47.0 86.94 Favored 'General case' 0 N--CA 1.481 1.106 0 C-N-CA 123.439 0.696 . . . . 72.400000000000006 111.579 174.213 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 37.1 tp -56.7 -40.37 75.49 Favored 'General case' 0 CA--C 1.549 0.926 0 C-N-CA 123.454 0.701 . . . . 73.140000000000001 112.138 178.706 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 82.4 mt -66.52 -50.43 66.9 Favored 'Isoleucine or valine' 0 C--N 1.355 0.825 0 C-N-CA 123.972 0.909 . . . . 72.519999999999996 111.275 178.458 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 86.8 t -58.25 -44.11 87.31 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.974 0 C-N-CA 123.583 0.753 . . . . 75.030000000000001 111.343 179.18 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 70.0 t -67.07 -36.15 76.28 Favored 'Isoleucine or valine' 0 CA--C 1.554 1.121 0 C-N-CA 122.896 0.478 . . . . 75.239999999999995 111.695 176.429 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -67.18 -53.55 29.35 Favored 'General case' 0 N--CA 1.483 1.188 0 C-N-CA 122.607 0.363 . . . . 75.519999999999996 111.325 179.991 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 12' ' ' ILE . . . . . 0.628 HG13 HD12 ' A' ' 13' ' ' ILE . 33.4 pt -64.1 -48.4 86.0 Favored 'Isoleucine or valine' 0 CA--C 1.554 1.107 0 C-N-CA 123.439 0.696 . . . . 61.25 111.651 -175.829 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 13' ' ' ILE . . . . . 0.628 HD12 HG13 ' A' ' 12' ' ' ILE . 1.8 mp -64.84 -32.97 60.41 Favored 'Isoleucine or valine' 0 C--N 1.372 1.566 0 C-N-CA 123.066 0.546 . . . . 75.109999999999999 109.986 175.479 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -59.53 -37.63 92.44 Favored Glycine 0 C--N 1.352 1.424 0 O-C-N 123.578 0.549 . . . . 63.43 113.328 177.641 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 18.5 mt -72.12 -44.65 64.93 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.989 0 C-N-CA 123.372 0.669 . . . . 65.310000000000002 110.784 176.043 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.521 ' HG ' ' O ' ' A' ' 12' ' ' ILE . 22.7 mt -59.63 -37.89 79.87 Favored 'General case' 0 N--CA 1.488 1.442 0 C-N-CA 123.428 0.691 . . . . 72.329999999999998 111.136 179.41 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -74.1 -48.7 27.9 Favored 'General case' 0 N--CA 1.474 0.754 0 C-N-CA 123.603 0.761 . . . . 52.520000000000003 110.918 178.498 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -56.41 -27.76 57.45 Favored 'General case' 0 N--CA 1.486 1.33 0 C-N-CA 123.91 0.884 . . . . 71.200000000000003 112.803 -178.176 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 2.8 pp -91.39 -37.92 9.82 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.175 0 N-CA-C 112.035 0.383 . . . . 64.230000000000004 112.035 172.89 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -66.93 -50.1 63.45 Favored 'General case' 0 N--CA 1.489 1.498 0 N-CA-C 113.141 0.793 . . . . 75.310000000000002 113.141 -171.089 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 2.5 mp -59.35 -54.24 58.11 Favored Pre-proline 0 CA--C 1.567 1.623 0 CA-C-O 118.534 -0.746 . . . . 74.239999999999995 112.509 -175.392 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 30.2 Cg_endo -63.44 -39.74 35.05 Favored 'Trans proline' 0 C--N 1.384 2.43 0 C-N-CA 121.921 1.747 . . . . 64.439999999999998 113.43 176.514 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 61.0 tt0 -64.88 -37.29 87.13 Favored 'General case' 0 N--CA 1.483 1.199 0 CA-C-N 115.366 -0.834 . . . . 75.299999999999997 110.566 -177.04 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 24' ' ' PHE . . . . . . . . . . . . . 71.6 t80 -83.05 -36.86 24.6 Favored 'General case' 0 N--CA 1.484 1.234 0 CA-C-N 114.701 -1.136 . . . . 73.340000000000003 110.898 -176.243 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 40.6 t -57.39 -44.69 84.71 Favored 'General case' 0 N--CA 1.48 1.053 0 C-N-CA 123.139 0.575 . . . . 53.009999999999998 110.941 172.108 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -72.57 -32.8 66.3 Favored 'General case' 0 N--CA 1.477 0.907 0 CA-C-N 115.878 -0.601 . . . . 64.340000000000003 111.873 176.077 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 76.5 t80 -68.48 -47.44 67.06 Favored 'General case' 0 N--CA 1.493 1.684 0 C-N-CA 124.135 0.974 . . . . 75.540000000000006 112.223 -176.437 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 10.4 ptm180 -75.2 -24.72 57.82 Favored 'General case' 0 N--CA 1.475 0.802 0 CA-C-N 115.303 -0.862 . . . . 64.299999999999997 110.914 -175.274 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 86.2 t -84.01 -34.14 9.84 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.555 0 CA-C-O 121.143 0.497 . . . . 51.310000000000002 109.966 175.851 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 30.0 tttt -61.77 -35.28 77.67 Favored 'General case' 0 CA--C 1.546 0.823 0 C-N-CA 123.703 0.801 . . . . 74.120000000000005 110.172 167.301 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -68.72 -39.45 80.4 Favored 'General case' 0 N--CA 1.48 1.07 0 C-N-CA 123.239 0.616 . . . . 31.32 110.724 178.111 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 76.0 t80 -59.16 -59.7 5.04 Favored 'General case' 0 C--O 1.212 -0.871 0 CA-C-N 115.714 -0.675 . . . . 75.400000000000006 110.084 173.908 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 3.9 m-20 -56.8 -44.15 81.66 Favored 'General case' 0 N--CA 1.486 1.325 0 C-N-CA 124.06 0.944 . . . . 73.439999999999998 113.128 -179.512 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 46.9 t -68.04 -57.16 6.59 Favored 'General case' 0 N--CA 1.487 1.401 0 C-N-CA 123.289 0.635 . . . . 64.400000000000006 110.842 -177.151 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -65.9 -36.14 82.57 Favored 'General case' 0 N--CA 1.48 1.037 0 N-CA-C 112.3 0.482 . . . . 72.230000000000004 112.3 -178.758 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -69.08 -47.83 64.26 Favored 'General case' 0 N--CA 1.495 1.803 0 N-CA-C 111.921 0.341 . . . . 51.32 111.921 179.175 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 67.3 m -69.23 -33.26 73.0 Favored 'General case' 0 N--CA 1.486 1.372 0 C-N-CA 122.62 0.368 . . . . 63.130000000000003 111.762 179.179 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 32.2 t -78.96 -26.14 43.51 Favored 'General case' 0 N--CA 1.486 1.342 0 C-N-CA 123.071 0.549 . . . . 42.520000000000003 111.339 178.284 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 27.1 t70 -67.63 -48.27 67.21 Favored 'General case' 0 N--CA 1.476 0.865 0 C-N-CA 123.146 0.578 . . . . 74.010000000000005 110.123 169.165 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 92.2 mt -67.13 -30.97 71.11 Favored 'General case' 0 N--CA 1.483 1.193 0 C-N-CA 123.144 0.578 . . . . 64.329999999999998 110.974 -179.497 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 50.1 ttm-85 -71.78 -45.79 60.45 Favored 'General case' 0 CA--C 1.541 0.626 0 C-N-CA 123.269 0.628 . . . . 74.409999999999997 110.266 175.178 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 63.3 t30 -64.28 -39.76 94.58 Favored 'General case' 0 N--CA 1.482 1.139 0 C-N-CA 123.605 0.762 . . . . 75.439999999999998 111.863 -179.047 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 93.9 mt -75.91 -30.93 58.93 Favored 'General case' 0 N--CA 1.479 1.009 0 C-N-CA 123.247 0.619 . . . . 74.310000000000002 111.292 179.889 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 23.8 ttmm -73.55 -47.52 40.13 Favored 'General case' 0 N--CA 1.477 0.918 0 C-N-CA 123.039 0.536 . . . . 75.019999999999996 110.21 -178.483 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 3.6 t -68.69 -32.83 72.92 Favored 'General case' 0 N--CA 1.475 0.811 0 CA-C-N 114.592 -1.185 . . . . 75.409999999999997 111.362 -178.436 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -70.68 -43.6 68.74 Favored 'General case' 0 N--CA 1.474 0.727 0 CA-C-N 115.356 -0.838 . . . . 74.109999999999999 111.236 173.791 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 47' ' ' LEU . . . . . 0.483 HD23 HG23 ' A' ' 56' ' ' THR . 14.4 tp -70.52 -37.23 74.1 Favored 'General case' 0 N--CA 1.487 1.377 0 C-N-CA 123.108 0.563 . . . . 54.039999999999999 111.611 -175.77 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 12.2 pt-20 -74.16 -30.85 62.46 Favored 'General case' 0 N--CA 1.482 1.137 0 CA-C-N 116.187 -0.461 . . . . 75.200000000000003 111.071 178.217 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 24.9 t -82.28 -14.9 54.7 Favored 'General case' 0 N--CA 1.487 1.414 0 C-N-CA 123.027 0.531 . . . . 51.210000000000001 112.103 174.296 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -83.2 -49.37 9.52 Favored 'General case' 0 N--CA 1.485 1.305 0 C-N-CA 123.568 0.747 . . . . 74.25 111.159 -179.12 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 51' ' ' PHE . . . . . . . . . . . . . 25.6 m-85 -87.59 -42.01 13.03 Favored 'General case' 0 N--CA 1.47 0.539 0 CA-C-N 115.845 -0.616 . . . . 63.219999999999999 110.498 179.713 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . 60.11 20.23 9.47 Favored 'General case' 0 N--CA 1.49 1.568 0 C-N-CA 124.425 1.09 . . . . 73.329999999999998 112.501 -177.321 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 31.5 t70 -130.42 14.71 5.54 Favored 'General case' 0 N--CA 1.491 1.604 0 C-N-CA 123.829 0.852 . . . . 63.329999999999998 111.022 -174.004 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 26.7 m-20 61.75 24.64 14.71 Favored 'General case' 0 N--CA 1.493 1.708 0 C-N-CA 124.596 1.158 . . . . 71.5 113.604 179.652 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 20.8 mt-30 -74.9 -6.1 47.3 Favored 'General case' 0 N--CA 1.485 1.29 0 C-N-CA 123.615 0.766 . . . . 75.310000000000002 111.505 174.972 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 56' ' ' THR . . . . . 0.483 HG23 HD23 ' A' ' 47' ' ' LEU . 80.6 m -55.62 -38.43 69.47 Favored 'General case' 0 N--CA 1.484 1.269 0 C-N-CA 124.599 1.16 . . . . 64.219999999999999 111.623 171.209 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 92.9 m-85 -112.26 101.49 52.21 Favored Pre-proline 0 CA--C 1.556 1.206 0 C-N-CA 123.366 0.666 . . . . 73.030000000000001 110.188 178.003 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 16.4 Cg_exo -71.48 157.34 56.57 Favored 'Trans proline' 0 CA--C 1.564 2.02 0 C-N-CA 122.754 2.303 . . . . 74.219999999999999 112.644 173.692 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 42.1 Cg_exo -58.68 90.54 0.06 OUTLIER 'Trans proline' 0 C--N 1.387 2.563 0 C-N-CA 122.926 2.417 . . . . 72.319999999999993 112.295 172.732 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 39.0 tt0 -82.33 -29.98 30.72 Favored 'General case' 0 N--CA 1.479 0.983 0 C-N-CA 123.933 0.893 . . . . 73.519999999999996 112.326 -174.441 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 35.2 t . . . . . 0 N--CA 1.493 1.682 0 C-N-CA 123.104 0.562 . . . . 71.319999999999993 112.031 -176.283 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 1' ' ' PHE . . . . . . . . . . . . . 87.8 m-85 . . . . . 0 N--CA 1.485 1.301 0 N-CA-C 111.46 0.17 . . . . 74.140000000000001 111.46 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 2' ' ' THR . . . . . 0.518 HG23 ' H ' ' A' ' 5' ' ' GLU . 6.7 t -128.93 150.51 50.34 Favored 'General case' 0 N--CA 1.487 1.417 0 C-N-CA 122.72 0.408 . . . . 73.209999999999994 111.745 -175.458 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 3' ' ' LEU . . . . . 0.532 HD13 HD12 ' A' ' 6' ' ' LEU . 3.4 mm? -63.22 -24.2 67.77 Favored 'General case' 0 N--CA 1.483 1.212 0 CA-C-N 115.538 -0.756 . . . . 61.100000000000001 110.63 174.317 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 41.3 mm -59.24 -49.69 82.54 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.297 0 C-N-CA 123.725 0.81 . . . . 54.219999999999999 111.22 179.301 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 5' ' ' GLU . . . . . 0.518 ' H ' HG23 ' A' ' 2' ' ' THR . 43.8 mm-40 -65.5 -35.55 81.2 Favored 'General case' 0 N--CA 1.479 1.02 0 CA-C-N 116.079 -0.509 . . . . 71.409999999999997 111.854 177.639 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 6' ' ' LEU . . . . . 0.532 HD12 HD13 ' A' ' 3' ' ' LEU . 82.4 mt -64.31 -38.63 91.72 Favored 'General case' 0 N--CA 1.483 1.206 0 C-N-CA 122.617 0.367 . . . . 63.039999999999999 111.571 176.258 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 7' ' ' LEU . . . . . 0.434 ' HG ' ' O ' ' A' ' 3' ' ' LEU . 91.8 mt -60.77 -44.24 97.02 Favored 'General case' 0 N--CA 1.485 1.28 0 C-N-CA 123.327 0.651 . . . . 74.049999999999997 111.213 174.321 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 96.7 mt -68.66 -53.22 28.67 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.78 0 C-N-CA 124.087 0.955 . . . . 63.229999999999997 112.565 -179.163 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 71.0 t -57.63 -43.45 83.5 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.027 0 C-N-CA 123.705 0.802 . . . . 74.439999999999998 112.005 -177.209 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 72.9 t -68.42 -33.77 62.06 Favored 'Isoleucine or valine' 0 CA--C 1.559 1.32 0 C-N-CA 122.627 0.371 . . . . 74.430000000000007 111.952 176.919 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -73.46 -49.72 25.38 Favored 'General case' 0 N--CA 1.485 1.283 0 CA-C-N 118.091 0.405 . . . . 74.109999999999999 111.841 -179.52 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 12' ' ' ILE . . . . . 0.432 ' O ' ' HG ' ' A' ' 16' ' ' LEU . 25.8 pt -64.93 -43.11 96.28 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.151 0 C-N-CA 123.744 0.818 . . . . 74.209999999999994 112.064 -175.488 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 78.8 mt -73.38 -30.1 29.47 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.882 0 C-N-CA 123.881 0.873 . . . . 54.229999999999997 109.893 176.305 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -62.01 -36.24 92.59 Favored Glycine 0 C--N 1.355 1.624 0 CA-C-N 115.604 -0.725 . . . . 71.409999999999997 113.046 174.858 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 15' ' ' ILE . . . . . 0.425 HD12 ' HA ' ' A' ' 12' ' ' ILE . 21.5 mt -69.51 -47.21 73.37 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.892 0 C-N-CA 123.407 0.683 . . . . 64.310000000000002 110.549 173.544 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.432 ' HG ' ' O ' ' A' ' 12' ' ' ILE . 14.6 mt -59.94 -35.73 75.54 Favored 'General case' 0 N--CA 1.484 1.241 0 O-C-N 123.562 0.539 . . . . 72.319999999999993 112.172 -176.073 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -72.2 -52.16 17.79 Favored 'General case' 0 N--CA 1.478 0.939 0 CA-C-O 121.289 0.566 . . . . 63.240000000000002 110.662 174.87 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -64.51 -19.55 65.66 Favored 'General case' 0 N--CA 1.479 1.005 0 N-CA-C 114.175 1.176 . . . . 72.319999999999993 114.175 -176.837 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 2.7 pp -94.57 -43.33 13.09 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.178 0 CA-C-N 118.458 0.572 . . . . 65.209999999999994 111.441 173.441 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -72.39 -46.9 53.17 Favored 'General case' 0 N--CA 1.491 1.577 0 N-CA-C 112.542 0.571 . . . . 44.509999999999998 112.542 -170.483 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 23.4 mt -59.35 -54.41 56.43 Favored Pre-proline 0 CA--C 1.561 1.379 0 CA-C-O 118.091 -0.957 . . . . 73.430000000000007 113.063 -177.988 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 39.2 Cg_endo -65.43 -37.87 28.39 Favored 'Trans proline' 0 C--N 1.38 2.221 0 C-N-CA 121.821 1.681 . . . . 74.340000000000003 112.773 176.554 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 27.4 tt0 -66.07 -35.63 81.03 Favored 'General case' 0 N--CA 1.485 1.284 0 C-N-CA 123.349 0.66 . . . . 74.310000000000002 110.291 -178.124 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 24' ' ' PHE . . . . . . . . . . . . . 66.8 t80 -87.37 -38.03 16.55 Favored 'General case' 0 N--CA 1.489 1.49 0 CA-C-N 115.563 -0.744 . . . . 74.310000000000002 111.082 -176.959 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 25' ' ' SER . . . . . 0.404 ' O ' HG23 ' A' ' 29' ' ' VAL . 74.7 m -56.15 -49.21 74.61 Favored 'General case' 0 N--CA 1.488 1.453 0 C-N-CA 122.358 0.263 . . . . 74.209999999999994 110.721 171.008 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -67.3 -30.76 70.7 Favored 'General case' 0 N--CA 1.483 1.216 0 C-N-CA 123.264 0.626 . . . . 54.420000000000002 112.19 175.932 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 61.2 t80 -68.38 -53.36 24.41 Favored 'General case' 0 N--CA 1.479 1.007 0 C-N-CA 123.16 0.584 . . . . 71.400000000000006 110.906 -179.044 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 1.8 ptm180 -69.59 -18.24 63.6 Favored 'General case' 0 N--CA 1.475 0.815 0 C-N-CA 123.317 0.647 . . . . 73.420000000000002 111.443 -175.415 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 29' ' ' VAL . . . . . 0.404 HG23 ' O ' ' A' ' 25' ' ' SER . 52.9 t -76.5 -51.43 19.51 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.183 0 CA-C-O 120.906 0.384 . . . . 75.030000000000001 110.45 171.436 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 21.2 ptmt -73.41 -18.7 61.12 Favored 'General case' 0 N--CA 1.482 1.154 0 CA-C-N 115.819 -0.628 . . . . 64.439999999999998 111.882 -178.572 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -87.15 -33.2 19.49 Favored 'General case' 0 N--CA 1.486 1.375 0 C-N-CA 123.459 0.704 . . . . 72.439999999999998 109.822 179.09 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 69.8 t80 -69.77 -22.32 63.36 Favored 'General case' 0 N--CA 1.483 1.211 0 CA-C-N 115.566 -0.743 . . . . 71.120000000000005 109.967 171.58 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 7.6 t30 -84.33 -51.23 7.14 Favored 'General case' 0 N--CA 1.475 0.785 0 C-N-CA 124.221 1.008 . . . . 61.420000000000002 111.218 173.106 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 46.5 t -67.67 -54.95 15.4 Favored 'General case' 0 N--CA 1.492 1.631 0 C-N-CA 123.247 0.619 . . . . 64.400000000000006 112.181 -172.427 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -61.41 -39.25 90.06 Favored 'General case' 0 N--CA 1.474 0.762 0 CA-C-N 115.981 -0.554 . . . . 72.120000000000005 111.296 178.572 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -70.36 -43.3 70.46 Favored 'General case' 0 N--CA 1.483 1.176 0 O-C-N 123.359 0.412 . . . . 75.439999999999998 111.808 -178.424 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 40.2 t -59.11 -43.91 91.94 Favored 'General case' 0 N--CA 1.491 1.6 0 C-N-CA 123.53 0.732 . . . . 74.349999999999994 111.514 178.249 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 44.6 t -79.08 -27.54 43.03 Favored 'General case' 0 N--CA 1.475 0.823 0 CA-C-N 115.411 -0.813 . . . . 72.25 112.059 -179.211 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 26.6 t70 -66.6 -47.17 73.55 Favored 'General case' 0 N--CA 1.481 1.083 0 C-N-CA 122.82 0.448 . . . . 75.450000000000003 110.809 172.414 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 97.2 mt -71.82 -31.73 66.85 Favored 'General case' 0 N--CA 1.481 1.091 0 C-N-CA 123.423 0.689 . . . . 71.209999999999994 110.829 -177.288 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 50.4 ttp180 -74.08 -31.99 63.07 Favored 'General case' 0 CA--C 1.548 0.882 0 CA-C-N 115.842 -0.617 . . . . 73.420000000000002 110.3 173.347 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 42' ' ' ASN . . . . . 0.468 ' HA ' HG22 ' A' ' 45' ' ' THR . 18.0 t-20 -68.63 -31.38 70.48 Favored 'General case' 0 N--CA 1.485 1.285 0 C-N-CA 122.802 0.441 . . . . 70.329999999999998 111.14 173.916 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 96.3 mt -66.67 -37.33 84.54 Favored 'General case' 0 N--CA 1.486 1.358 0 C-N-CA 123.022 0.529 . . . . 75.25 110.391 172.719 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 17.8 tppt? -72.61 -47.66 46.06 Favored 'General case' 0 N--CA 1.473 0.677 0 C-N-CA 123.682 0.793 . . . . 61.009999999999998 110.258 -176.761 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 45' ' ' THR . . . . . 0.468 HG22 ' HA ' ' A' ' 42' ' ' ASN . 2.9 t -68.3 -31.16 70.39 Favored 'General case' 0 N--CA 1.485 1.285 0 C-N-CA 123.872 0.869 . . . . 63.299999999999997 111.489 -177.52 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -65.51 -52.43 52.76 Favored 'General case' 0 N--CA 1.473 0.687 0 CA-C-N 115.18 -0.918 . . . . 74.310000000000002 110.569 173.929 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 91.7 mt -66.36 -27.75 68.12 Favored 'General case' 0 N--CA 1.485 1.301 0 C-N-CA 123.643 0.777 . . . . 70.200000000000003 112.494 176.535 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 13.1 tp10 -71.78 -53.36 13.63 Favored 'General case' 0 C--N 1.349 0.571 0 C-N-CA 124.304 1.042 . . . . 72.319999999999993 111.108 -179.577 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 46.8 t -67.46 -34.76 77.83 Favored 'General case' 0 N--CA 1.48 1.075 0 CA-C-N 115.542 -0.754 . . . . 74.150000000000006 111.569 178.897 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -65.94 -52.14 52.39 Favored 'General case' 0 N--CA 1.482 1.126 0 C-N-CA 123.347 0.659 . . . . 63.200000000000003 111.555 177.263 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 51' ' ' PHE . . . . . . . . . . . . . 73.9 t80 -72.1 -22.12 61.39 Favored 'General case' 0 N--CA 1.492 1.635 0 C-N-CA 123.334 0.654 . . . . 72.209999999999994 111.231 -178.923 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -65.58 -43.34 90.07 Favored 'General case' 0 N--CA 1.487 1.387 0 C-N-CA 122.928 0.491 . . . . 70.329999999999998 110.709 170.654 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 34.6 t70 -73.85 -27.31 61.02 Favored 'General case' 0 CA--C 1.564 1.503 0 C-N-CA 123.799 0.84 . . . . 75.340000000000003 110.701 171.984 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 35.9 t70 67.51 123.38 0.02 OUTLIER 'General case' 0 N--CA 1.484 1.245 0 C-N-CA 126.81 2.044 . . . . 72.200000000000003 114.817 177.689 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 17.9 mp0 -132.46 17.14 4.41 Favored 'General case' 0 N--CA 1.483 1.205 0 C-N-CA 124.409 1.084 . . . . 74.540000000000006 109.599 170.047 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 85.7 m -96.36 -54.06 3.4 Favored 'General case' 0 N--CA 1.489 1.479 0 C-N-CA 123.907 0.883 . . . . 54.399999999999999 110.563 -179.708 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 48.3 m-85 -85.93 149.46 50.67 Favored Pre-proline 0 N--CA 1.489 1.519 0 C-N-CA 123.412 0.685 . . . . 73.340000000000003 110.11 179.994 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 58' ' ' PRO . . . . . 0.445 ' HA ' ' HD3' ' A' ' 59' ' ' PRO . 82.3 Cg_exo -50.75 132.94 38.12 Favored 'Trans proline' 0 C--N 1.382 2.315 0 C-N-CA 122.937 2.425 . . . . 70.200000000000003 113.145 173.548 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 59' ' ' PRO . . . . . 0.445 ' HD3' ' HA ' ' A' ' 58' ' ' PRO . 26.9 Cg_exo -61.71 106.59 0.44 Allowed 'Trans proline' 0 C--N 1.381 2.248 0 C-N-CA 122.799 2.333 . . . . 73.439999999999998 112.801 -173.987 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 45.2 tt0 -60.14 -37.32 79.73 Favored 'General case' 0 CA--C 1.555 1.171 0 C-N-CA 123.059 0.544 . . . . 74.420000000000002 111.623 -179.401 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 73.1 p . . . . . 0 N--CA 1.487 1.41 0 C-N-CA 123.204 0.602 . . . . 64.129999999999995 110.544 173.636 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 1' ' ' PHE . . . . . . . . . . . . . 43.6 p90 . . . . . 0 N--CA 1.491 1.619 0 CA-C-O 120.719 0.295 . . . . 75.25 111.719 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 2' ' ' THR . . . . . 0.663 ' HB ' ' HG2' ' A' ' 5' ' ' GLU . 25.8 m -90.28 136.94 32.74 Favored 'General case' 0 N--CA 1.479 0.979 0 C-N-CA 123.666 0.786 . . . . 60.32 109.908 174.374 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 7.7 tt -57.15 -33.31 67.27 Favored 'General case' 0 N--CA 1.488 1.473 0 C-N-CA 123.53 0.732 . . . . 64.230000000000004 110.745 176.594 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 4' ' ' ILE . . . . . 0.57 ' H ' HG22 ' A' ' 2' ' ' THR . 48.7 mm -65.95 -37.34 79.61 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.251 0 C-N-CA 123.093 0.557 . . . . 73.329999999999998 111.461 -178.223 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 5' ' ' GLU . . . . . 0.663 ' HG2' ' HB ' ' A' ' 2' ' ' THR . 11.2 mm-40 -56.68 -45.55 81.67 Favored 'General case' 0 N--CA 1.491 1.577 0 C-N-CA 123.296 0.639 . . . . 70.510000000000005 110.726 173.586 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 53.8 mt -65.43 -42.6 92.27 Favored 'General case' 0 N--CA 1.479 1.004 0 C-N-CA 123.625 0.77 . . . . 64.030000000000001 111.385 177.887 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -56.73 -48.91 76.7 Favored 'General case' 0 CA--C 1.552 1.041 0 C-N-CA 124.364 1.066 . . . . 73.310000000000002 110.294 178.089 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 95.2 mt -65.88 -43.77 92.92 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.791 0 C-N-CA 124.254 1.022 . . . . 63.32 112.143 -179.249 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 49.6 t -62.91 -45.45 98.84 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.061 0 C-N-CA 122.868 0.467 . . . . 73.040000000000006 111.396 178.383 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 71.6 t -66.58 -32.8 59.66 Favored 'Isoleucine or valine' 0 CA--C 1.562 1.431 0 C-N-CA 122.7 0.4 . . . . 73.099999999999994 111.016 175.36 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -67.23 -55.63 13.22 Favored 'General case' 0 CA--C 1.552 1.031 0 C-N-CA 123.065 0.546 . . . . 53.340000000000003 111.584 179.219 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 12' ' ' ILE . . . . . 0.477 ' O ' ' HG ' ' A' ' 16' ' ' LEU . 23.7 pt -61.28 -46.03 97.43 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.125 0 C-N-CA 123.461 0.705 . . . . 72.439999999999998 111.45 -176.869 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 77.1 mt -65.76 -32.16 56.95 Favored 'Isoleucine or valine' 0 CA--C 1.551 1.002 0 C-N-CA 124.138 0.975 . . . . 64.530000000000001 110.598 176.853 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -60.35 -39.69 96.49 Favored Glycine 0 C--N 1.349 1.293 0 CA-C-N 115.685 -0.689 . . . . 72.319999999999993 112.882 172.911 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 1.8 mp -72.99 -40.32 58.98 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.06 0 N-CA-C 109.757 -0.46 . . . . 73.540000000000006 109.757 176.869 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.477 ' HG ' ' O ' ' A' ' 12' ' ' ILE . 28.2 mt -58.83 -40.28 83.72 Favored 'General case' 0 N--CA 1.491 1.59 0 C-N-CA 123.113 0.565 . . . . 55.439999999999998 111.681 179.973 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -74.32 -45.77 45.19 Favored 'General case' 0 N--CA 1.479 1.009 0 C-N-CA 123.287 0.635 . . . . 72.230000000000004 110.864 176.833 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -59.18 -32.39 69.87 Favored 'General case' 0 N--CA 1.482 1.171 0 C-N-CA 123.99 0.916 . . . . 72.25 113.275 -178.871 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 2.8 pp -86.01 -37.71 12.02 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.153 0 C-N-CA 122.327 0.251 . . . . 75.400000000000006 111.324 175.628 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -63.44 -55.18 26.31 Favored 'General case' 0 N--CA 1.486 1.342 0 C-N-CA 123.792 0.837 . . . . 72.140000000000001 112.954 -174.799 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 21.5 mt -54.09 -54.51 46.6 Favored Pre-proline 0 CA--C 1.563 1.444 0 N-CA-C 113.66 0.985 . . . . 64.340000000000003 113.66 -174.956 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 37.7 Cg_endo -66.08 -40.42 15.87 Favored 'Trans proline' 0 C--N 1.378 2.103 0 CA-C-N 121.619 1.614 . . . . 72.5 112.894 176.107 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 23' ' ' GLN . . . . . 0.414 ' O ' ' HB2' ' A' ' 27' ' ' TYR . 43.3 tt0 -59.58 -41.75 90.94 Favored 'General case' 0 N--CA 1.485 1.314 0 C-N-CA 123.565 0.746 . . . . 65.329999999999998 110.829 -177.566 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 24' ' ' PHE . . . . . . . . . . . . . 19.1 m-85 -92.59 -33.9 14.24 Favored 'General case' 0 N--CA 1.484 1.234 0 CA-C-N 114.65 -1.159 . . . . 61.109999999999999 112.005 -172.068 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 25' ' ' SER . . . . . 0.429 ' O ' HG23 ' A' ' 29' ' ' VAL . 43.3 t -61.82 -53.34 57.26 Favored 'General case' 0 N--CA 1.49 1.545 0 N-CA-C 110.284 -0.265 . . . . 62.420000000000002 110.284 170.764 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -63.58 -27.38 69.21 Favored 'General case' 0 N--CA 1.48 1.037 0 C-N-CA 123.384 0.673 . . . . 73.439999999999998 112.333 176.308 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 27' ' ' TYR . . . . . 0.414 ' HB2' ' O ' ' A' ' 23' ' ' GLN . 66.6 t80 -66.22 -48.48 70.44 Favored 'General case' 0 N--CA 1.482 1.171 0 C-N-CA 122.975 0.51 . . . . 61.210000000000001 111.386 176.904 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 13.7 mmt180 -67.65 -29.72 69.1 Favored 'General case' 0 N--CA 1.476 0.853 0 O-C-N 124.067 0.854 . . . . 73.329999999999998 111.548 -179.212 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 29' ' ' VAL . . . . . 0.429 HG23 ' O ' ' A' ' 25' ' ' SER . 87.8 t -72.7 -48.69 44.95 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.382 0 N-CA-C 109.359 -0.608 . . . . 60.350000000000001 109.359 176.486 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 8.1 tttp -55.14 -40.41 70.53 Favored 'General case' 0 CA--C 1.549 0.931 0 C-N-CA 124.722 1.209 . . . . 74.510000000000005 111.213 172.986 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -73.83 -45.22 52.59 Favored 'General case' 0 N--CA 1.476 0.845 0 C-N-CA 122.918 0.487 . . . . 72.040000000000006 110.78 -174.045 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 53.7 t80 -64.18 -37.44 87.48 Favored 'General case' 0 CA--C 1.544 0.737 0 O-C-N 123.829 0.706 . . . . 72.109999999999999 110.676 179.636 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 93.1 m-20 -72.99 -41.68 64.06 Favored 'General case' 0 N--CA 1.485 1.287 0 C-N-CA 123.774 0.83 . . . . 71.319999999999993 112.192 178.905 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 64.7 m -68.85 -49.81 55.18 Favored 'General case' 0 N--CA 1.496 1.843 0 C-N-CA 123.184 0.594 . . . . 75.120000000000005 110.935 -179.28 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -62.61 -40.11 95.92 Favored 'General case' 0 N--CA 1.476 0.842 0 CA-C-N 115.564 -0.744 . . . . 52.329999999999998 111.333 176.345 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -61.89 -46.33 89.87 Favored 'General case' 0 N--CA 1.496 1.832 0 O-C-N 123.465 0.478 . . . . 71.519999999999996 112.219 174.793 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 67.8 m -60.34 -43.44 96.45 Favored 'General case' 0 N--CA 1.494 1.727 0 C-N-CA 123.563 0.745 . . . . 73.239999999999995 111.329 179.206 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 37.6 m -73.36 -33.72 65.23 Favored 'General case' 0 N--CA 1.476 0.834 0 CA-C-N 115.362 -0.835 . . . . 73.430000000000007 111.607 179.248 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 29.5 t70 -60.49 -52.93 63.09 Favored 'General case' 0 N--CA 1.48 1.029 0 C-N-CA 123.52 0.728 . . . . 72.019999999999996 111.338 175.872 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 4.2 pp -71.22 -31.51 67.67 Favored 'General case' 0 N--CA 1.486 1.347 0 CA-C-N 116.194 -0.457 . . . . 65.439999999999998 111.143 -172.063 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 36.2 ttm180 -80.67 -40.74 24.94 Favored 'General case' 0 CA--C 1.548 0.891 0 C-N-CA 123.131 0.572 . . . . 64.420000000000002 110.92 -179.275 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 42' ' ' ASN . . . . . 0.476 ' HA ' HG22 ' A' ' 45' ' ' THR . 19.9 t-20 -68.04 -38.07 82.09 Favored 'General case' 0 N--CA 1.489 1.501 0 N-CA-C 112.183 0.438 . . . . 71.010000000000005 112.183 -178.738 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 86.9 mt -69.99 -29.07 66.07 Favored 'General case' 0 N--CA 1.484 1.23 0 C-N-CA 122.48 0.312 . . . . 54.219999999999999 111.369 179.005 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 44' ' ' LYS . . . . . 0.429 ' O ' ' HG2' ' A' ' 48' ' ' GLU . 86.4 tttt -78.15 -45.08 24.2 Favored 'General case' 0 CA--C 1.542 0.655 0 CA-C-N 115.906 -0.588 . . . . 72.319999999999993 110.423 176.394 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 45' ' ' THR . . . . . 0.476 HG22 ' HA ' ' A' ' 42' ' ' ASN . 1.5 t -68.23 -30.11 69.1 Favored 'General case' 0 N--CA 1.487 1.399 0 C-N-CA 123.374 0.669 . . . . 42.130000000000003 110.832 -176.65 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -58.27 -43.91 88.15 Favored 'General case' 0 N--CA 1.474 0.762 0 CA-C-N 115.02 -0.991 . . . . 63.140000000000001 110.582 169.5 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -68.09 -39.67 82.81 Favored 'General case' 0 CA--C 1.567 1.606 0 C-N-CA 123.608 0.763 . . . . 71.409999999999997 110.832 175.016 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 48' ' ' GLU . . . . . 0.429 ' HG2' ' O ' ' A' ' 44' ' ' LYS . 25.0 mm-40 -65.49 -33.74 76.64 Favored 'General case' 0 N--CA 1.487 1.404 0 C-N-CA 123.498 0.719 . . . . 74.510000000000005 111.662 -178.309 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 43.3 t -84.15 -55.81 4.0 Favored 'General case' 0 N--CA 1.478 0.94 0 C-N-CA 122.803 0.441 . . . . 71.430000000000007 111.952 176.408 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -60.5 -53.21 60.26 Favored 'General case' 0 N--CA 1.479 1.017 0 C-N-CA 123.414 0.686 . . . . 24.219999999999999 112.408 -175.457 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 51' ' ' PHE . . . . . . . . . . . . . 80.1 t80 -94.31 -40.19 10.1 Favored 'General case' 0 N--CA 1.481 1.09 0 CA-C-O 120.665 0.269 . . . . 72.230000000000004 111.607 -173.72 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -98.51 1.78 46.96 Favored 'General case' 0 N--CA 1.489 1.478 0 N-CA-C 114.038 1.125 . . . . 52.420000000000002 114.038 -168.868 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 30.5 t70 -125.8 -46.36 1.71 Allowed 'General case' 0 N--CA 1.485 1.294 0 CA-C-N 117.968 0.349 . . . . 73.340000000000003 110.776 177.088 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 24.2 t70 -165.64 110.65 0.87 Allowed 'General case' 0 N--CA 1.492 1.628 0 C-N-CA 122.924 0.49 . . . . 73.25 111.87 179.686 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 9.5 tp-100 -112.37 13.45 20.29 Favored 'General case' 0 N--CA 1.493 1.678 0 C-N-CA 123.705 0.802 . . . . 62.509999999999998 111.318 176.586 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 62.7 p -63.24 -51.61 65.53 Favored 'General case' 0 N--CA 1.496 1.853 0 O-C-N 121.711 -0.618 . . . . 73.439999999999998 110.902 179.179 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 76.8 m-85 -92.97 137.06 23.99 Favored Pre-proline 0 CA--C 1.548 0.878 0 CA-C-N 115.714 -0.675 . . . . 74.040000000000006 109.504 171.157 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 58' ' ' PRO . . . . . 0.408 ' HA ' ' HD3' ' A' ' 59' ' ' PRO . 69.8 Cg_endo -71.41 136.69 29.27 Favored 'Trans proline' 0 CA--C 1.564 2.022 0 C-N-CA 122.291 1.994 . . . . 73.140000000000001 112.169 -178.876 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 59' ' ' PRO . . . . . 0.408 ' HD3' ' HA ' ' A' ' 58' ' ' PRO . 5.4 Cg_exo -74.58 -154.83 0.04 OUTLIER 'Trans proline' 0 C--N 1.375 1.942 0 C-N-CA 123.403 2.736 . . . . 74.430000000000007 112.712 179.29 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 3.3 mp0 -70.16 -10.62 59.38 Favored 'General case' 0 CA--C 1.564 1.497 0 C-N-CA 123.19 0.596 . . . . 64.099999999999994 111.484 174.106 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 36.0 m . . . . . 0 CA--C 1.569 1.681 0 C-N-CA 125.637 1.575 . . . . 64.319999999999993 113.441 -179.062 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 1' ' ' PHE . . . . . . . . . . . . . 16.7 p90 . . . . . 0 N--CA 1.493 1.713 0 N-CA-C 112.918 0.711 . . . . 73.409999999999997 112.918 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 2' ' ' THR . . . . . 0.714 HG22 ' H ' ' A' ' 4' ' ' ILE . 19.7 m -86.3 134.02 33.77 Favored 'General case' 0 N--CA 1.484 1.275 0 C-N-CA 122.933 0.493 . . . . 54.530000000000001 111.455 -176.775 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 3' ' ' LEU . . . . . 0.411 ' O ' ' HG ' ' A' ' 7' ' ' LEU . 2.5 pt? -57.41 -27.87 62.76 Favored 'General case' 0 N--CA 1.484 1.225 0 C-N-CA 123.603 0.761 . . . . 70.400000000000006 112.449 175.218 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 4' ' ' ILE . . . . . 0.714 ' H ' HG22 ' A' ' 2' ' ' THR . 51.8 mm -84.42 -44.94 17.97 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.109 0 C-N-CA 123.37 0.668 . . . . 75.430000000000007 110.996 -176.708 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 5' ' ' GLU . . . . . 0.456 ' O ' HG23 ' A' ' 9' ' ' VAL . 22.4 mm-40 -58.69 -39.66 81.38 Favored 'General case' 0 N--CA 1.481 1.093 0 O-C-N 123.432 0.457 . . . . 72.200000000000003 111.357 176.126 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 2.4 pp -69.34 -31.61 70.16 Favored 'General case' 0 N--CA 1.484 1.226 0 C-N-CA 122.351 0.26 . . . . 65.310000000000002 111.33 178.923 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 7' ' ' LEU . . . . . 0.411 ' HG ' ' O ' ' A' ' 3' ' ' LEU . 90.5 mt -64.15 -37.34 87.12 Favored 'General case' 0 N--CA 1.484 1.241 0 C-N-CA 122.464 0.305 . . . . 64.209999999999994 111.579 172.035 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 84.0 mt -68.7 -43.48 83.04 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.078 0 C-N-CA 123.252 0.621 . . . . 73.450000000000003 111.645 175.446 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 9' ' ' VAL . . . . . 0.456 HG23 ' O ' ' A' ' 5' ' ' GLU . 95.9 t -59.53 -48.34 87.64 Favored 'Isoleucine or valine' 0 CA--C 1.556 1.196 0 C-N-CA 123.657 0.783 . . . . 74.019999999999996 111.928 175.323 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 10' ' ' VAL . . . . . 0.405 HG12 ' HA ' ' A' ' 7' ' ' LEU . 5.5 p -69.77 -25.13 27.71 Favored 'Isoleucine or valine' 0 CA--C 1.557 1.215 0 C-N-CA 122.77 0.428 . . . . 75.030000000000001 111.374 179.281 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -68.66 -55.61 10.88 Favored 'General case' 0 C--N 1.36 1.038 0 C-N-CA 122.766 0.426 . . . . 63.200000000000003 111.366 175.196 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 12' ' ' ILE . . . . . 0.557 ' HA ' HD12 ' A' ' 15' ' ' ILE . 23.1 pt -65.15 -45.46 93.97 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.966 0 C-N-CA 123.3 0.64 . . . . 72.219999999999999 111.819 -177.703 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 72.5 mt -68.15 -28.84 42.43 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.918 0 C-N-CA 123.562 0.745 . . . . 51.039999999999999 110.479 174.712 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -61.71 -38.75 96.42 Favored Glycine 0 C--N 1.346 1.109 0 CA-C-N 116.046 -0.525 . . . . 62.549999999999997 112.822 173.057 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 15' ' ' ILE . . . . . 0.557 HD12 ' HA ' ' A' ' 12' ' ' ILE . 14.4 mt -70.71 -44.32 76.55 Favored 'Isoleucine or valine' 0 C--N 1.352 0.682 0 C-N-CA 123.064 0.545 . . . . 62.5 109.929 175.387 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.485 ' HG ' ' O ' ' A' ' 12' ' ' ILE . 22.0 mt -58.57 -40.42 83.05 Favored 'General case' 0 N--CA 1.482 1.165 0 O-C-N 123.791 0.682 . . . . 65.319999999999993 111.501 179.669 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -72.01 -51.92 19.5 Favored 'General case' 0 N--CA 1.476 0.843 0 C-N-CA 123.053 0.541 . . . . 71.209999999999994 110.754 179.171 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -55.09 -30.79 60.43 Favored 'General case' 0 N--CA 1.482 1.152 0 C-N-CA 123.981 0.913 . . . . 72.230000000000004 112.879 -179.132 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 2.7 pp -88.26 -34.51 7.19 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.256 0 N-CA-C 112.551 0.575 . . . . 71.129999999999995 112.551 174.529 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -65.79 -52.32 51.78 Favored 'General case' 0 N--CA 1.484 1.251 0 C-N-CA 123.074 0.55 . . . . 41.439999999999998 112.264 -173.268 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 2.1 mp -54.61 -54.12 52.52 Favored Pre-proline 0 CA--C 1.574 1.894 0 N-CA-C 112.851 0.686 . . . . 63.119999999999997 112.851 -174.733 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 36.7 Cg_endo -65.13 -42.25 14.35 Favored 'Trans proline' 0 C--N 1.38 2.221 0 CA-C-N 121.065 1.416 . . . . 74.239999999999995 113.115 175.113 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 28.8 tt0 -62.76 -34.41 77.16 Favored 'General case' 0 N--CA 1.486 1.357 0 C-N-CA 123.358 0.663 . . . . 74.140000000000001 111.001 -177.859 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 24' ' ' PHE . . . . . . . . . . . . . 84.3 t80 -84.42 -42.06 16.04 Favored 'General case' 0 N--CA 1.484 1.229 0 C-N-CA 123.912 0.885 . . . . 51.149999999999999 110.49 -174.137 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 26.4 t -67.16 -28.34 68.04 Favored 'General case' 0 N--CA 1.479 1.004 0 CA-C-N 116.402 -0.363 . . . . 71.349999999999994 110.582 175.253 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -79.94 -29.81 39.79 Favored 'General case' 0 C--O 1.214 -0.808 0 C-N-CA 123.109 0.564 . . . . 55.539999999999999 111.717 172.737 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 78.7 t80 -71.97 -45.8 59.72 Favored 'General case' 0 N--CA 1.487 1.408 0 C-N-CA 123.89 0.876 . . . . 72.340000000000003 111.722 -175.539 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 39.3 ptt180 -68.23 -29.32 68.12 Favored 'General case' 0 N--CA 1.477 0.92 0 CA-C-N 115.181 -0.918 . . . . 52.219999999999999 111.309 179.74 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 79.3 t -83.3 -34.89 11.38 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.375 0 CA-C-N 115.699 -0.682 . . . . 73.109999999999999 110.136 178.896 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 10.8 tttp -61.25 -42.87 99.37 Favored 'General case' 0 C--O 1.214 -0.769 0 C-N-CA 124.061 0.944 . . . . 51.229999999999997 109.783 168.69 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -71.04 -42.46 69.46 Favored 'General case' 0 N--CA 1.476 0.842 0 N-CA-C 109.935 -0.395 . . . . 74.349999999999994 109.935 -176.686 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 74.9 t80 -62.53 -62.48 1.71 Allowed 'General case' 0 C--O 1.215 -0.715 0 CA-C-N 115.57 -0.741 . . . . 72.430000000000007 110.977 178.828 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 85.4 m-20 -66.95 -44.46 80.51 Favored 'General case' 0 N--CA 1.485 1.275 0 N-CA-C 113.664 0.987 . . . . 73.239999999999995 113.664 -174.535 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 47.0 t -68.01 -52.85 30.9 Favored 'General case' 0 N--CA 1.497 1.918 0 CA-C-N 117.636 0.198 . . . . 75.329999999999998 111.09 -176.321 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -62.8 -41.36 99.25 Favored 'General case' 0 C--O 1.212 -0.882 0 O-C-N 123.446 0.466 . . . . 41.0 111.27 177.765 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -59.82 -50.44 73.78 Favored 'General case' 0 N--CA 1.498 1.937 0 N-CA-C 112.24 0.459 . . . . 52.140000000000001 112.24 178.379 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 66.8 m -63.81 -37.55 87.8 Favored 'General case' 0 N--CA 1.486 1.356 0 C-N-CA 123.331 0.652 . . . . 73.120000000000005 111.891 -179.277 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 79.9 p -80.97 -25.52 37.26 Favored 'General case' 0 N--CA 1.482 1.135 0 C-N-CA 122.844 0.458 . . . . 72.140000000000001 111.997 -178.626 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 39' ' ' ASP . . . . . 0.438 ' O ' ' HG ' ' A' ' 43' ' ' LEU . 94.6 m-20 -65.69 -52.65 49.75 Favored 'General case' 0 C--O 1.211 -0.958 0 N-CA-C 109.336 -0.616 . . . . 72.340000000000003 109.336 167.254 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 98.5 mt -64.37 -29.83 70.89 Favored 'General case' 0 N--CA 1.481 1.11 0 C-N-CA 123.483 0.713 . . . . 75.319999999999993 111.63 -176.516 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 47.4 ttp180 -75.29 -43.21 52.34 Favored 'General case' 0 CA--C 1.546 0.809 0 C-N-CA 123.536 0.734 . . . . 73.400000000000006 110.663 175.213 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 62.4 t30 -69.68 -34.49 74.03 Favored 'General case' 0 N--CA 1.488 1.471 0 C-N-CA 123.467 0.707 . . . . 54.530000000000001 112.221 -179.78 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 43' ' ' LEU . . . . . 0.438 ' HG ' ' O ' ' A' ' 39' ' ' ASP . 89.8 mt -77.21 -32.01 55.61 Favored 'General case' 0 N--CA 1.478 0.949 0 C-N-CA 123.007 0.523 . . . . 75.219999999999999 110.12 179.37 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 44' ' ' LYS . . . . . 0.415 ' O ' ' HG2' ' A' ' 48' ' ' GLU . 38.8 ttpt -77.55 -36.87 51.82 Favored 'General case' 0 N--CA 1.477 0.885 0 C-N-CA 122.913 0.485 . . . . 53.200000000000003 110.602 179.091 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 1.7 t -70.57 -30.93 67.77 Favored 'General case' 0 N--CA 1.485 1.298 0 CA-C-O 121.369 0.604 . . . . 74.310000000000002 110.753 179.438 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -66.42 -43.86 84.55 Favored 'General case' 0 N--CA 1.479 1.003 0 CA-C-N 114.86 -1.064 . . . . 64.540000000000006 111.101 168.915 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 36.5 tp -63.71 -34.52 78.07 Favored 'General case' 0 CA--C 1.554 1.13 0 C-N-CA 123.648 0.779 . . . . 72.129999999999995 111.308 177.132 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 48' ' ' GLU . . . . . 0.415 ' HG2' ' O ' ' A' ' 44' ' ' LYS . 80.9 mm-40 -67.32 -47.84 69.34 Favored 'General case' 0 N--CA 1.474 0.762 0 C-N-CA 123.582 0.753 . . . . 71.049999999999997 110.115 173.356 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 40.5 t -57.63 -44.13 85.33 Favored 'General case' 0 N--CA 1.483 1.215 0 C-N-CA 123.681 0.792 . . . . 60.450000000000003 112.852 -176.435 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -72.41 -52.28 16.66 Favored 'General case' 0 N--CA 1.481 1.091 0 C-N-CA 123.407 0.683 . . . . 50.030000000000001 112.66 178.863 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 51' ' ' PHE . . . . . . . . . . . . . 41.5 t80 -71.91 -33.63 68.44 Favored 'General case' 0 N--CA 1.486 1.357 0 CA-C-N 115.635 -0.712 . . . . 70.129999999999995 111.45 -170.344 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -79.92 -30.13 39.95 Favored 'General case' 0 N--CA 1.482 1.134 0 C-N-CA 123.293 0.637 . . . . 63.329999999999998 111.936 178.939 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 19.6 t70 -55.1 -46.23 75.51 Favored 'General case' 0 N--CA 1.488 1.47 0 C-N-CA 123.339 0.655 . . . . 75.099999999999994 111.658 177.647 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 23.9 t70 -66.21 -51.05 61.45 Favored 'General case' 0 CA--C 1.554 1.126 0 CA-C-O 121.033 0.444 . . . . 54.32 110.87 178.482 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 29.8 pt20 -89.59 20.22 4.12 Favored 'General case' 0 N--CA 1.488 1.45 0 N-CA-C 113.085 0.772 . . . . 72.099999999999994 113.085 -174.571 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 95.1 m -48.1 -42.37 28.81 Favored 'General case' 0 N--CA 1.497 1.916 0 C-N-CA 123.943 0.897 . . . . 75.540000000000006 111.721 177.433 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 36.6 p90 -116.32 129.46 25.22 Favored Pre-proline 0 CA--C 1.558 1.264 0 C-N-CA 123.932 0.893 . . . . 73.319999999999993 110.036 173.504 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 69.3 Cg_exo -58.02 153.65 43.76 Favored 'Trans proline' 0 CA--C 1.564 2.017 0 C-N-CA 122.796 2.33 . . . . 43.210000000000001 112.983 167.043 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 50.8 Cg_exo -57.19 85.94 0.04 OUTLIER 'Trans proline' 0 C--N 1.382 2.324 0 C-N-CA 123.177 2.585 . . . . 74.530000000000001 113.938 175.881 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 25.0 tt0 44.68 69.19 0.45 Allowed 'General case' 0 CA--C 1.559 1.291 0 C-N-CA 126.082 1.753 . . . . 75.120000000000005 113.197 -178.692 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 66.6 m . . . . . 0 N--CA 1.489 1.492 0 C-N-CA 124.009 0.924 . . . . 63.009999999999998 110.048 -178.172 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 1' ' ' PHE . . . . . . . . . . . . . 59.0 m-85 . . . . . 0 N--CA 1.487 1.407 0 N-CA-C 109.929 -0.397 . . . . 74.219999999999999 109.929 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 4.7 t -74.17 154.67 38.98 Favored 'General case' 0 N--CA 1.481 1.078 0 CA-C-N 117.702 0.228 . . . . 70.519999999999996 110.605 170.082 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 9.3 mp -59.95 -18.97 49.4 Favored 'General case' 0 N--CA 1.481 1.1 0 C-N-CA 123.272 0.629 . . . . 70.150000000000006 111.01 176.244 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 50.3 mm -64.07 -49.79 79.91 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.102 0 C-N-CA 123.505 0.722 . . . . 73.540000000000006 110.822 174.962 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 40.8 mm-40 -57.95 -47.71 82.1 Favored 'General case' 0 N--CA 1.49 1.544 0 C-N-CA 123.376 0.67 . . . . 45.509999999999998 111.512 -179.753 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 46.9 mt -68.88 -32.7 72.55 Favored 'General case' 0 CA--C 1.547 0.853 0 CA-C-N 115.576 -0.738 . . . . 71.120000000000005 111.382 -178.108 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 42.3 tp -66.77 -37.15 84.02 Favored 'General case' 0 CA--C 1.549 0.906 0 C-N-CA 123.976 0.911 . . . . 73.200000000000003 111.659 173.855 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 96.2 mt -68.95 -50.11 56.97 Favored 'Isoleucine or valine' 0 C--N 1.35 0.606 0 C-N-CA 123.636 0.775 . . . . 71.439999999999998 111.245 176.946 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 88.3 t -60.07 -43.03 91.85 Favored 'Isoleucine or valine' 0 CA--C 1.554 1.107 0 C-N-CA 123.119 0.568 . . . . 70.049999999999997 111.482 179.345 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 2.7 p -69.24 -31.45 49.87 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.093 0 O-C-N 122.328 -0.233 . . . . 73.319999999999993 111.595 177.482 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -68.24 -57.52 5.85 Favored 'General case' 0 C--N 1.363 1.162 0 C-N-CA 123.141 0.576 . . . . 53.32 111.193 179.308 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 12' ' ' ILE . . . . . 0.507 ' O ' ' HG ' ' A' ' 16' ' ' LEU . 21.9 pt -60.33 -46.99 94.18 Favored 'Isoleucine or valine' 0 CA--C 1.554 1.101 0 C-N-CA 123.776 0.83 . . . . 73.120000000000005 112.055 -177.943 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 1.7 mp -62.03 -35.48 68.72 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.558 0 C-N-CA 123.721 0.808 . . . . 52.25 110.345 174.887 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -62.07 -39.64 97.88 Favored Glycine 0 C--N 1.352 1.418 0 CA-C-N 115.554 -0.748 . . . . 71.310000000000002 113.067 176.241 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 15' ' ' ILE . . . . . 0.486 HD12 ' HA ' ' A' ' 12' ' ' ILE . 21.7 mt -69.59 -40.49 79.59 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.917 0 C-N-CA 123.507 0.723 . . . . 62.340000000000003 111.088 176.686 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.507 ' HG ' ' O ' ' A' ' 12' ' ' ILE . 21.8 mt -57.75 -40.06 78.84 Favored 'General case' 0 N--CA 1.489 1.491 0 C-N-CA 123.207 0.603 . . . . 74.140000000000001 111.192 178.647 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -76.84 -49.18 16.38 Favored 'General case' 0 N--CA 1.48 1.026 0 C-N-CA 123.391 0.676 . . . . 65.010000000000005 111.478 179.067 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -59.43 -26.18 64.96 Favored 'General case' 0 N--CA 1.483 1.2 0 C-N-CA 124.182 0.993 . . . . 71.140000000000001 113.263 -176.485 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 19' ' ' ILE . . . . . 0.417 HD12 ' N ' ' A' ' 20' ' ' ALA . 2.8 pp -87.22 -38.51 12.2 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.382 0 CA-C-N 117.915 0.325 . . . . 74.109999999999999 111.741 170.556 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 20' ' ' ALA . . . . . 0.417 ' N ' HD12 ' A' ' 19' ' ' ILE . . . -65.19 -56.85 10.47 Favored 'General case' 0 N--CA 1.478 0.934 0 C-N-CA 123.568 0.747 . . . . 72.200000000000003 112.807 -170.276 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 2.6 mp -58.9 -50.99 85.0 Favored Pre-proline 0 CA--C 1.571 1.777 0 N-CA-C 113.228 0.825 . . . . 71.150000000000006 113.228 -173.503 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 37.7 Cg_endo -65.99 -36.51 30.04 Favored 'Trans proline' 0 C--N 1.382 2.338 0 C-N-CA 121.72 1.613 . . . . 63.049999999999997 113.354 176.395 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 22.0 tt0 -65.31 -36.88 85.42 Favored 'General case' 0 N--CA 1.489 1.504 0 CA-C-O 121.489 0.661 . . . . 62.219999999999999 109.788 178.851 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 24' ' ' PHE . . . . . . . . . . . . . 64.3 t80 -76.04 -39.92 54.56 Favored 'General case' 0 N--CA 1.484 1.261 0 CA-C-N 113.994 -1.457 . . . . 72.239999999999995 110.689 -177.951 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 44.4 t -58.3 -52.25 66.38 Favored 'General case' 0 N--CA 1.478 0.947 0 C-N-CA 123.769 0.828 . . . . 75.049999999999997 110.582 173.9 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -64.11 -28.56 69.85 Favored 'General case' 0 N--CA 1.484 1.232 0 C-N-CA 123.683 0.793 . . . . 72.230000000000004 112.269 176.636 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 47.8 t80 -75.69 -46.01 33.67 Favored 'General case' 0 N--CA 1.484 1.271 0 C-N-CA 123.085 0.554 . . . . 74.129999999999995 111.442 -176.503 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 14.3 ptm180 -73.78 -23.69 59.74 Favored 'General case' 0 N--CA 1.474 0.749 0 CA-C-N 115.42 -0.809 . . . . 62.299999999999997 111.082 -179.499 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 28.3 t -69.32 -58.79 4.64 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.781 0 N-CA-C 109.389 -0.597 . . . . 52.200000000000003 109.389 171.328 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 30' ' ' LYS . . . . . 0.434 ' O ' ' HB3' ' A' ' 34' ' ' SER . 21.1 ptmt -65.98 -17.24 64.55 Favored 'General case' 0 N--CA 1.486 1.366 0 N-CA-C 112.253 0.464 . . . . 63.520000000000003 112.253 -179.223 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -72.95 -46.17 53.96 Favored 'General case' 0 N--CA 1.479 0.99 0 CA-C-O 121.334 0.588 . . . . 73.219999999999999 109.696 172.633 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 12.5 t80 -89.36 -9.99 48.31 Favored 'General case' 0 N--CA 1.488 1.447 0 CA-C-N 115.244 -0.889 . . . . 75.019999999999996 112.195 -173.59 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 29.6 m-80 -101.5 -58.8 1.81 Allowed 'General case' 0 N--CA 1.47 0.574 0 CA-C-N 115.552 -0.749 . . . . 71.349999999999994 110.479 172.93 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 34' ' ' SER . . . . . 0.434 ' HB3' ' O ' ' A' ' 30' ' ' LYS . 47.2 t -83.54 -52.03 6.82 Favored 'General case' 0 N--CA 1.496 1.849 0 CA-C-N 116.745 -0.207 . . . . 71.239999999999995 111.552 -168.405 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -69.15 -32.28 71.53 Favored 'General case' 0 N--CA 1.486 1.348 0 C-N-CA 122.165 0.186 . . . . 60.310000000000002 111.148 179.546 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -72.12 -38.52 69.26 Favored 'General case' 0 N--CA 1.478 0.97 0 C-N-CA 122.745 0.418 . . . . 62.200000000000003 111.25 176.028 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 36.4 t -66.11 -32.39 73.82 Favored 'General case' 0 N--CA 1.494 1.773 0 C-N-CA 122.526 0.331 . . . . 53.240000000000002 111.443 174.355 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 38' ' ' SER . . . . . 0.504 ' HA ' ' HB3' ' A' ' 41' ' ' ARG . 52.7 m -80.37 -23.52 40.44 Favored 'General case' 0 N--CA 1.48 1.062 0 C-N-CA 123.489 0.716 . . . . 74.200000000000003 111.323 177.798 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 39' ' ' ASP . . . . . 0.441 ' O ' ' HG ' ' A' ' 43' ' ' LEU . 24.0 t70 -68.79 -46.94 67.39 Favored 'General case' 0 CA--C 1.553 1.072 0 C-N-CA 122.985 0.514 . . . . 74.450000000000003 110.597 168.718 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 11.1 mp -69.68 -27.76 65.29 Favored 'General case' 0 N--CA 1.482 1.152 0 C-N-CA 123.378 0.671 . . . . 71.430000000000007 111.481 176.634 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 41' ' ' ARG . . . . . 0.504 ' HB3' ' HA ' ' A' ' 38' ' ' SER . 51.5 ttt180 -69.78 -41.02 75.68 Favored 'General case' 0 N--CA 1.478 0.975 0 C-N-CA 123.701 0.8 . . . . 75.349999999999994 110.033 171.738 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 52.9 t30 -60.15 -36.04 76.67 Favored 'General case' 0 CA--C 1.554 1.108 0 C-N-CA 123.793 0.837 . . . . 65.239999999999995 111.2 175.33 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 43' ' ' LEU . . . . . 0.441 ' HG ' ' O ' ' A' ' 39' ' ' ASP . 77.4 mt -79.76 -35.76 38.25 Favored 'General case' 0 N--CA 1.478 0.974 0 C-N-CA 123.272 0.629 . . . . 64.209999999999994 111.38 178.171 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 22.5 tptm -70.24 -45.31 66.73 Favored 'General case' 0 N--CA 1.481 1.087 0 N-CA-C 109.912 -0.403 . . . . 73.219999999999999 109.912 -177.343 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 45' ' ' THR . . . . . 0.496 ' HA ' ' HG2' ' A' ' 48' ' ' GLU . 3.2 t -67.44 -33.63 75.55 Favored 'General case' 0 N--CA 1.473 0.71 0 CA-C-N 114.864 -1.062 . . . . 63.32 111.158 179.622 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -63.39 -52.24 62.48 Favored 'General case' 0 N--CA 1.477 0.882 0 C-N-CA 123.461 0.705 . . . . 73.400000000000006 111.356 176.388 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 10.8 mp -67.08 -46.33 74.59 Favored 'General case' 0 N--CA 1.478 0.964 0 C-N-CA 123.01 0.524 . . . . 73.030000000000001 112.156 -179.887 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 48' ' ' GLU . . . . . 0.496 ' HG2' ' HA ' ' A' ' 45' ' ' THR . 11.1 pt-20 -67.51 -33.55 75.32 Favored 'General case' 0 N--CA 1.487 1.398 0 CA-C-N 117.935 0.334 . . . . 72.230000000000004 111.22 -176.407 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 48.2 t -74.86 -32.97 62.03 Favored 'General case' 0 N--CA 1.478 0.961 0 C-N-CA 123.242 0.617 . . . . 73.439999999999998 111.031 175.951 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -70.63 -44.36 67.33 Favored 'General case' 0 N--CA 1.489 1.512 0 CA-C-O 121.207 0.527 . . . . 72.230000000000004 110.722 -178.674 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 51' ' ' PHE . . . . . . . . . . . . . 58.1 m-85 -74.96 -20.98 59.44 Favored 'General case' 0 CA--C 1.549 0.93 0 CA-C-N 115.238 -0.892 . . . . 73.409999999999997 111.614 175.703 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -71.01 -40.54 71.74 Favored 'General case' 0 N--CA 1.484 1.27 0 C-N-CA 122.688 0.395 . . . . 64.129999999999995 110.497 171.141 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 82.9 m-20 -66.34 -49.82 65.67 Favored 'General case' 0 CA--C 1.547 0.848 0 C-N-CA 123.508 0.723 . . . . 73.409999999999997 111.252 175.768 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 38.8 t70 -140.24 146.15 38.26 Favored 'General case' 0 N--CA 1.48 1.057 0 CA-C-O 121.371 0.605 . . . . 61.439999999999998 112.47 -171.808 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 20.0 mm-40 -131.94 24.39 4.62 Favored 'General case' 0 N--CA 1.483 1.183 0 C-N-CA 124.521 1.128 . . . . 73.049999999999997 111.419 -179.404 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 67.3 p -101.0 75.0 1.64 Allowed 'General case' 0 N--CA 1.495 1.776 0 CA-C-O 122.039 0.924 . . . . 74.0 110.787 178.343 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 94.8 m-85 -129.9 84.4 60.9 Favored Pre-proline 0 N--CA 1.488 1.433 0 C-N-CA 124.056 0.942 . . . . 73.140000000000001 109.829 -179.392 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 86.7 Cg_endo -75.3 133.99 16.79 Favored 'Trans proline' 0 C--N 1.38 2.191 0 C-N-CA 122.664 2.243 . . . . 65.420000000000002 113.243 -174.617 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 74.8 Cg_endo -75.19 88.94 1.21 Allowed 'Trans proline' 0 C--N 1.382 2.322 0 C-N-CA 122.819 2.346 . . . . 70.239999999999995 111.873 177.021 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 33.2 mt-10 -73.58 -45.73 51.53 Favored 'General case' 0 N--CA 1.487 1.419 0 C-N-CA 123.665 0.786 . . . . 75.019999999999996 112.7 -172.225 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 58.2 m . . . . . 0 N--CA 1.492 1.648 0 C-N-CA 123.342 0.657 . . . . 53.039999999999999 110.56 179.168 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 1' ' ' PHE . . . . . . . . . . . . . 93.4 m-85 . . . . . 0 N--CA 1.486 1.343 0 N-CA-C 110.477 -0.194 . . . . 73.340000000000003 110.477 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 57.5 p -73.88 170.79 14.63 Favored 'General case' 0 N--CA 1.487 1.377 0 C-N-CA 123.055 0.542 . . . . 51.240000000000002 111.206 173.413 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 9.3 tt -61.07 -23.45 65.48 Favored 'General case' 0 N--CA 1.486 1.369 0 C-N-CA 123.347 0.659 . . . . 73.129999999999995 110.32 171.603 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 51.4 mm -83.0 -43.42 18.47 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.692 0 CA-C-N 115.586 -0.734 . . . . 72.25 110.001 -178.542 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 70.7 mm-40 -56.76 -42.83 80.03 Favored 'General case' 0 N--CA 1.483 1.203 0 C-N-CA 123.55 0.74 . . . . 65.120000000000005 111.658 173.943 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 2.4 pp -71.19 -37.91 72.13 Favored 'General case' 0 N--CA 1.476 0.869 0 O-C-N 123.31 0.382 . . . . 74.310000000000002 110.924 178.651 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -61.48 -46.66 89.1 Favored 'General case' 0 CA--C 1.551 1.011 0 C-N-CA 122.941 0.496 . . . . 74.540000000000006 110.765 177.978 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 95.2 mt -67.65 -49.88 66.08 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.721 0 C-N-CA 123.857 0.863 . . . . 70.430000000000007 112.341 -177.938 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 7.2 p -60.38 -41.13 86.21 Favored 'Isoleucine or valine' 0 CA--C 1.555 1.137 0 CA-C-N 118.194 0.452 . . . . 52.100000000000001 111.852 -177.05 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 74.1 t -68.81 -39.83 80.57 Favored 'Isoleucine or valine' 0 CA--C 1.555 1.16 0 C-N-CA 122.909 0.484 . . . . 72.329999999999998 111.307 174.858 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -64.27 -51.57 62.91 Favored 'General case' 0 N--CA 1.487 1.379 0 C-N-CA 122.835 0.454 . . . . 64.230000000000004 111.855 -178.733 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 12' ' ' ILE . . . . . 0.549 ' O ' ' HG ' ' A' ' 16' ' ' LEU . 22.9 pt -62.28 -48.14 89.76 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.776 0 C-N-CA 123.533 0.733 . . . . 73.519999999999996 111.471 -176.464 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 86.2 mt -63.69 -31.72 54.13 Favored 'Isoleucine or valine' 0 C--N 1.361 1.097 0 C-N-CA 123.306 0.642 . . . . 63.119999999999997 110.925 177.99 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -60.92 -40.66 98.68 Favored Glycine 0 C--N 1.35 1.341 0 CA-C-N 115.562 -0.745 . . . . 74.040000000000006 112.961 174.134 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 15' ' ' ILE . . . . . 0.529 HD12 ' HA ' ' A' ' 12' ' ' ILE . 14.5 mt -71.35 -43.78 73.09 Favored 'Isoleucine or valine' 0 C--N 1.355 0.811 0 C-N-CA 123.282 0.633 . . . . 73.109999999999999 110.465 177.061 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.549 ' HG ' ' O ' ' A' ' 12' ' ' ILE . 34.5 mt -58.23 -39.62 79.59 Favored 'General case' 0 N--CA 1.486 1.356 0 C-N-CA 123.54 0.736 . . . . 73.219999999999999 111.283 -177.578 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -73.49 -48.68 31.49 Favored 'General case' 0 N--CA 1.478 0.97 0 C-N-CA 123.016 0.526 . . . . 74.519999999999996 110.913 177.559 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -63.96 -23.9 67.52 Favored 'General case' 0 N--CA 1.482 1.149 0 N-CA-C 113.53 0.937 . . . . 62.140000000000001 113.53 -176.756 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 2.8 pp -89.76 -38.26 10.86 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.28 0 CA-C-N 118.213 0.461 . . . . 70.310000000000002 111.359 172.362 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -63.6 -47.63 80.67 Favored 'General case' 0 N--CA 1.486 1.373 0 C-N-CA 123.429 0.692 . . . . 65.219999999999999 112.789 -175.177 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 27.5 mt -57.43 -54.62 53.03 Favored Pre-proline 0 CA--C 1.563 1.462 0 CA-C-O 118.097 -0.954 . . . . 74.439999999999998 113.281 -176.692 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 39.4 Cg_endo -66.13 -37.42 25.41 Favored 'Trans proline' 0 C--N 1.378 2.09 0 CA-C-N 121.504 1.573 . . . . 64.420000000000002 113.093 174.149 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 23.8 tt0 -63.34 -37.1 85.95 Favored 'General case' 0 N--CA 1.49 1.573 0 C-N-CA 123.519 0.728 . . . . 71.519999999999996 110.802 -177.671 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 24' ' ' PHE . . . . . . . . . . . . . 70.1 t80 -93.8 -36.46 12.25 Favored 'General case' 0 N--CA 1.487 1.407 0 CA-C-N 114.685 -1.143 . . . . 71.540000000000006 111.315 -173.055 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 25' ' ' SER . . . . . 0.505 ' O ' HG23 ' A' ' 29' ' ' VAL . 39.5 t -59.55 -53.26 60.1 Favored 'General case' 0 N--CA 1.486 1.334 0 N-CA-C 110.05 -0.352 . . . . 61.009999999999998 110.05 170.983 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -65.13 -28.15 69.23 Favored 'General case' 0 N--CA 1.488 1.474 0 C-N-CA 123.668 0.787 . . . . 61.350000000000001 112.518 176.866 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 84.6 t80 -63.25 -51.07 67.68 Favored 'General case' 0 N--CA 1.487 1.38 0 CA-C-O 120.835 0.35 . . . . 75.409999999999997 110.209 172.697 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 57.0 mtp180 -65.82 -24.63 66.95 Favored 'General case' 0 N--CA 1.47 0.571 0 CA-C-N 115.465 -0.789 . . . . 74.230000000000004 111.721 179.475 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 29' ' ' VAL . . . . . 0.505 HG23 ' O ' ' A' ' 25' ' ' SER . 79.6 t -68.98 -56.29 12.52 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.09 0 N-CA-C 109.871 -0.418 . . . . 74.450000000000003 109.871 174.341 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 48.4 pttt -67.6 -24.68 65.51 Favored 'General case' 0 CA--C 1.546 0.814 0 CA-C-N 115.491 -0.777 . . . . 73.439999999999998 111.545 -176.85 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -81.65 -37.64 27.17 Favored 'General case' 0 N--CA 1.485 1.305 0 CA-C-O 121.313 0.578 . . . . 71.409999999999997 110.002 -178.522 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 21.4 t80 -76.94 -16.03 59.49 Favored 'General case' 0 N--CA 1.483 1.178 0 CA-C-N 115.048 -0.978 . . . . 74.400000000000006 111.079 -179.85 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 85.6 m-20 -94.89 -50.76 4.98 Favored 'General case' 0 N--CA 1.478 0.95 0 C-N-CA 123.798 0.839 . . . . 71.420000000000002 111.857 173.957 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 46.9 t -70.54 -52.8 19.23 Favored 'General case' 0 N--CA 1.501 2.085 0 N-CA-C 111.864 0.32 . . . . 70.329999999999998 111.864 -172.16 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -66.44 -29.78 70.0 Favored 'General case' 0 N--CA 1.479 0.99 0 C-N-CA 122.998 0.519 . . . . 54.439999999999998 111.706 179.089 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -65.99 -59.02 4.23 Favored 'General case' 0 N--CA 1.482 1.161 0 C-N-CA 122.848 0.459 . . . . 61.350000000000001 111.136 174.144 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 66.2 m -53.65 -40.55 65.96 Favored 'General case' 0 N--CA 1.482 1.143 0 C-N-CA 123.846 0.858 . . . . 74.120000000000005 111.984 179.174 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 47.7 t -76.0 -38.31 57.5 Favored 'General case' 0 N--CA 1.48 1.072 0 C-N-CA 123.105 0.562 . . . . 74.319999999999993 112.446 -176.945 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 38.5 t70 -63.72 -47.02 82.77 Favored 'General case' 0 N--CA 1.483 1.183 0 CA-C-O 121.266 0.555 . . . . 72.439999999999998 111.435 176.981 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 70.0 mt -78.66 -32.63 47.26 Favored 'General case' 0 N--CA 1.476 0.849 0 CA-C-N 115.113 -0.948 . . . . 73.329999999999998 110.78 -172.658 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 17.3 ttp180 -71.68 -35.28 70.25 Favored 'General case' 0 N--CA 1.479 1.002 0 C-N-CA 122.602 0.361 . . . . 71.129999999999995 110.244 174.643 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 28.6 t-20 -61.23 -39.76 91.49 Favored 'General case' 0 N--CA 1.485 1.316 0 C-N-CA 123.232 0.613 . . . . 71.109999999999999 111.258 171.903 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 87.2 mt -69.58 -34.12 73.69 Favored 'General case' 0 N--CA 1.48 1.026 0 C-N-CA 122.757 0.423 . . . . 52.0 111.072 177.849 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 55.8 tptt -80.58 -35.41 34.27 Favored 'General case' 0 CA--C 1.548 0.866 0 C-N-CA 123.574 0.749 . . . . 74.430000000000007 111.214 -176.636 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 3.2 t -74.35 -38.57 63.2 Favored 'General case' 0 N--CA 1.482 1.129 0 CA-C-O 121.226 0.536 . . . . 62.039999999999999 110.389 -178.022 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -71.69 -35.66 70.33 Favored 'General case' 0 N--CA 1.478 0.961 0 CA-C-N 115.193 -0.912 . . . . 61.420000000000002 111.21 174.012 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 69.8 tp -57.77 -62.65 1.65 Allowed 'General case' 0 C--N 1.359 1.021 0 O-C-N 123.89 0.744 . . . . 73.519999999999996 110.705 175.118 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 33.4 mm-40 -59.89 -32.92 71.18 Favored 'General case' 0 N--CA 1.489 1.502 0 C-N-CA 123.661 0.784 . . . . 71.340000000000003 112.583 -173.435 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 25.3 t -61.63 -52.23 65.22 Favored 'General case' 0 CA--C 1.551 1.004 0 CA-C-N 115.439 -0.8 . . . . 70.140000000000001 111.18 178.267 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -78.38 -34.1 48.42 Favored 'General case' 0 N--CA 1.486 1.36 0 C-N-CA 123.43 0.692 . . . . 41.450000000000003 112.33 -179.018 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 51' ' ' PHE . . . . . . . . . . . . . 75.1 t80 -65.09 -32.94 74.9 Favored 'General case' 0 N--CA 1.488 1.456 0 C-N-CA 125.25 1.42 . . . . 72.439999999999998 110.572 -176.146 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -79.22 -35.44 41.62 Favored 'General case' 0 CA--C 1.545 0.767 0 CA-C-N 115.592 -0.731 . . . . 73.219999999999999 110.797 176.57 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 32.8 t70 -62.44 -50.94 69.48 Favored 'General case' 0 N--CA 1.481 1.076 0 C-N-CA 123.797 0.839 . . . . 65.310000000000002 112.788 -174.817 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 6.7 p-10 -64.82 -33.12 75.23 Favored 'General case' 0 N--CA 1.49 1.525 0 C-N-CA 122.599 0.36 . . . . 74.329999999999998 111.845 -177.518 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 76.2 mt-30 -69.19 -45.02 70.97 Favored 'General case' 0 N--CA 1.484 1.245 0 C-N-CA 123.573 0.749 . . . . 73.549999999999997 111.345 176.361 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 69.4 p -97.55 76.65 2.54 Favored 'General case' 0 N--CA 1.48 1.053 0 CA-C-O 122.326 1.06 . . . . 72.310000000000002 110.157 -179.108 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 47.2 p90 -100.14 153.99 37.46 Favored Pre-proline 0 N--CA 1.485 1.276 0 CA-C-N 114.94 -1.027 . . . . 75.519999999999996 111.546 -176.72 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 52.5 Cg_endo -67.03 145.19 72.81 Favored 'Trans proline' 0 C--N 1.379 2.157 0 C-N-CA 122.069 1.846 . . . . 63.439999999999998 111.419 171.326 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 24.5 Cg_endo -58.53 102.41 0.14 Allowed 'Trans proline' 0 C--N 1.379 2.178 0 C-N-CA 123.066 2.511 . . . . 62.049999999999997 112.98 -178.137 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -66.48 96.42 0.37 Allowed 'General case' 0 CA--C 1.552 1.044 0 C-N-CA 123.42 0.688 . . . . 62.020000000000003 110.148 -177.878 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 49.0 m . . . . . 0 CA--C 1.555 1.158 0 C-N-CA 124.028 0.931 . . . . 63.340000000000003 110.986 179.617 . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 1' ' ' PHE . . . . . . . . . . . . . 93.0 m-85 . . . . . 0 N--CA 1.48 1.064 0 N-CA-C 110.142 -0.318 . . . . 61.130000000000003 110.142 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 72.4 p -131.0 154.41 48.2 Favored 'General case' 0 N--CA 1.491 1.598 0 C-N-CA 123.781 0.832 . . . . 74.510000000000005 110.851 177.403 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 2.4 pt? -60.72 -21.33 62.83 Favored 'General case' 0 N--CA 1.489 1.494 0 C-N-CA 123.567 0.747 . . . . 75.299999999999997 111.348 171.179 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 49.2 mm -69.33 -47.57 72.56 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.087 0 C-N-CA 123.821 0.848 . . . . 73.310000000000002 110.316 176.353 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 22.9 mm-40 -59.94 -42.22 93.55 Favored 'General case' 0 N--CA 1.484 1.229 0 C-N-CA 123.441 0.696 . . . . 74.140000000000001 111.355 175.41 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 83.4 mt -63.75 -37.34 86.98 Favored 'General case' 0 N--CA 1.487 1.408 0 C-N-CA 123.19 0.596 . . . . 72.439999999999998 111.835 176.508 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 6.7 tt -64.51 -43.09 95.16 Favored 'General case' 0 CA--C 1.548 0.883 0 C-N-CA 124.026 0.931 . . . . 63.32 110.108 176.416 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 96.0 mt -67.95 -42.1 85.26 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.943 0 C-N-CA 123.546 0.738 . . . . 74.540000000000006 111.762 179.193 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 79.1 t -63.48 -45.72 97.1 Favored 'Isoleucine or valine' 0 CA--C 1.556 1.177 0 C-N-CA 123.325 0.65 . . . . 73.329999999999998 111.601 176.764 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 3.1 p -69.36 -26.48 31.58 Favored 'Isoleucine or valine' 0 CA--C 1.56 1.338 0 C-N-CA 122.368 0.267 . . . . 74.219999999999999 111.603 177.864 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -73.89 -55.35 6.29 Favored 'General case' 0 N--CA 1.48 1.046 0 C-N-CA 123.242 0.617 . . . . 73.230000000000004 111.272 178.673 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 12' ' ' ILE . . . . . 0.535 ' O ' ' HG ' ' A' ' 16' ' ' LEU . 16.3 pt -57.3 -53.28 45.81 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.039 0 C-N-CA 122.943 0.497 . . . . 72.299999999999997 111.435 -179.853 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 80.1 mt -66.6 -32.81 59.71 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.967 0 C-N-CA 123.777 0.831 . . . . 71.120000000000005 110.869 -179.56 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -60.81 -42.37 99.49 Favored Glycine 0 C--N 1.353 1.481 0 O-C-N 123.628 0.58 . . . . 74.439999999999998 113.651 176.796 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 1.8 mp -75.74 -34.93 29.57 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.255 0 C-N-CA 122.856 0.462 . . . . 62.539999999999999 110.408 177.249 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.535 ' HG ' ' O ' ' A' ' 12' ' ' ILE . 19.3 mt -62.31 -39.06 91.79 Favored 'General case' 0 N--CA 1.489 1.523 0 C-N-CA 122.377 0.271 . . . . 73.549999999999997 111.089 176.409 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -74.28 -39.9 62.66 Favored 'General case' 0 N--CA 1.477 0.888 0 C-N-CA 123.529 0.732 . . . . 71.430000000000007 110.944 177.501 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -62.48 -24.06 67.25 Favored 'General case' 0 N--CA 1.483 1.176 0 C-N-CA 123.894 0.878 . . . . 74.299999999999997 112.947 178.835 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 2.8 pp -96.85 -37.63 7.25 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.208 0 N-CA-C 111.846 0.313 . . . . 72.540000000000006 111.846 171.723 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -67.62 -48.47 66.67 Favored 'General case' 0 N--CA 1.493 1.713 0 N-CA-C 112.891 0.701 . . . . 73.140000000000001 112.891 -173.011 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 27.9 mt -58.79 -52.56 73.85 Favored Pre-proline 0 CA--C 1.556 1.199 0 CA-C-O 118.059 -0.972 . . . . 74.209999999999994 113.18 -178.565 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 42.9 Cg_endo -67.09 -36.96 20.16 Favored 'Trans proline' 0 C--N 1.378 2.101 0 CA-C-N 121.77 1.668 . . . . 54.439999999999998 113.123 174.115 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 28.6 tt0 -66.64 -32.45 73.78 Favored 'General case' 0 N--CA 1.491 1.599 0 C-N-CA 122.854 0.462 . . . . 64.319999999999993 110.52 -177.627 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 24' ' ' PHE . . . . . . . . . . . . . 85.5 t80 -90.09 -40.06 12.51 Favored 'General case' 0 N--CA 1.487 1.396 0 CA-C-N 115.366 -0.833 . . . . 63.109999999999999 111.406 -178.5 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 34.8 t -56.91 -55.24 37.08 Favored 'General case' 0 N--CA 1.488 1.449 0 C-N-CA 122.849 0.459 . . . . 55.299999999999997 110.837 172.645 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -61.89 -26.32 68.08 Favored 'General case' 0 N--CA 1.487 1.399 0 C-N-CA 123.357 0.663 . . . . 74.530000000000001 112.571 175.336 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 57.5 t80 -70.81 -51.74 24.89 Favored 'General case' 0 N--CA 1.48 1.052 0 C-N-CA 123.119 0.568 . . . . 72.430000000000007 111.104 178.534 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 13.6 ptm180 -70.53 -21.57 62.71 Favored 'General case' 0 N--CA 1.475 0.824 0 C-N-CA 123.184 0.593 . . . . 74.319999999999993 111.108 -177.707 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 49.1 t -73.96 -52.79 19.39 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.969 0 CA-C-N 115.989 -0.551 . . . . 64.239999999999995 109.884 172.939 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 21.1 ptmt -70.74 -15.92 62.73 Favored 'General case' 0 N--CA 1.489 1.485 0 C-N-CA 122.773 0.429 . . . . 74.430000000000007 111.379 179.17 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -76.64 -36.46 57.39 Favored 'General case' 0 N--CA 1.481 1.1 0 CA-C-O 121.547 0.689 . . . . 64.010000000000005 109.737 172.964 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 33.4 t80 -83.61 -19.04 36.2 Favored 'General case' 0 N--CA 1.48 1.036 0 CA-C-N 115.133 -0.94 . . . . 74.310000000000002 111.87 -179.735 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 3.8 m-20 -92.63 -56.46 3.01 Favored 'General case' 0 N--CA 1.473 0.722 0 CA-C-N 115.556 -0.747 . . . . 75.200000000000003 111.069 175.97 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 46.0 t -88.97 -51.71 5.47 Favored 'General case' 0 N--CA 1.497 1.882 0 CA-C-N 116.247 -0.433 . . . . 64.049999999999997 111.585 -168.802 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -71.7 -24.8 61.88 Favored 'General case' 0 N--CA 1.484 1.275 0 C-N-CA 122.656 0.382 . . . . 64.430000000000007 111.966 -178.148 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -79.43 -37.25 37.5 Favored 'General case' 0 N--CA 1.481 1.1 0 C-N-CA 122.478 0.311 . . . . 71.040000000000006 110.805 174.246 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 37.9 t -61.62 -43.47 98.8 Favored 'General case' 0 N--CA 1.494 1.748 0 C-N-CA 123.075 0.55 . . . . 75.150000000000006 111.507 173.245 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 80.1 p -75.83 -27.51 57.89 Favored 'General case' 0 N--CA 1.481 1.107 0 C-N-CA 124.127 0.971 . . . . 54.149999999999999 111.637 -177.909 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 16.8 t70 -63.08 -48.03 80.35 Favored 'General case' 0 CA--C 1.553 1.071 0 O-C-N 123.419 0.449 . . . . 64.349999999999994 110.712 169.159 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 0.471 HD23 HD12 ' A' ' 43' ' ' LEU . 96.2 mt -71.04 -26.94 63.31 Favored 'General case' 0 N--CA 1.484 1.253 0 C-N-CA 123.199 0.6 . . . . 64.439999999999998 111.244 179.317 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 27.9 tpt180 -72.22 -37.84 69.09 Favored 'General case' 0 CA--C 1.548 0.883 0 C-N-CA 123.894 0.878 . . . . 64.109999999999999 110.136 174.845 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 44.7 t-20 -65.95 -38.89 89.77 Favored 'General case' 0 CA--C 1.56 1.329 0 C-N-CA 124.197 0.999 . . . . 55.350000000000001 110.36 174.447 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 43' ' ' LEU . . . . . 0.471 HD12 HD23 ' A' ' 40' ' ' LEU . 96.0 mt -69.5 -33.08 72.33 Favored 'General case' 0 N--CA 1.482 1.125 0 C-N-CA 123.167 0.587 . . . . 65.010000000000005 110.979 175.97 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 44' ' ' LYS . . . . . 0.451 ' O ' ' HG2' ' A' ' 48' ' ' GLU . 60.7 tttp -73.78 -46.42 45.71 Favored 'General case' 0 N--CA 1.474 0.767 0 CA-C-N 116.102 -0.499 . . . . 65.329999999999998 110.51 179.93 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 3.7 t -64.01 -32.27 73.75 Favored 'General case' 0 N--CA 1.487 1.389 0 C-N-CA 123.573 0.749 . . . . 70.299999999999997 111.168 -174.58 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -68.88 -43.46 75.28 Favored 'General case' 0 N--CA 1.478 0.945 0 CA-C-N 115.035 -0.984 . . . . 74.299999999999997 111.679 171.521 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 9.7 tt -60.7 -39.89 90.21 Favored 'General case' 0 N--CA 1.483 1.179 0 C-N-CA 123.976 0.911 . . . . 70.319999999999993 110.609 176.514 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 48' ' ' GLU . . . . . 0.451 ' HG2' ' O ' ' A' ' 44' ' ' LYS . 60.8 mm-40 -65.31 -47.87 75.06 Favored 'General case' 0 N--CA 1.476 0.85 0 C-N-CA 123.244 0.618 . . . . 74.530000000000001 110.499 179.988 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 59.5 m -61.33 -31.92 71.79 Favored 'General case' 0 N--CA 1.483 1.186 0 C-N-CA 123.356 0.663 . . . . 74.450000000000003 112.08 179.543 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -78.5 -52.1 9.01 Favored 'General case' 0 N--CA 1.482 1.156 0 C-N-CA 123.205 0.602 . . . . 72.519999999999996 111.965 -178.507 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 51' ' ' PHE . . . . . . . . . . . . . 70.6 m-85 -85.68 -13.7 47.73 Favored 'General case' 0 N--CA 1.482 1.138 0 N-CA-C 113.482 0.919 . . . . 55.240000000000002 113.482 -170.207 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -79.16 -15.12 58.56 Favored 'General case' 0 N--CA 1.491 1.595 0 N-CA-C 111.774 0.287 . . . . 64.049999999999997 111.774 175.036 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 20.0 t70 -117.32 -36.49 3.74 Favored 'General case' 0 N--CA 1.481 1.086 0 C-N-CA 122.574 0.35 . . . . 73.329999999999998 111.137 178.832 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 8.6 m-20 -122.77 120.21 32.91 Favored 'General case' 0 N--CA 1.491 1.587 0 CA-C-O 121.7 0.762 . . . . 63.049999999999997 112.885 -177.051 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 26.2 mp0 -97.61 12.46 33.48 Favored 'General case' 0 N--CA 1.484 1.243 0 C-N-CA 124.379 1.072 . . . . 71.150000000000006 110.073 163.48 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 22.2 m -53.8 -38.51 64.61 Favored 'General case' 0 N--CA 1.492 1.652 0 C-N-CA 125.26 1.424 . . . . 72.299999999999997 112.321 -179.671 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 49.9 t80 -108.12 93.59 11.38 Favored Pre-proline 0 CA--C 1.555 1.158 0 C-N-CA 124.237 1.015 . . . . 73.310000000000002 108.68 172.057 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 95.3 Cg_endo -84.41 131.52 4.84 Favored 'Trans proline' 0 CA--C 1.565 2.049 0 C-N-CA 121.889 1.726 . . . . 75.140000000000001 112.463 175.82 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 87.7 Cg_endo -91.07 110.36 0.33 Allowed 'Trans proline' 0 C--N 1.374 1.884 0 C-N-CA 122.736 2.291 . . . . 54.32 112.241 174.571 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 11.1 pt-20 -75.29 119.37 19.31 Favored 'General case' 0 N--CA 1.482 1.163 0 CA-C-O 121.242 0.544 . . . . 71.409999999999997 111.163 179.69 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 35.2 t . . . . . 0 N--CA 1.486 1.354 0 C-N-CA 123.376 0.67 . . . . 75.109999999999999 110.849 -177.186 . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 1' ' ' PHE . . . . . . . . . . . . . 53.2 m-85 . . . . . 0 N--CA 1.484 1.253 0 N-CA-C 109.741 -0.466 . . . . 74.530000000000001 109.741 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 38.8 p -126.32 152.08 46.69 Favored 'General case' 0 N--CA 1.495 1.775 0 C-N-CA 123.384 0.674 . . . . 75.439999999999998 111.229 -179.481 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 44.4 mt -67.84 -19.04 65.01 Favored 'General case' 0 N--CA 1.484 1.271 0 C-N-CA 124.112 0.965 . . . . 75.510000000000005 111.846 178.64 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 46.6 mm -87.65 -48.96 14.96 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.167 0 CA-C-N 115.437 -0.801 . . . . 74.140000000000001 111.083 -175.362 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 9.0 tp10 -54.12 -47.66 71.61 Favored 'General case' 0 N--CA 1.475 0.78 0 C-N-CA 124.046 0.938 . . . . 55.020000000000003 110.959 175.941 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 3.0 pp -64.7 -37.08 86.37 Favored 'General case' 0 N--CA 1.48 1.069 0 C-N-CA 122.843 0.457 . . . . 74.340000000000003 111.951 -178.539 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 61.2 tp -59.31 -45.66 90.69 Favored 'General case' 0 CA--C 1.547 0.864 0 C-N-CA 123.495 0.718 . . . . 74.200000000000003 111.36 175.093 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 94.1 mt -68.4 -39.74 81.26 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.039 0 C-N-CA 124.272 1.029 . . . . 74.310000000000002 111.967 178.779 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 48.5 t -60.82 -47.9 91.23 Favored 'Isoleucine or valine' 0 CA--C 1.554 1.13 0 C-N-CA 123.645 0.778 . . . . 73.319999999999993 111.454 175.485 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 76.7 t -64.39 -32.16 56.49 Favored 'Isoleucine or valine' 0 CA--C 1.558 1.269 0 C-N-CA 123.323 0.649 . . . . 74.430000000000007 111.571 176.086 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -65.73 -57.22 8.54 Favored 'General case' 0 N--CA 1.482 1.156 0 C-N-CA 122.983 0.513 . . . . 72.140000000000001 111.584 176.181 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 12' ' ' ILE . . . . . 0.574 ' HA ' HD12 ' A' ' 15' ' ' ILE . 22.5 pt -66.14 -42.39 91.17 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.011 0 C-N-CA 123.548 0.739 . . . . 62.420000000000002 112.054 -175.122 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 58.2 mt -65.2 -34.88 73.57 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.13 0 C-N-CA 123.764 0.825 . . . . 71.120000000000005 110.57 174.149 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -60.67 -37.33 93.31 Favored Glycine 0 C--N 1.353 1.525 0 CA-C-N 115.674 -0.694 . . . . 42.109999999999999 112.67 174.402 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 15' ' ' ILE . . . . . 0.574 HD12 ' HA ' ' A' ' 12' ' ' ILE . 21.8 mt -71.31 -46.96 62.45 Favored 'Isoleucine or valine' 0 C--N 1.353 0.742 0 C-N-CA 123.577 0.751 . . . . 72.420000000000002 110.976 175.872 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.481 ' HG ' ' O ' ' A' ' 12' ' ' ILE . 21.4 mt -56.2 -43.47 78.51 Favored 'General case' 0 N--CA 1.488 1.472 0 C-N-CA 123.378 0.671 . . . . 73.400000000000006 111.35 -178.554 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -74.78 -47.53 30.4 Favored 'General case' 0 CA--C 1.544 0.749 0 C-N-CA 123.36 0.664 . . . . 40.299999999999997 111.209 -178.078 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -63.91 -23.01 67.18 Favored 'General case' 0 N--CA 1.484 1.253 0 N-CA-C 113.037 0.755 . . . . 70.439999999999998 113.037 -177.926 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 2.7 pp -90.3 -38.19 10.58 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.195 0 CA-C-N 118.151 0.432 . . . . 72.340000000000003 111.502 171.973 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -63.96 -50.31 69.1 Favored 'General case' 0 N--CA 1.487 1.401 0 C-N-CA 123.549 0.74 . . . . 70.340000000000003 112.704 -175.309 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 28.5 mt -55.44 -55.51 39.21 Favored Pre-proline 0 CA--C 1.558 1.271 0 CA-C-O 118.149 -0.929 . . . . 53.350000000000001 113.308 -175.621 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 40.4 Cg_endo -66.31 -40.77 13.91 Favored 'Trans proline' 0 C--N 1.379 2.171 0 CA-C-N 121.323 1.508 . . . . 63.119999999999997 112.991 175.979 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 21.3 tt0 -62.56 -38.03 88.44 Favored 'General case' 0 N--CA 1.486 1.366 0 C-N-CA 123.273 0.629 . . . . 74.049999999999997 111.034 -175.595 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 24' ' ' PHE . . . . . . . . . . . . . 26.7 m-85 -96.28 -32.39 12.44 Favored 'General case' 0 N--CA 1.485 1.316 0 CA-C-N 115.082 -0.963 . . . . 63.149999999999999 112.104 -173.348 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 47.0 t -62.96 -55.11 28.72 Favored 'General case' 0 N--CA 1.49 1.567 0 N-CA-C 109.853 -0.425 . . . . 74.109999999999999 109.853 171.181 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -62.18 -27.06 68.71 Favored 'General case' 0 N--CA 1.483 1.204 0 C-N-CA 123.913 0.885 . . . . 43.329999999999998 112.495 177.749 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 87.9 t80 -65.42 -54.07 33.95 Favored 'General case' 0 N--CA 1.484 1.275 0 C-N-CA 122.745 0.418 . . . . 72.230000000000004 110.726 175.053 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 49.8 mtp180 -69.99 -24.3 63.29 Favored 'General case' 0 N--CA 1.481 1.121 0 C-N-CA 123.485 0.714 . . . . 73.209999999999994 111.8 -178.578 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 24.7 t -72.48 -46.17 56.72 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.266 0 CA-C-N 116.02 -0.537 . . . . 75.319999999999993 110.6 175.471 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 18.8 ptmt -79.02 -16.9 56.23 Favored 'General case' 0 N--CA 1.48 1.029 0 CA-C-N 115.715 -0.675 . . . . 72.310000000000002 111.114 178.178 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -81.9 -29.18 32.49 Favored 'General case' 0 N--CA 1.486 1.364 0 C-N-CA 123.233 0.613 . . . . 61.109999999999999 110.129 174.013 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 62.5 t80 -62.79 -53.77 49.14 Favored 'General case' 0 C--O 1.21 -1.013 0 N-CA-C 108.945 -0.761 . . . . 72.430000000000007 108.945 168.559 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 3.4 m-20 -57.23 -43.24 82.69 Favored 'General case' 0 N--CA 1.487 1.384 0 C-N-CA 123.898 0.879 . . . . 73.409999999999997 112.334 175.477 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 35.5 t -62.54 -65.94 0.61 Allowed 'General case' 0 N--CA 1.484 1.258 0 C-N-CA 123.17 0.588 . . . . 74.329999999999998 111.11 -179.86 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -65.09 -31.36 72.54 Favored 'General case' 0 N--CA 1.481 1.081 0 N-CA-C 113.016 0.747 . . . . 73.209999999999994 113.016 -176.165 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -69.46 -60.57 2.25 Favored 'General case' 0 N--CA 1.492 1.668 0 CA-C-N 117.608 0.186 . . . . 65.140000000000001 111.248 177.29 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 48.7 m -66.37 -25.06 66.62 Favored 'General case' 0 N--CA 1.484 1.257 0 C-N-CA 123.023 0.529 . . . . 72.329999999999998 112.401 -177.909 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 42.4 t -75.98 -39.26 56.28 Favored 'General case' 0 N--CA 1.491 1.603 0 C-N-CA 123.021 0.528 . . . . 64.030000000000001 111.088 176.163 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 28.2 t70 -58.01 -50.73 72.4 Favored 'General case' 0 N--CA 1.481 1.116 0 C-N-CA 123.059 0.544 . . . . 74.129999999999995 110.369 170.186 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 95.1 mt -65.01 -38.81 92.15 Favored 'General case' 0 N--CA 1.478 0.943 0 CA-C-N 115.066 -0.97 . . . . 71.439999999999998 110.937 -176.155 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 36.4 ttt180 -71.37 -54.49 10.58 Favored 'General case' 0 CA--C 1.542 0.644 0 C-N-CA 123.385 0.674 . . . . 64.219999999999999 110.678 -179.134 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 2.8 t-20 -57.55 -41.64 81.37 Favored 'General case' 0 N--CA 1.488 1.473 0 C-N-CA 124.059 0.943 . . . . 70.0 112.348 -175.06 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 98.1 mt -72.44 -47.14 51.35 Favored 'General case' 0 N--CA 1.48 1.069 0 C-N-CA 122.924 0.49 . . . . 70.230000000000004 111.083 -179.675 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 36.4 ttpt -67.27 -46.33 73.97 Favored 'General case' 0 N--CA 1.481 1.09 0 C-N-CA 123.525 0.73 . . . . 73.430000000000007 110.967 -173.893 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 45' ' ' THR . . . . . 0.519 ' HA ' ' HG2' ' A' ' 48' ' ' GLU . 1.8 t -71.76 -33.86 68.99 Favored 'General case' 0 N--CA 1.472 0.655 0 CA-C-N 115.056 -0.974 . . . . 72.239999999999995 111.357 -173.936 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -68.81 -43.06 76.38 Favored 'General case' 0 N--CA 1.475 0.791 0 CA-C-N 115.885 -0.598 . . . . 71.519999999999996 110.492 176.513 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 1.8 pp -75.96 -32.99 59.78 Favored 'General case' 0 N--CA 1.481 1.104 0 C-N-CA 122.653 0.381 . . . . 74.400000000000006 111.61 -177.073 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 48' ' ' GLU . . . . . 0.519 ' HG2' ' HA ' ' A' ' 45' ' ' THR . 11.0 pt-20 -78.6 -36.07 44.81 Favored 'General case' 0 N--CA 1.489 1.513 0 CA-C-N 117.756 0.253 . . . . 53.049999999999997 111.314 -178.208 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 67.8 m -68.59 -35.0 76.75 Favored 'General case' 0 N--CA 1.485 1.315 0 C-N-CA 123.083 0.553 . . . . 74.530000000000001 110.326 173.334 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 50' ' ' ALA . . . . . 0.48 ' HB1' ' HG3' ' A' ' 55' ' ' GLN . . . -65.83 -42.9 89.99 Favored 'General case' 0 N--CA 1.474 0.739 0 CA-C-N 115.397 -0.819 . . . . 73.519999999999996 110.657 172.825 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 51' ' ' PHE . . . . . . . . . . . . . 61.0 t80 -71.31 -26.38 62.83 Favored 'General case' 0 N--CA 1.483 1.182 0 C-N-CA 123.783 0.833 . . . . 74.310000000000002 111.468 178.994 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -69.95 -38.31 76.08 Favored 'General case' 0 N--CA 1.485 1.313 0 C-N-CA 123.605 0.762 . . . . 72.450000000000003 110.942 178.28 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 16.3 t70 -95.77 -8.5 34.22 Favored 'General case' 0 CA--C 1.56 1.364 0 C-N-CA 123.383 0.673 . . . . 54.310000000000002 111.215 177.751 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 14.5 t70 75.97 130.68 0.05 OUTLIER 'General case' 0 CA--C 1.568 1.67 0 C-N-CA 126.463 1.905 . . . . 73.209999999999994 110.989 -173.625 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 55' ' ' GLN . . . . . 0.48 ' HG3' ' HB1' ' A' ' 50' ' ' ALA . 22.1 mp0 -70.68 -1.58 11.79 Favored 'General case' 0 N--CA 1.493 1.678 0 N-CA-C 114.283 1.216 . . . . 62.219999999999999 114.283 -171.393 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 93.8 m -65.51 -38.14 88.83 Favored 'General case' 0 N--CA 1.49 1.541 0 CA-C-N 118.282 0.492 . . . . 74.140000000000001 110.997 173.69 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 59.1 t80 -91.81 120.62 67.93 Favored Pre-proline 0 CA--C 1.558 1.267 0 C-N-CA 122.561 0.344 . . . . 74.129999999999995 110.68 175.718 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 69.1 Cg_endo -85.19 148.39 10.38 Favored 'Trans proline' 0 CA--C 1.567 2.128 0 C-N-CA 122.575 2.183 . . . . 53.539999999999999 113.098 169.736 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 43.9 Cg_exo -60.3 154.35 53.26 Favored 'Trans proline' 0 C--N 1.38 2.218 0 C-N-CA 122.971 2.447 . . . . 62.219999999999999 112.479 168.673 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 44.0 tt0 -61.09 108.15 0.84 Allowed 'General case' 0 N--CA 1.485 1.289 0 C-N-CA 123.195 0.598 . . . . 74.0 111.98 -176.37 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 36.8 t . . . . . 0 N--CA 1.487 1.414 0 C-N-CA 123.706 0.802 . . . . 72.329999999999998 110.27 176.811 . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 1' ' ' PHE . . . . . . . . . . . . . 67.5 m-85 . . . . . 0 N--CA 1.486 1.354 0 CA-C-O 121.107 0.48 . . . . 71.409999999999997 110.492 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 2' ' ' THR . . . . . 0.595 HG22 ' H ' ' A' ' 4' ' ' ILE . 22.1 m -92.05 141.81 28.21 Favored 'General case' 0 N--CA 1.482 1.165 0 C-N-CA 123.947 0.899 . . . . 73.340000000000003 111.3 -179.686 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 2.8 mm? -64.63 -18.16 64.68 Favored 'General case' 0 N--CA 1.49 1.563 0 C-N-CA 123.923 0.889 . . . . 73.430000000000007 111.908 178.859 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 4' ' ' ILE . . . . . 0.595 ' H ' HG22 ' A' ' 2' ' ' THR . 50.6 mm -71.18 -39.68 73.78 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.267 0 C-N-CA 123.599 0.76 . . . . 72.219999999999999 110.276 175.223 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 43.3 mt-10 -54.82 -48.26 73.04 Favored 'General case' 0 N--CA 1.485 1.275 0 C-N-CA 123.044 0.538 . . . . 65.230000000000004 111.407 175.671 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -60.96 -37.29 81.86 Favored 'General case' 0 N--CA 1.488 1.454 0 O-C-N 123.567 0.542 . . . . 73.5 110.733 -179.311 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 34.0 tp -68.6 -34.06 75.12 Favored 'General case' 0 CA--C 1.551 1.016 0 C-N-CA 123.455 0.702 . . . . 73.299999999999997 112.222 179.77 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 89.1 mt -73.62 -45.69 50.25 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.639 0 C-N-CA 123.355 0.662 . . . . 72.049999999999997 110.943 175.392 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 73.3 t -62.1 -42.93 96.93 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.868 0 C-N-CA 123.624 0.77 . . . . 51.32 111.618 179.493 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 6.1 p -68.93 -31.45 50.59 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.074 0 O-C-N 122.205 -0.309 . . . . 74.140000000000001 111.519 177.321 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -69.07 -53.49 20.07 Favored 'General case' 0 C--N 1.361 1.087 0 C-N-CA 122.775 0.43 . . . . 73.099999999999994 111.437 178.661 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 12' ' ' ILE . . . . . 0.587 ' HA ' HD12 ' A' ' 15' ' ' ILE . 29.6 pt -65.17 -45.57 93.58 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.953 0 C-N-CA 123.306 0.643 . . . . 63.25 111.636 -178.346 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 1.7 mp -61.93 -32.89 55.6 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.532 0 C-N-CA 123.717 0.807 . . . . 74.400000000000006 110.457 174.253 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -58.91 -40.3 95.11 Favored Glycine 0 C--N 1.355 1.614 0 O-C-N 123.5 0.5 . . . . 53.109999999999999 112.618 174.146 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 15' ' ' ILE . . . . . 0.587 HD12 ' HA ' ' A' ' 12' ' ' ILE . 19.2 mt -72.13 -46.81 57.09 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.748 0 C-N-CA 124.049 0.94 . . . . 71.140000000000001 110.902 175.843 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.527 ' HG ' ' O ' ' A' ' 12' ' ' ILE . 25.6 mt -59.74 -37.77 79.89 Favored 'General case' 0 N--CA 1.482 1.137 0 C-N-CA 123.549 0.739 . . . . 63.109999999999999 111.6 -176.749 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -75.97 -48.03 22.7 Favored 'General case' 0 N--CA 1.474 0.756 0 C-N-CA 123.103 0.561 . . . . 63.210000000000001 110.381 178.344 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -56.92 -26.85 60.09 Favored 'General case' 0 N--CA 1.481 1.087 0 N-CA-C 113.249 0.833 . . . . 70.439999999999998 113.249 -179.139 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 2.8 pp -91.18 -38.27 10.37 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.982 0 N-CA-C 111.758 0.281 . . . . 63.130000000000003 111.758 172.117 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -64.72 -50.41 67.04 Favored 'General case' 0 N--CA 1.489 1.483 0 N-CA-C 113.204 0.816 . . . . 71.129999999999995 113.204 -171.374 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 2.4 mp -63.78 -53.06 53.21 Favored Pre-proline 0 CA--C 1.563 1.451 0 CA-C-O 118.544 -0.741 . . . . 71.219999999999999 112.461 -174.035 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 36.7 Cg_endo -63.7 -35.49 57.68 Favored 'Trans proline' 0 C--N 1.38 2.194 0 C-N-CA 121.895 1.73 . . . . 70.030000000000001 113.374 175.025 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 29.9 tt0 -66.14 -38.78 88.96 Favored 'General case' 0 N--CA 1.487 1.382 0 C-N-CA 123.034 0.533 . . . . 71.319999999999993 110.259 179.899 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 24' ' ' PHE . . . . . . . . . . . . . 79.9 t80 -79.69 -38.79 32.75 Favored 'General case' 0 N--CA 1.487 1.423 0 CA-C-N 114.742 -1.117 . . . . 71.129999999999995 110.67 -176.241 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 25' ' ' SER . . . . . 0.404 ' O ' HG23 ' A' ' 29' ' ' VAL . 47.8 t -56.44 -59.19 5.33 Favored 'General case' 0 N--CA 1.475 0.798 0 C-N-CA 123.696 0.798 . . . . 75.019999999999996 109.244 172.25 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -57.56 -29.31 64.32 Favored 'General case' 0 N--CA 1.48 1.057 0 C-N-CA 124.141 0.976 . . . . 54.100000000000001 112.652 177.444 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 64.3 t80 -75.19 -47.92 26.04 Favored 'General case' 0 N--CA 1.483 1.196 0 C-N-CA 123.173 0.589 . . . . 62.32 111.361 -177.145 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 40.6 ptt180 -78.28 -21.38 49.84 Favored 'General case' 0 N--CA 1.48 1.044 0 CA-C-N 115.589 -0.732 . . . . 72.049999999999997 110.935 -178.92 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 29' ' ' VAL . . . . . 0.404 HG23 ' O ' ' A' ' 25' ' ' SER . 42.9 t -72.99 -54.42 15.83 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.027 0 N-CA-C 109.485 -0.561 . . . . 72.329999999999998 109.485 172.797 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 14.3 ptmm? -65.29 -20.27 66.33 Favored 'General case' 0 N--CA 1.489 1.519 0 C-N-CA 122.49 0.316 . . . . 64.430000000000007 111.235 178.541 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -68.62 -44.86 73.34 Favored 'General case' 0 N--CA 1.476 0.859 0 CA-C-O 121.404 0.621 . . . . 64.230000000000004 109.94 170.531 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 30.9 t80 -83.8 -12.02 56.24 Favored 'General case' 0 N--CA 1.481 1.108 0 CA-C-N 114.97 -1.013 . . . . 73.310000000000002 112.543 -177.066 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 3.6 m-20 -96.57 -54.11 3.35 Favored 'General case' 0 N--CA 1.478 0.971 0 C-N-CA 123.441 0.696 . . . . 73.340000000000003 110.432 176.874 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 46.6 t -77.7 -51.24 10.89 Favored 'General case' 0 N--CA 1.494 1.754 0 CA-C-N 115.98 -0.555 . . . . 72.019999999999996 111.658 -171.139 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -68.72 -28.73 67.09 Favored 'General case' 0 N--CA 1.483 1.182 0 C-N-CA 122.602 0.361 . . . . 53.329999999999998 111.567 179.647 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -69.98 -42.82 72.62 Favored 'General case' 0 N--CA 1.482 1.14 0 C-N-CA 122.49 0.316 . . . . 62.420000000000002 111.024 175.122 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 37' ' ' SER . . . . . 0.42 ' O ' ' HG2' ' A' ' 41' ' ' ARG . 71.1 m -59.86 -46.84 88.02 Favored 'General case' 0 N--CA 1.482 1.169 0 C-N-CA 122.807 0.443 . . . . 61.210000000000001 110.797 173.406 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 50.6 m -66.69 -31.55 72.29 Favored 'General case' 0 N--CA 1.481 1.113 0 C-N-CA 123.664 0.785 . . . . 72.430000000000007 112.031 -178.354 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 28.8 t70 -60.21 -51.03 71.29 Favored 'General case' 0 N--CA 1.477 0.882 0 C-N-CA 123.24 0.616 . . . . 75.439999999999998 110.454 171.052 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 85.7 mt -70.89 -30.93 67.42 Favored 'General case' 0 N--CA 1.481 1.119 0 C-N-CA 123.388 0.675 . . . . 51.420000000000002 111.585 -175.769 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 41' ' ' ARG . . . . . 0.42 ' HG2' ' O ' ' A' ' 37' ' ' SER . 14.7 mmt180 -78.32 -32.74 49.41 Favored 'General case' 0 N--CA 1.48 1.067 0 CA-C-N 115.777 -0.647 . . . . 72.310000000000002 110.408 177.853 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 64.1 t30 -64.93 -38.87 92.4 Favored 'General case' 0 N--CA 1.484 1.248 0 C-N-CA 123.14 0.576 . . . . 74.299999999999997 110.432 172.56 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 43' ' ' LEU . . . . . 0.491 ' O ' HD13 ' A' ' 47' ' ' LEU . 94.3 mt -70.42 -42.69 71.29 Favored 'General case' 0 N--CA 1.479 1.0 0 C-N-CA 123.304 0.641 . . . . 64.140000000000001 110.407 178.607 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 44' ' ' LYS . . . . . 0.483 ' O ' ' HG2' ' A' ' 48' ' ' GLU . 3.7 tppp? -68.84 -51.06 44.55 Favored 'General case' 0 N--CA 1.466 0.353 0 CA-C-N 115.934 -0.576 . . . . 63.130000000000003 110.074 -175.487 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 1.7 t -61.84 -33.6 74.46 Favored 'General case' 0 N--CA 1.486 1.328 0 C-N-CA 123.933 0.893 . . . . 60.32 111.786 -178.392 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -63.62 -47.69 80.35 Favored 'General case' 0 N--CA 1.482 1.165 0 C-N-CA 123.757 0.823 . . . . 72.120000000000005 111.41 174.926 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 47' ' ' LEU . . . . . 0.491 HD13 ' O ' ' A' ' 43' ' ' LEU . 9.2 mp -65.49 -41.22 93.49 Favored 'General case' 0 CA--C 1.554 1.118 0 CA-C-N 115.51 -0.768 . . . . 75.129999999999995 111.791 176.559 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 48' ' ' GLU . . . . . 0.483 ' HG2' ' O ' ' A' ' 44' ' ' LYS . 11.2 mm-40 -65.48 -41.96 92.73 Favored 'General case' 0 N--CA 1.482 1.161 0 C-N-CA 122.553 0.341 . . . . 75.239999999999995 110.839 -178.346 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 68.1 m -69.79 -28.01 65.38 Favored 'General case' 0 N--CA 1.485 1.315 0 C-N-CA 123.191 0.596 . . . . 63.32 112.037 177.725 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -75.66 -53.15 9.02 Favored 'General case' 0 N--CA 1.48 1.036 0 C-N-CA 122.891 0.476 . . . . 72.319999999999993 110.765 -178.15 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 51' ' ' PHE . . . . . . . . . . . . . 44.9 m-85 -77.55 -19.7 55.31 Favored 'General case' 0 N--CA 1.482 1.15 0 CA-C-N 115.176 -0.92 . . . . 71.319999999999993 112.569 -174.868 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -81.73 -26.66 34.37 Favored 'General case' 0 N--CA 1.489 1.516 0 C-N-CA 122.668 0.387 . . . . 63.130000000000003 111.654 176.223 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 4.5 t70 -85.43 -52.42 5.87 Favored 'General case' 0 CA--C 1.549 0.94 0 CA-C-O 121.268 0.556 . . . . 75.200000000000003 109.643 177.826 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 16.6 m-20 -135.49 102.94 5.29 Favored 'General case' 0 N--CA 1.48 1.056 0 C-N-CA 124.916 1.286 . . . . 71.349999999999994 109.575 177.176 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 6.6 tp-100 -69.04 -20.36 64.12 Favored 'General case' 0 CA--C 1.559 1.299 0 CA-C-O 121.283 0.563 . . . . 71.519999999999996 110.853 173.939 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 82.5 p -72.61 -29.37 63.43 Favored 'General case' 0 N--CA 1.482 1.129 0 C-N-CA 124.33 1.052 . . . . 74.209999999999994 112.55 174.9 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 17.9 m-85 -93.16 151.47 40.47 Favored Pre-proline 0 N--CA 1.489 1.504 0 C-N-CA 123.232 0.613 . . . . 75.409999999999997 112.648 -176.169 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 51.3 Cg_endo -80.95 174.64 10.72 Favored 'Trans proline' 0 C--N 1.384 2.441 0 C-N-CA 123.459 2.773 . . . . 62.420000000000002 112.224 173.976 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 74.4 Cg_endo -73.04 164.24 36.06 Favored 'Trans proline' 0 C--N 1.382 2.296 0 C-N-CA 121.924 1.749 . . . . 73.219999999999999 112.95 173.694 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 37.3 mt-10 -74.7 -27.4 60.37 Favored 'General case' 0 N--CA 1.488 1.468 0 C-N-CA 123.456 0.702 . . . . 74.040000000000006 111.681 -177.584 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 70.6 p . . . . . 0 C--O 1.251 1.166 0 C-N-CA 124.065 0.946 . . . . 38.18 110.203 179.879 . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 1' ' ' PHE . . . . . . . . . . . . . 74.8 t80 . . . . . 0 N--CA 1.491 1.603 0 N-CA-C 111.533 0.197 . . . . 53.229999999999997 111.533 . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 66.2 p -57.49 149.63 20.6 Favored 'General case' 0 N--CA 1.494 1.751 0 N-CA-C 112.066 0.395 . . . . 72.239999999999995 112.066 -179.173 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 3' ' ' LEU . . . . . 0.403 HD23 HD12 ' A' ' 6' ' ' LEU . 63.0 mt -57.33 -23.41 48.64 Favored 'General case' 0 N--CA 1.487 1.396 0 C-N-CA 123.828 0.851 . . . . 64.099999999999994 111.54 174.285 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 50.7 mm -66.79 -53.29 36.08 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.873 0 CA-C-N 115.155 -0.929 . . . . 72.329999999999998 110.339 172.83 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 48.2 mm-40 -64.45 -31.76 73.11 Favored 'General case' 0 N--CA 1.485 1.318 0 C-N-CA 123.546 0.738 . . . . 65.420000000000002 112.366 179.654 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 6' ' ' LEU . . . . . 0.403 HD12 HD23 ' A' ' 3' ' ' LEU . 92.9 mt -66.59 -45.33 79.57 Favored 'General case' 0 N--CA 1.481 1.085 0 C-N-CA 123.242 0.617 . . . . 43.43 110.923 173.935 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 40.9 tp -58.85 -43.28 90.75 Favored 'General case' 0 CA--C 1.551 1.004 0 C-N-CA 123.411 0.685 . . . . 72.109999999999999 111.488 175.378 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 96.6 mt -67.99 -47.36 79.26 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.866 0 C-N-CA 124.227 1.011 . . . . 71.340000000000003 112.927 179.626 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 8.3 p -64.67 -40.24 88.39 Favored 'Isoleucine or valine' 0 C--N 1.357 0.901 0 CA-C-N 118.44 0.563 . . . . 35.32 111.481 -177.812 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 76.6 t -66.67 -39.14 83.07 Favored 'Isoleucine or valine' 0 CA--C 1.555 1.141 0 C-N-CA 123.13 0.572 . . . . 73.109999999999999 111.026 173.827 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -64.91 -47.42 77.84 Favored 'General case' 0 N--CA 1.482 1.133 0 C-N-CA 122.941 0.497 . . . . 74.200000000000003 111.853 -179.84 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 12' ' ' ILE . . . . . 0.618 ' HA ' HD12 ' A' ' 15' ' ' ILE . 2.7 pp -68.89 -40.16 80.81 Favored 'Isoleucine or valine' 0 C--N 1.355 0.81 0 CA-C-O 119.042 -0.504 . . . . 72.319999999999993 111.416 -177.261 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 58.5 mt -60.92 -33.32 55.11 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.253 0 C-N-CA 123.564 0.746 . . . . 75.319999999999993 110.95 173.289 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -59.87 -43.44 98.01 Favored Glycine 0 C--N 1.352 1.444 0 CA-C-N 115.882 -0.599 . . . . 74.430000000000007 112.548 173.111 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 15' ' ' ILE . . . . . 0.618 HD12 ' HA ' ' A' ' 12' ' ' ILE . 18.7 mt -70.33 -43.94 77.97 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.738 0 C-N-CA 123.528 0.731 . . . . 74.019999999999996 111.066 178.455 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.513 ' HG ' ' O ' ' A' ' 12' ' ' ILE . 23.8 mt -57.62 -41.67 81.8 Favored 'General case' 0 N--CA 1.483 1.18 0 C-N-CA 123.346 0.658 . . . . 64.439999999999998 111.121 -177.996 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -70.72 -51.16 29.22 Favored 'General case' 0 N--CA 1.474 0.757 0 CA-C-O 121.239 0.543 . . . . 60.329999999999998 110.8 178.592 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -61.35 -21.59 64.15 Favored 'General case' 0 CA--C 1.55 0.979 0 N-CA-C 113.372 0.878 . . . . 73.219999999999999 113.372 -177.266 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 2.7 pp -94.2 -39.18 10.19 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.09 0 CA-C-N 118.004 0.366 . . . . 72.010000000000005 111.782 172.387 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -69.56 -52.78 23.03 Favored 'General case' 0 N--CA 1.485 1.295 0 N-CA-C 112.42 0.526 . . . . 62.509999999999998 112.42 -171.415 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 2.4 mp -54.51 -54.97 42.72 Favored Pre-proline 0 CA--C 1.568 1.641 0 CA-C-O 118.119 -0.943 . . . . 73.120000000000005 112.272 -176.722 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 29.0 Cg_endo -63.2 -42.75 21.44 Favored 'Trans proline' 0 C--N 1.381 2.282 0 C-N-CA 121.963 1.775 . . . . 74.150000000000006 113.64 176.823 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 46.9 tt0 -62.76 -42.29 99.61 Favored 'General case' 0 N--CA 1.486 1.366 0 C-N-CA 124.061 0.944 . . . . 75.510000000000005 110.996 -175.333 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 24' ' ' PHE . . . . . . . . . . . . . 44.4 m-85 -90.62 -25.68 20.02 Favored 'General case' 0 N--CA 1.482 1.128 0 CA-C-N 114.27 -1.332 . . . . 72.329999999999998 111.136 -174.764 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 43.9 t -63.62 -59.23 4.87 Favored 'General case' 0 N--CA 1.48 1.04 0 N-CA-C 108.644 -0.872 . . . . 52.450000000000003 108.644 170.069 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -55.84 -32.65 63.81 Favored 'General case' 0 N--CA 1.479 1.019 0 C-N-CA 123.841 0.856 . . . . 72.129999999999995 112.971 177.222 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 19.6 t80 -72.74 -49.6 30.02 Favored 'General case' 0 N--CA 1.486 1.353 0 C-N-CA 123.168 0.587 . . . . 62.43 111.822 -179.6 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 70.4 mtp180 -81.36 -16.19 53.05 Favored 'General case' 0 N--CA 1.48 1.072 0 C-N-CA 123.286 0.635 . . . . 62.539999999999999 111.62 -177.076 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 73.5 t -90.17 -32.43 5.52 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.635 0 C-N-CA 122.651 0.381 . . . . 74.420000000000002 110.828 175.365 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 19.3 ptmt -74.14 -23.83 59.33 Favored 'General case' 0 N--CA 1.488 1.464 0 N-CA-C 109.279 -0.637 . . . . 72.430000000000007 109.279 170.121 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -72.74 -36.56 67.77 Favored 'General case' 0 C--N 1.359 0.988 0 C-N-CA 122.778 0.431 . . . . 63.149999999999999 110.094 171.887 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 83.1 t80 -60.02 -56.41 22.05 Favored 'General case' 0 N--CA 1.478 0.926 0 CA-C-N 115.688 -0.687 . . . . 64.200000000000003 110.02 171.71 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 5.4 m-20 -55.49 -53.71 52.92 Favored 'General case' 0 N--CA 1.48 1.057 0 C-N-CA 124.505 1.122 . . . . 71.109999999999999 112.683 177.985 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 32.1 t -66.87 -52.33 44.8 Favored 'General case' 0 N--CA 1.492 1.63 0 C-N-CA 122.92 0.488 . . . . 62.219999999999999 111.811 -173.821 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -64.0 -42.51 97.14 Favored 'General case' 0 N--CA 1.475 0.82 0 CA-C-O 119.094 -0.479 . . . . 62.32 111.832 179.347 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -66.33 -48.38 70.45 Favored 'General case' 0 N--CA 1.495 1.825 0 N-CA-C 111.942 0.349 . . . . 64.040000000000006 111.942 -177.931 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 37' ' ' SER . . . . . 0.494 ' O ' ' HG2' ' A' ' 41' ' ' ARG . 70.9 m -63.38 -49.44 73.81 Favored 'General case' 0 N--CA 1.483 1.183 0 C-N-CA 123.284 0.634 . . . . 74.319999999999993 111.612 179.689 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 47.1 t -72.78 -26.63 61.6 Favored 'General case' 0 N--CA 1.486 1.365 0 N-CA-C 112.337 0.495 . . . . 63.119999999999997 112.337 -177.678 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 27.6 t70 -62.52 -49.79 73.94 Favored 'General case' 0 N--CA 1.482 1.131 0 C-N-CA 122.758 0.423 . . . . 64.019999999999996 111.206 171.514 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 0.417 ' HG ' ' O ' ' A' ' 37' ' ' SER . 4.0 pp -72.34 -21.92 61.25 Favored 'General case' 0 N--CA 1.488 1.44 0 CA-C-O 120.758 0.314 . . . . 72.310000000000002 111.315 -175.274 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 41' ' ' ARG . . . . . 0.494 ' HG2' ' O ' ' A' ' 37' ' ' SER . 27.1 mmt180 -80.1 -39.72 29.01 Favored 'General case' 0 N--CA 1.485 1.281 0 C-N-CA 123.13 0.572 . . . . 75.510000000000005 110.758 171.95 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 42' ' ' ASN . . . . . 0.411 ' O ' HG22 ' A' ' 45' ' ' THR . 61.1 t30 -68.02 -40.77 82.88 Favored 'General case' 0 N--CA 1.488 1.464 0 C-N-CA 123.534 0.734 . . . . 74.109999999999999 112.408 -178.095 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 4.3 pp -72.89 -29.87 63.49 Favored 'General case' 0 N--CA 1.485 1.318 0 O-C-N 122.083 -0.386 . . . . 52.539999999999999 110.727 177.025 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 44' ' ' LYS . . . . . 0.653 ' HE2' ' HB2' ' A' ' 57' ' ' TYR . 44.5 tttm -67.86 -40.22 83.68 Favored 'General case' 0 N--CA 1.471 0.612 0 C-N-CA 123.517 0.727 . . . . 64.420000000000002 109.81 174.708 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 45' ' ' THR . . . . . 0.54 ' HA ' ' HG2' ' A' ' 48' ' ' GLU . 0.9 OUTLIER -77.97 -31.49 50.82 Favored 'General case' 0 N--CA 1.483 1.18 0 CA-C-N 115.414 -0.812 . . . . 70.109999999999999 111.258 -171.501 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -63.57 -46.77 84.36 Favored 'General case' 0 CA--C 1.547 0.836 0 C-N-CA 123.986 0.914 . . . . 51.350000000000001 110.888 171.306 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 87.2 mt -67.83 -43.6 79.18 Favored 'General case' 0 N--CA 1.481 1.123 0 C-N-CA 123.729 0.811 . . . . 73.310000000000002 112.581 179.354 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 48' ' ' GLU . . . . . 0.54 ' HG2' ' HA ' ' A' ' 45' ' ' THR . 11.3 pt-20 -71.95 -26.74 62.4 Favored 'General case' 0 N--CA 1.483 1.207 0 O-C-N 122.153 -0.342 . . . . 43.130000000000003 111.395 -176.246 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 57.1 m -73.05 -30.0 63.39 Favored 'General case' 0 N--CA 1.49 1.559 0 C-N-CA 122.954 0.501 . . . . 73.5 111.209 169.823 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -76.52 -27.7 56.1 Favored 'General case' 0 N--CA 1.482 1.17 0 C-N-CA 124.151 0.981 . . . . 55.149999999999999 112.428 -176.41 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 51' ' ' PHE . . . . . . . . . . . . . 96.5 m-85 -107.69 -16.37 14.35 Favored 'General case' 0 N--CA 1.483 1.211 0 C-N-CA 123.965 0.906 . . . . 74.340000000000003 111.04 177.711 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . 71.29 -18.89 0.26 Allowed 'General case' 0 N--CA 1.5 2.054 0 C-N-CA 125.498 1.519 . . . . 73.430000000000007 115.079 177.454 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 32.7 t70 -95.97 -26.4 15.58 Favored 'General case' 0 CA--C 1.558 1.253 0 C-N-CA 123.71 0.804 . . . . 73.239999999999995 112.385 -172.323 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 24.3 t0 61.38 78.56 0.28 Allowed 'General case' 0 N--CA 1.486 1.35 0 C-N-CA 124.503 1.121 . . . . 73.540000000000006 112.329 -172.304 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 1.1 pm0 -109.0 10.87 26.15 Favored 'General case' 0 N--CA 1.484 1.241 0 CA-C-N 114.912 -1.04 . . . . 75.140000000000001 110.178 170.838 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 69.0 p -69.05 -60.31 2.44 Favored 'General case' 0 N--CA 1.482 1.159 0 C-N-CA 123.267 0.627 . . . . 74.519999999999996 110.026 177.464 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 57' ' ' TYR . . . . . 0.653 ' HB2' ' HE2' ' A' ' 44' ' ' LYS . 74.0 m-85 -144.06 104.41 4.81 Favored Pre-proline 0 CA--C 1.547 0.856 0 C-N-CA 125.127 1.371 . . . . 71.219999999999999 107.454 170.967 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 62.8 Cg_exo -43.29 140.85 3.51 Favored 'Trans proline' 0 C--N 1.385 2.477 0 C-N-CA 123.94 3.094 . . . . 74.319999999999993 113.701 176.161 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 19.8 Cg_exo -32.97 92.34 0.01 OUTLIER 'Trans proline' 0 C--N 1.395 3.015 1 C-N-CA 125.439 4.093 . . . . 61.530000000000001 116.14 -174.097 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 38.0 tt0 -72.81 -55.78 6.2 Favored 'General case' 0 CA--C 1.548 0.872 0 C-N-CA 124.005 0.922 . . . . 75.230000000000004 110.466 178.717 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 53.0 p . . . . . 0 CA--C 1.562 1.419 0 C-N-CA 124.431 1.092 . . . . 74.430000000000007 110.909 -179.907 . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 1' ' ' PHE . . . . . . . . . . . . . 33.9 p90 . . . . . 0 N--CA 1.485 1.305 0 N-CA-C 111.863 0.32 . . . . 71.239999999999995 111.863 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 2' ' ' THR . . . . . 0.603 HG22 ' H ' ' A' ' 4' ' ' ILE . 16.6 m -62.97 145.48 55.26 Favored 'General case' 0 N--CA 1.487 1.385 0 C-N-CA 124.076 0.95 . . . . 73.430000000000007 112.462 -174.085 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 49.7 tp -57.5 -26.51 61.41 Favored 'General case' 0 N--CA 1.483 1.179 0 C-N-CA 124.124 0.97 . . . . 71.540000000000006 111.808 175.649 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 4' ' ' ILE . . . . . 0.603 ' H ' HG22 ' A' ' 2' ' ' THR . 52.1 mm -67.37 -41.97 86.91 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.148 0 CA-C-N 115.959 -0.564 . . . . 75.319999999999993 110.717 175.622 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 5' ' ' GLU . . . . . 0.409 ' HA ' HD12 ' A' ' 8' ' ' ILE . 44.3 mt-10 -64.68 -36.35 84.0 Favored 'General case' 0 N--CA 1.488 1.461 0 C-N-CA 123.543 0.737 . . . . 64.129999999999995 111.123 175.854 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 6' ' ' LEU . . . . . 0.448 ' HA ' HG12 ' A' ' 9' ' ' VAL . 77.2 mt -69.11 -33.49 73.57 Favored 'General case' 0 N--CA 1.476 0.83 0 CA-C-N 115.524 -0.762 . . . . 74.219999999999999 111.296 174.289 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 26.9 tp -69.55 -33.35 72.64 Favored 'General case' 0 CA--C 1.56 1.327 0 C-N-CA 123.156 0.582 . . . . 74.420000000000002 111.346 174.522 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 8' ' ' ILE . . . . . 0.439 HG13 ' O ' ' A' ' 4' ' ' ILE . 77.8 mt -68.68 -49.39 65.0 Favored 'Isoleucine or valine' 0 C--N 1.363 1.178 0 C-N-CA 123.399 0.68 . . . . 71.150000000000006 111.412 175.935 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 9' ' ' VAL . . . . . 0.448 HG12 ' HA ' ' A' ' 6' ' ' LEU . 8.6 p -63.31 -38.1 81.23 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.972 0 C-N-CA 122.787 0.435 . . . . 61.119999999999997 111.852 -179.33 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 44.4 t -66.9 -36.57 77.49 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.064 0 C-N-CA 123.155 0.582 . . . . 75.209999999999994 111.889 172.418 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -66.94 -56.42 10.29 Favored 'General case' 0 N--CA 1.485 1.286 0 N-CA-C 111.821 0.304 . . . . 74.439999999999998 111.821 178.284 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 12' ' ' ILE . . . . . 0.526 ' O ' ' HG ' ' A' ' 16' ' ' LEU . 28.8 pt -59.9 -50.82 78.65 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.913 0 C-N-CA 122.992 0.517 . . . . 61.420000000000002 111.83 -175.473 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 81.4 mt -69.73 -31.12 47.33 Favored 'Isoleucine or valine' 0 C--N 1.36 1.064 0 C-N-CA 123.589 0.756 . . . . 63.229999999999997 110.092 -179.233 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -61.28 -34.27 87.56 Favored Glycine 0 C--N 1.349 1.284 0 CA-C-N 115.894 -0.594 . . . . 73.019999999999996 113.533 174.335 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 1.7 mp -79.85 -44.61 23.05 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.99 0 C-N-CA 122.934 0.494 . . . . 61.329999999999998 110.085 175.484 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.526 ' HG ' ' O ' ' A' ' 12' ' ' ILE . 31.9 mt -54.52 -42.64 71.06 Favored 'General case' 0 N--CA 1.488 1.43 0 C-N-CA 123.13 0.572 . . . . 74.140000000000001 111.324 -179.463 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -77.06 -48.73 17.03 Favored 'General case' 0 CA--C 1.55 0.969 0 C-N-CA 123.356 0.662 . . . . 75.420000000000002 111.378 179.337 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -55.78 -27.19 49.79 Favored 'General case' 0 N--CA 1.493 1.711 0 N-CA-C 113.182 0.808 . . . . 44.399999999999999 113.182 -178.863 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 2.8 pp -90.54 -35.85 7.71 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.105 0 N-CA-C 112.067 0.395 . . . . 71.5 112.067 173.097 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -67.63 -45.71 74.58 Favored 'General case' 0 N--CA 1.484 1.228 0 C-N-CA 123.224 0.609 . . . . 50.509999999999998 111.972 -172.639 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 1.9 mp -59.4 -52.98 70.46 Favored Pre-proline 0 CA--C 1.571 1.766 0 CA-C-O 118.486 -0.768 . . . . 60.399999999999999 112.478 -177.141 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 40.1 Cg_endo -66.66 -36.4 25.19 Favored 'Trans proline' 0 C--N 1.381 2.27 0 C-N-CA 121.911 1.74 . . . . 71.230000000000004 113.498 173.356 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 28.8 tt0 -66.58 -30.93 71.34 Favored 'General case' 0 N--CA 1.495 1.815 0 C-N-CA 123.133 0.573 . . . . 71.030000000000001 111.16 -178.096 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 24' ' ' PHE . . . . . . . . . . . . . 75.1 t80 -91.15 -40.13 11.75 Favored 'General case' 0 N--CA 1.489 1.482 0 CA-C-N 115.179 -0.919 . . . . 65.439999999999998 110.782 -176.6 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 25' ' ' SER . . . . . 0.442 ' O ' HG23 ' A' ' 29' ' ' VAL . 48.2 t -60.41 -55.47 33.15 Favored 'General case' 0 N--CA 1.479 1.003 0 C-N-CA 123.204 0.602 . . . . 64.450000000000003 110.051 174.669 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -64.7 -22.64 67.03 Favored 'General case' 0 N--CA 1.483 1.21 0 C-N-CA 123.74 0.816 . . . . 74.340000000000003 112.525 177.252 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 80.4 t80 -66.95 -47.59 71.17 Favored 'General case' 0 N--CA 1.48 1.063 0 CA-C-O 121.088 0.471 . . . . 64.25 110.206 172.92 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 19.9 mtp180 -72.41 -23.1 61.04 Favored 'General case' 0 N--CA 1.474 0.759 0 CA-C-N 115.196 -0.911 . . . . 65.0 111.173 179.806 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 29' ' ' VAL . . . . . 0.442 HG23 ' O ' ' A' ' 25' ' ' SER . 68.7 t -69.59 -50.79 47.43 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.184 0 N-CA-C 109.909 -0.404 . . . . 63.149999999999999 109.909 173.791 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 30' ' ' LYS . . . . . 0.469 ' HA ' ' HB3' ' A' ' 33' ' ' ASN . 14.7 ptmm? -75.71 -13.96 60.33 Favored 'General case' 0 N--CA 1.484 1.246 0 C-N-CA 122.862 0.465 . . . . 71.439999999999998 111.782 178.836 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -74.14 -40.69 62.45 Favored 'General case' 0 N--CA 1.481 1.088 0 CA-C-O 121.647 0.737 . . . . 65.109999999999999 109.593 172.393 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 32' ' ' TYR . . . . . 0.444 ' O ' ' HB3' ' A' ' 36' ' ' ALA . 36.2 t80 -85.77 -18.83 31.88 Favored 'General case' 0 N--CA 1.48 1.034 0 CA-C-N 115.068 -0.969 . . . . 73.310000000000002 111.582 -179.29 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 33' ' ' ASN . . . . . 0.469 ' HB3' ' HA ' ' A' ' 30' ' ' LYS . 27.8 t-20 -84.6 -63.24 1.37 Allowed 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 115.585 -0.734 . . . . 63.329999999999998 109.971 174.965 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 20.3 m -80.45 -51.46 8.79 Favored 'General case' 0 N--CA 1.487 1.409 0 CA-C-N 115.258 -0.883 . . . . 70.349999999999994 111.379 -166.539 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -70.21 -38.64 75.34 Favored 'General case' 0 N--CA 1.481 1.097 0 N-CA-C 111.613 0.227 . . . . 63.149999999999999 111.613 -178.281 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 36' ' ' ALA . . . . . 0.444 ' HB3' ' O ' ' A' ' 32' ' ' TYR . . . -69.82 -41.11 75.42 Favored 'General case' 0 N--CA 1.482 1.17 0 N-CA-C 111.425 0.157 . . . . 71.25 111.425 -179.07 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 68.0 m -67.38 -28.76 68.2 Favored 'General case' 0 N--CA 1.487 1.377 0 C-N-CA 122.45 0.3 . . . . 72.120000000000005 111.807 172.776 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 43.0 t -72.14 -37.88 69.34 Favored 'General case' 0 N--CA 1.484 1.256 0 C-N-CA 122.69 0.396 . . . . 44.340000000000003 111.128 176.399 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 33.1 m-20 -62.85 -49.05 76.42 Favored 'General case' 0 CA--C 1.544 0.72 0 C-N-CA 123.253 0.621 . . . . 75.239999999999995 111.084 170.013 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 73.5 mt -66.56 -32.69 74.2 Favored 'General case' 0 N--CA 1.487 1.405 0 C-N-CA 122.473 0.309 . . . . 62.530000000000001 111.066 -176.139 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 33.7 ttm180 -73.08 -47.68 42.42 Favored 'General case' 0 CA--C 1.537 0.444 0 C-N-CA 123.353 0.661 . . . . 74.099999999999994 110.016 177.871 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 66.2 t30 -62.71 -33.51 75.27 Favored 'General case' 0 N--CA 1.484 1.271 0 CA-C-N 115.436 -0.802 . . . . 63.5 112.162 179.748 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 91.7 mt -79.57 -37.8 35.56 Favored 'General case' 0 N--CA 1.481 1.1 0 C-N-CA 123.0 0.52 . . . . 72.209999999999994 110.717 179.938 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 44' ' ' LYS . . . . . 0.463 ' O ' ' HG2' ' A' ' 48' ' ' GLU . 0.8 OUTLIER -74.31 -43.54 56.33 Favored 'General case' 0 N--CA 1.476 0.845 0 N-CA-C 109.645 -0.502 . . . . 63.43 109.645 -176.077 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 3.0 t -65.82 -31.12 71.91 Favored 'General case' 0 N--CA 1.483 1.201 0 C-N-CA 123.428 0.691 . . . . 60.350000000000001 110.916 178.141 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -69.36 -31.92 70.65 Favored 'General case' 0 N--CA 1.479 1.001 0 CA-C-N 115.209 -0.905 . . . . 72.319999999999993 111.477 173.605 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 97.9 mt -67.45 -50.35 59.58 Favored 'General case' 0 N--CA 1.483 1.212 0 C-N-CA 122.768 0.427 . . . . 65.120000000000005 110.779 170.842 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 48' ' ' GLU . . . . . 0.463 ' HG2' ' O ' ' A' ' 44' ' ' LYS . 5.7 mm-40 -60.76 -35.05 75.44 Favored 'General case' 0 N--CA 1.493 1.702 0 C-N-CA 122.954 0.502 . . . . 73.25 110.797 -179.438 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 37.9 t -67.41 -58.77 4.16 Favored 'General case' 0 CA--C 1.54 0.583 0 CA-C-N 115.457 -0.792 . . . . 44.530000000000001 110.499 175.272 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 50' ' ' ALA . . . . . 0.472 ' O ' ' HB3' ' A' ' 54' ' ' ASP . . . -60.85 -38.13 84.46 Favored 'General case' 0 N--CA 1.487 1.415 0 C-N-CA 123.813 0.845 . . . . 74.099999999999994 112.17 -172.03 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 51' ' ' PHE . . . . . . . . . . . . . 2.7 m-85 -70.76 -35.64 72.72 Favored 'General case' 0 CA--C 1.542 0.65 0 CA-C-N 115.061 -0.972 . . . . 73.319999999999993 110.366 178.968 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -76.16 -51.8 11.39 Favored 'General case' 0 N--CA 1.48 1.053 0 N-CA-C 111.929 0.344 . . . . 55.100000000000001 111.929 -175.692 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 2.6 p30 -82.27 -38.07 24.96 Favored 'General case' 0 N--CA 1.482 1.137 0 N-CA-C 113.052 0.76 . . . . 54.409999999999997 113.052 -171.753 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 54' ' ' ASP . . . . . 0.472 ' HB3' ' O ' ' A' ' 50' ' ' ALA . 19.3 t70 -78.69 -74.04 0.3 Allowed 'General case' 0 N--CA 1.484 1.236 0 C-N-CA 122.911 0.484 . . . . 51.030000000000001 111.043 -178.397 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 23.5 pt20 -85.26 4.36 35.2 Favored 'General case' 0 N--CA 1.494 1.73 0 N-CA-C 113.291 0.849 . . . . 73.120000000000005 113.291 -174.302 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 6.7 m 65.37 28.21 11.78 Favored 'General case' 0 N--CA 1.494 1.742 0 C-N-CA 124.296 1.038 . . . . 74.099999999999994 112.158 171.52 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 44.8 t80 -103.18 92.39 3.76 Favored Pre-proline 0 N--CA 1.491 1.594 0 C-N-CA 123.975 0.91 . . . . 71.209999999999994 110.625 171.286 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 58' ' ' PRO . . . . . 0.46 ' HA ' ' HD3' ' A' ' 59' ' ' PRO . 81.3 Cg_endo -84.6 139.35 7.7 Favored 'Trans proline' 0 CA--C 1.563 1.926 0 C-N-CA 122.398 2.065 . . . . 64.310000000000002 112.519 174.341 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 59' ' ' PRO . . . . . 0.46 ' HD3' ' HA ' ' A' ' 58' ' ' PRO . 20.2 Cg_exo -65.37 94.45 0.25 Allowed 'Trans proline' 0 C--N 1.377 2.029 0 C-N-CA 122.969 2.446 . . . . 72.329999999999998 112.648 179.224 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 43.6 mt-10 55.46 28.38 11.57 Favored 'General case' 0 N--CA 1.494 1.759 0 C-N-CA 124.6 1.16 . . . . 75.349999999999994 113.738 176.721 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 33.9 t . . . . . 0 N--CA 1.494 1.727 0 C-N-CA 123.137 0.575 . . . . 71.230000000000004 111.566 -174.113 . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 1' ' ' PHE . . . . . . . . . . . . . 94.6 m-85 . . . . . 0 N--CA 1.492 1.641 0 N-CA-C 111.748 0.277 . . . . 73.140000000000001 111.748 . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 2' ' ' THR . . . . . 0.477 HG23 ' H ' ' A' ' 5' ' ' GLU . 4.1 t -116.01 142.85 46.24 Favored 'General case' 0 N--CA 1.488 1.449 0 C-N-CA 123.269 0.627 . . . . 73.140000000000001 110.982 -178.501 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 4.6 pp -63.36 -18.18 63.38 Favored 'General case' 0 N--CA 1.481 1.078 0 C-N-CA 123.942 0.897 . . . . 74.129999999999995 111.391 177.423 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 50.2 mm -64.06 -54.68 28.4 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.807 0 C-N-CA 123.436 0.695 . . . . 75.120000000000005 110.325 174.702 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 5' ' ' GLU . . . . . 0.477 ' H ' HG23 ' A' ' 2' ' ' THR . 42.7 mm-40 -66.84 -29.84 69.87 Favored 'General case' 0 N--CA 1.481 1.087 0 C-N-CA 122.958 0.503 . . . . 63.130000000000003 112.113 178.476 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 95.0 mt -67.62 -42.1 82.92 Favored 'General case' 0 N--CA 1.481 1.122 0 C-N-CA 122.966 0.507 . . . . 64.239999999999995 111.403 174.068 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -60.69 -50.37 73.76 Favored 'General case' 0 CA--C 1.555 1.172 0 C-N-CA 123.817 0.847 . . . . 65.349999999999994 109.962 176.283 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 96.5 mt -63.79 -46.37 94.61 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.869 0 C-N-CA 124.207 1.003 . . . . 55.020000000000003 112.603 -178.749 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 6.4 p -65.37 -38.83 83.49 Favored 'Isoleucine or valine' 0 CA--C 1.551 1.011 0 C-N-CA 122.694 0.398 . . . . 72.150000000000006 111.181 -178.482 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 8.9 t -66.12 -37.41 79.7 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.083 0 C-N-CA 123.403 0.681 . . . . 41.43 111.578 172.485 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -66.27 -51.68 55.05 Favored 'General case' 0 N--CA 1.48 1.031 0 C-N-CA 123.02 0.528 . . . . 51.43 111.546 -179.066 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 12' ' ' ILE . . . . . 0.545 ' HA ' HD12 ' A' ' 15' ' ' ILE . 20.8 pt -67.49 -44.71 86.5 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.935 0 C-N-CA 123.231 0.613 . . . . 73.230000000000004 111.823 -176.878 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 82.4 mt -64.37 -32.67 58.59 Favored 'Isoleucine or valine' 0 C--N 1.361 1.099 0 C-N-CA 123.614 0.766 . . . . 73.150000000000006 110.427 174.35 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -61.77 -36.95 93.5 Favored Glycine 0 C--N 1.349 1.291 0 CA-C-N 115.558 -0.746 . . . . 63.140000000000001 112.914 175.169 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 15' ' ' ILE . . . . . 0.545 HD12 ' HA ' ' A' ' 12' ' ' ILE . 22.9 mt -70.76 -42.91 77.62 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.904 0 C-N-CA 123.852 0.861 . . . . 74.519999999999996 110.705 175.343 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.508 ' HG ' ' O ' ' A' ' 12' ' ' ILE . 28.6 mt -60.99 -38.36 85.71 Favored 'General case' 0 N--CA 1.482 1.137 0 C-N-CA 123.361 0.664 . . . . 63.229999999999997 111.256 -179.948 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -74.36 -48.32 28.8 Favored 'General case' 0 CA--C 1.55 0.966 0 C-N-CA 123.218 0.607 . . . . 72.409999999999997 110.754 176.251 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -57.74 -22.83 48.85 Favored 'General case' 0 N--CA 1.487 1.379 0 N-CA-C 113.602 0.964 . . . . 61.140000000000001 113.602 -179.287 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 2.8 pp -94.79 -35.56 6.22 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.218 0 N-CA-C 112.07 0.396 . . . . 73.200000000000003 112.07 171.687 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -66.71 -46.66 74.83 Favored 'General case' 0 N--CA 1.484 1.275 0 C-N-CA 123.381 0.673 . . . . 74.25 112.471 -172.586 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 2.2 mp -61.78 -53.67 58.35 Favored Pre-proline 0 CA--C 1.574 1.881 0 CA-C-O 118.739 -0.648 . . . . 75.140000000000001 112.533 -177.053 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 34.3 Cg_endo -64.53 -37.53 37.58 Favored 'Trans proline' 0 C--N 1.384 2.411 0 C-N-CA 122.256 1.97 . . . . 74.209999999999994 113.523 175.013 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 26.0 tt0 -64.98 -38.89 92.45 Favored 'General case' 0 N--CA 1.487 1.381 0 C-N-CA 123.196 0.598 . . . . 50.229999999999997 110.502 -178.098 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 24' ' ' PHE . . . . . . . . . . . . . 72.8 t80 -81.99 -34.28 29.74 Favored 'General case' 0 N--CA 1.487 1.393 0 CA-C-N 114.998 -1.001 . . . . 72.049999999999997 110.291 -176.068 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 25' ' ' SER . . . . . 0.513 ' O ' HG23 ' A' ' 29' ' ' VAL . 48.4 t -53.76 -59.21 4.92 Favored 'General case' 0 N--CA 1.478 0.97 0 C-N-CA 123.108 0.563 . . . . 64.340000000000003 109.868 168.866 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -65.18 -21.32 66.75 Favored 'General case' 0 N--CA 1.482 1.132 0 C-N-CA 124.319 1.047 . . . . 72.200000000000003 112.784 179.302 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 57.4 t80 -72.37 -45.02 61.66 Favored 'General case' 0 N--CA 1.483 1.188 0 C-N-CA 123.06 0.544 . . . . 74.239999999999995 111.076 174.911 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 27.8 mmm180 -70.2 -25.86 63.61 Favored 'General case' 0 N--CA 1.482 1.153 0 C-N-CA 123.545 0.738 . . . . 73.319999999999993 110.334 176.366 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 29' ' ' VAL . . . . . 0.513 HG23 ' O ' ' A' ' 25' ' ' SER . 91.1 t -69.5 -48.02 68.81 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.152 0 CA-C-N 115.75 -0.659 . . . . 75.150000000000006 109.41 172.359 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 30' ' ' LYS . . . . . 0.517 ' O ' ' HB3' ' A' ' 34' ' ' SER . 55.9 mttp -66.44 -21.28 66.2 Favored 'General case' 0 N--CA 1.488 1.455 0 C-N-CA 123.293 0.637 . . . . 72.409999999999997 112.297 175.799 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -68.1 -53.05 28.23 Favored 'General case' 0 N--CA 1.473 0.685 0 O-C-N 121.893 -0.504 . . . . 75.109999999999999 109.685 171.719 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 62.9 t80 -69.2 -64.08 0.94 Allowed 'General case' 0 C--O 1.219 -0.53 0 CA-C-N 115.274 -0.875 . . . . 73.140000000000001 111.235 -177.435 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 2.8 m-20 -56.91 -55.43 34.69 Favored 'General case' 0 N--CA 1.482 1.137 0 C-N-CA 125.213 1.405 . . . . 53.32 113.518 -177.414 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 34' ' ' SER . . . . . 0.517 ' HB3' ' O ' ' A' ' 30' ' ' LYS . 44.1 t -73.76 -44.62 55.58 Favored 'General case' 0 N--CA 1.493 1.712 0 N-CA-C 111.685 0.254 . . . . 52.409999999999997 111.685 -170.486 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -68.18 -30.3 69.37 Favored 'General case' 0 N--CA 1.479 1.008 0 CA-C-O 119.596 -0.24 . . . . 71.099999999999994 111.445 176.856 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -64.48 -46.92 80.95 Favored 'General case' 0 N--CA 1.494 1.76 0 N-CA-C 111.908 0.336 . . . . 74.400000000000006 111.908 170.529 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 71.1 m -63.62 -41.94 98.24 Favored 'General case' 0 N--CA 1.489 1.504 0 C-N-CA 123.374 0.67 . . . . 45.229999999999997 111.742 -179.562 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 80.9 p -77.64 -26.45 50.47 Favored 'General case' 0 N--CA 1.48 1.043 0 C-N-CA 123.441 0.696 . . . . 50.409999999999997 111.638 -179.211 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 31.2 t70 -62.48 -51.62 66.74 Favored 'General case' 0 N--CA 1.479 0.998 0 C-N-CA 123.17 0.588 . . . . 55.340000000000003 110.011 169.265 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 95.3 mt -64.14 -36.92 85.61 Favored 'General case' 0 N--CA 1.479 1.004 0 CA-C-N 115.498 -0.774 . . . . 73.549999999999997 110.859 -178.266 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 20.6 tpt85 -66.98 -44.15 81.17 Favored 'General case' 0 CA--C 1.547 0.83 0 C-N-CA 123.788 0.835 . . . . 74.439999999999998 110.475 176.647 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 63.5 t30 -66.94 -35.46 80.04 Favored 'General case' 0 N--CA 1.482 1.132 0 C-N-CA 123.762 0.825 . . . . 74.310000000000002 111.591 179.739 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 92.2 mt -72.71 -36.9 67.91 Favored 'General case' 0 N--CA 1.482 1.171 0 C-N-CA 123.135 0.574 . . . . 73.129999999999995 110.18 177.665 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 23.2 tptm -73.59 -41.65 62.6 Favored 'General case' 0 CA--C 1.538 0.505 0 CA-C-O 121.383 0.611 . . . . 73.209999999999994 110.077 -174.18 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 5.1 t -73.62 -32.58 64.13 Favored 'General case' 0 CA--C 1.547 0.846 0 CA-C-N 115.899 -0.592 . . . . 71.129999999999995 111.876 -177.419 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -79.96 -60.67 2.25 Favored 'General case' 0 N--CA 1.482 1.169 0 C-N-CA 123.383 0.673 . . . . 74.219999999999999 111.938 179.889 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -65.14 -44.31 89.03 Favored 'General case' 0 N--CA 1.479 1.02 0 C-N-CA 123.038 0.535 . . . . 54.549999999999997 112.034 -175.616 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 56.8 mm-40 -73.9 -16.31 61.11 Favored 'General case' 0 N--CA 1.485 1.324 0 CA-C-N 118.215 0.462 . . . . 74.319999999999993 112.12 -177.837 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 36.8 t -71.13 -36.25 72.04 Favored 'General case' 0 N--CA 1.485 1.298 0 CA-C-O 121.048 0.451 . . . . 75.010000000000005 110.058 168.88 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -69.86 -40.66 75.62 Favored 'General case' 0 N--CA 1.48 1.03 0 C-N-CA 123.756 0.823 . . . . 70.530000000000001 111.152 178.681 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 51' ' ' PHE . . . . . 0.46 ' O ' ' HG2' ' A' ' 55' ' ' GLN . 60.5 m-85 -71.0 -41.96 70.24 Favored 'General case' 0 N--CA 1.478 0.967 0 CA-C-N 115.863 -0.608 . . . . 74.400000000000006 110.358 176.217 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -76.68 -0.11 22.34 Favored 'General case' 0 N--CA 1.495 1.783 0 C-N-CA 123.166 0.586 . . . . 70.430000000000007 112.344 -179.279 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 23.0 t70 -70.0 -48.05 59.7 Favored 'General case' 0 CA--C 1.553 1.08 0 C-N-CA 123.267 0.627 . . . . 75.129999999999995 110.236 170.201 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 9.5 m-20 -87.41 -62.18 1.56 Allowed 'General case' 0 N--CA 1.483 1.198 0 C-N-CA 123.579 0.752 . . . . 73.430000000000007 111.701 -176.218 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 55' ' ' GLN . . . . . 0.46 ' HG2' ' O ' ' A' ' 51' ' ' PHE . 10.2 pt20 -73.97 -16.79 61.07 Favored 'General case' 0 N--CA 1.49 1.574 0 C-N-CA 123.068 0.547 . . . . 41.420000000000002 112.368 -175.732 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 21.3 m 75.9 -45.42 0.53 Allowed 'General case' 0 N--CA 1.496 1.835 0 C-N-CA 125.734 1.613 . . . . 72.140000000000001 112.423 -177.718 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 75.4 t80 -67.43 118.84 60.58 Favored Pre-proline 0 CA--C 1.559 1.323 0 C-N-CA 124.758 1.223 . . . . 73.150000000000006 112.52 -179.48 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 59.0 Cg_endo -89.52 169.08 4.88 Favored 'Trans proline' 0 CA--C 1.562 1.921 0 C-N-CA 122.811 2.341 . . . . 70.219999999999999 110.821 162.822 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 21.8 Cg_exo -68.26 15.02 0.16 Allowed 'Trans proline' 0 N--CA 1.509 2.417 0 C-N-CA 122.729 2.286 . . . . 73.430000000000007 115.419 179.766 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 28.9 tt0 64.21 -75.39 0.04 OUTLIER 'General case' 0 CA--C 1.554 1.1 0 C-N-CA 125.76 1.624 . . . . 73.420000000000002 111.715 -176.583 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 32.3 t . . . . . 0 CA--C 1.563 1.452 0 CA-C-O 118.128 -0.939 . . . . 73.25 110.146 172.517 . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 1' ' ' PHE . . . . . . . . . . . . . 30.4 p90 . . . . . 0 N--CA 1.48 1.048 0 N-CA-C 111.712 0.264 . . . . 64.319999999999993 111.712 . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 2' ' ' THR . . . . . 0.477 HG23 ' H ' ' A' ' 5' ' ' GLU . 5.7 t -113.63 149.22 34.9 Favored 'General case' 0 N--CA 1.488 1.443 0 CA-C-O 121.207 0.527 . . . . 65.430000000000007 111.732 -175.222 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 3' ' ' LEU . . . . . 0.494 HD13 HD12 ' A' ' 6' ' ' LEU . 3.2 mm? -68.8 -17.99 64.11 Favored 'General case' 0 N--CA 1.479 0.995 0 CA-C-N 115.038 -0.983 . . . . 70.209999999999994 111.028 175.913 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 50.4 mm -65.05 -51.21 69.22 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.216 0 C-N-CA 123.194 0.598 . . . . 63.100000000000001 110.572 176.886 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 5' ' ' GLU . . . . . 0.477 ' H ' HG23 ' A' ' 2' ' ' THR . 18.9 mm-40 -62.76 -41.09 99.06 Favored 'General case' 0 N--CA 1.481 1.097 0 C-N-CA 123.001 0.52 . . . . 75.420000000000002 111.689 177.725 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 6' ' ' LEU . . . . . 0.494 HD12 HD13 ' A' ' 3' ' ' LEU . 90.9 mt -62.54 -37.33 85.69 Favored 'General case' 0 N--CA 1.489 1.524 0 C-N-CA 123.051 0.541 . . . . 73.409999999999997 111.96 174.182 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 34.4 tp -64.75 -41.15 96.13 Favored 'General case' 0 N--CA 1.476 0.861 0 C-N-CA 123.817 0.847 . . . . 51.399999999999999 111.736 178.504 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 93.4 mt -69.47 -43.81 80.44 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.768 0 C-N-CA 123.654 0.781 . . . . 74.209999999999994 111.226 178.333 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 82.9 t -61.92 -47.25 94.11 Favored 'Isoleucine or valine' 0 CA--C 1.556 1.18 0 C-N-CA 122.976 0.511 . . . . 63.329999999999998 111.465 176.041 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 2.5 p -68.07 -29.44 44.66 Favored 'Isoleucine or valine' 0 CA--C 1.556 1.179 0 C-N-CA 122.572 0.349 . . . . 74.109999999999999 111.6 179.656 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -70.75 -53.63 14.79 Favored 'General case' 0 C--N 1.365 1.258 0 C-N-CA 122.698 0.399 . . . . 70.099999999999994 111.164 177.558 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 12' ' ' ILE . . . . . 0.53 ' O ' ' HG ' ' A' ' 16' ' ' LEU . 21.4 pt -63.83 -42.14 94.87 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.101 0 C-N-CA 123.168 0.587 . . . . 65.319999999999993 111.794 -176.554 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 65.7 mt -66.08 -32.76 59.55 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.047 0 C-N-CA 123.697 0.799 . . . . 74.140000000000001 110.275 173.809 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -63.75 -32.78 85.32 Favored Glycine 0 C--N 1.351 1.412 0 CA-C-N 116.029 -0.532 . . . . 22.34 113.179 172.23 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 18.8 mm -72.55 -44.91 60.39 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.202 0 N-CA-C 109.216 -0.661 . . . . 73.340000000000003 109.216 175.116 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.53 ' HG ' ' O ' ' A' ' 12' ' ' ILE . 26.3 mt -59.77 -36.09 75.95 Favored 'General case' 0 N--CA 1.484 1.25 0 C-N-CA 123.655 0.782 . . . . 61.43 111.257 -179.316 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -70.62 -51.96 24.59 Favored 'General case' 0 N--CA 1.476 0.872 0 C-N-CA 123.232 0.613 . . . . 60.240000000000002 110.808 174.48 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -61.84 -22.9 65.9 Favored 'General case' 0 N--CA 1.481 1.095 0 N-CA-C 113.618 0.97 . . . . 60.32 113.618 -176.635 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 19' ' ' ILE . . . . . 0.404 HD12 ' N ' ' A' ' 20' ' ' ALA . 2.8 pp -92.4 -38.87 10.76 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.292 0 N-CA-C 111.835 0.309 . . . . 74.010000000000005 111.835 173.907 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 20' ' ' ALA . . . . . 0.404 ' N ' HD12 ' A' ' 19' ' ' ILE . . . -67.86 -43.39 79.55 Favored 'General case' 0 N--CA 1.485 1.323 0 N-CA-C 112.726 0.639 . . . . 65.230000000000004 112.726 -173.613 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 27.9 mt -61.06 -52.83 69.1 Favored Pre-proline 0 CA--C 1.563 1.454 0 CA-C-O 118.09 -0.957 . . . . 64.450000000000003 113.194 -177.071 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 46.2 Cg_endo -67.39 -35.78 22.58 Favored 'Trans proline' 0 C--N 1.377 2.077 0 CA-C-N 121.521 1.579 . . . . 74.409999999999997 112.956 173.765 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 29.3 tt0 -69.84 -31.08 68.75 Favored 'General case' 0 N--CA 1.483 1.201 0 CA-C-O 121.13 0.49 . . . . 63.520000000000003 111.106 -177.067 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 24' ' ' PHE . . . . . . . . . . . . . 16.4 t80 -95.22 -30.61 13.91 Favored 'General case' 0 N--CA 1.491 1.58 0 CA-C-N 115.796 -0.638 . . . . 74.409999999999997 110.781 -176.668 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 25' ' ' SER . . . . . 0.438 ' O ' HG23 ' A' ' 29' ' ' VAL . 41.6 t -57.02 -56.88 16.07 Favored 'General case' 0 N--CA 1.486 1.337 0 N-CA-C 109.87 -0.418 . . . . 70.219999999999999 109.87 165.446 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -67.26 -17.55 64.84 Favored 'General case' 0 N--CA 1.486 1.362 0 C-N-CA 123.965 0.906 . . . . 65.319999999999993 112.843 177.996 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 93.2 t80 -67.01 -46.71 73.69 Favored 'General case' 0 N--CA 1.485 1.306 0 C-N-CA 123.286 0.634 . . . . 73.219999999999999 110.273 171.422 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 39.9 mtt180 -70.91 -29.64 65.75 Favored 'General case' 0 N--CA 1.478 0.966 0 CA-C-N 115.716 -0.675 . . . . 71.340000000000003 110.591 177.225 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 29' ' ' VAL . . . . . 0.438 HG23 ' O ' ' A' ' 25' ' ' SER . 73.2 t -67.65 -54.08 26.09 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.409 0 CA-C-N 116.033 -0.53 . . . . 71.329999999999998 110.398 177.4 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 12.4 ptmm? -68.96 -21.45 64.18 Favored 'General case' 0 N--CA 1.479 0.999 0 CA-C-N 115.659 -0.701 . . . . 61.32 110.803 177.645 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -69.1 -39.27 79.08 Favored 'General case' 0 N--CA 1.482 1.171 0 O-C-N 121.931 -0.481 . . . . 75.519999999999996 110.114 173.551 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 92.9 t80 -66.42 -43.72 84.9 Favored 'General case' 0 N--CA 1.474 0.727 0 CA-C-N 115.539 -0.755 . . . . 65.430000000000007 111.769 -179.552 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 52.2 m-80 -83.87 -45.83 12.81 Favored 'General case' 0 N--CA 1.476 0.851 0 C-N-CA 123.627 0.771 . . . . 62.229999999999997 112.701 -175.233 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 30.3 t -77.6 -47.01 20.43 Favored 'General case' 0 N--CA 1.494 1.739 0 N-CA-C 111.49 0.182 . . . . 65.319999999999993 111.49 -171.506 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -62.28 -35.51 79.23 Favored 'General case' 0 N--CA 1.481 1.077 0 C-N-CA 122.473 0.309 . . . . 72.349999999999994 111.203 174.915 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -63.01 -49.89 72.88 Favored 'General case' 0 N--CA 1.486 1.343 0 O-C-N 123.418 0.449 . . . . 75.209999999999994 111.619 175.348 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 71.2 m -57.1 -38.68 73.74 Favored 'General case' 0 N--CA 1.491 1.59 0 C-N-CA 122.871 0.468 . . . . 71.030000000000001 112.2 -178.688 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 33.5 t -85.96 -31.59 22.0 Favored 'General case' 0 N--CA 1.487 1.397 0 C-N-CA 123.625 0.77 . . . . 61.240000000000002 112.648 -177.619 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 38.8 t70 -70.07 -44.61 68.77 Favored 'General case' 0 N--CA 1.48 1.052 0 CA-C-O 120.846 0.355 . . . . 71.109999999999999 110.616 176.406 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 97.0 mt -71.99 -27.53 62.81 Favored 'General case' 0 N--CA 1.475 0.79 0 CA-C-N 115.702 -0.681 . . . . 71.129999999999995 110.242 -178.732 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 20.5 tpp180 -71.63 -43.13 66.68 Favored 'General case' 0 N--CA 1.475 0.787 0 C-N-CA 123.604 0.762 . . . . 70.430000000000007 110.483 173.319 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 58.2 t30 -61.66 -44.07 97.65 Favored 'General case' 0 N--CA 1.486 1.335 0 C-N-CA 124.076 0.95 . . . . 72.5 111.944 177.218 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 94.6 mt -75.15 -33.11 61.48 Favored 'General case' 0 N--CA 1.479 1.001 0 CA-C-N 115.923 -0.581 . . . . 75.209999999999994 111.142 -179.05 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 44' ' ' LYS . . . . . 0.413 ' O ' ' HG2' ' A' ' 48' ' ' GLU . 22.4 ttmm -71.44 -48.1 51.63 Favored 'General case' 0 N--CA 1.475 0.799 0 N-CA-C 109.747 -0.464 . . . . 71.109999999999999 109.747 179.789 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 3.4 t -61.76 -36.0 79.76 Favored 'General case' 0 N--CA 1.484 1.256 0 C-N-CA 123.025 0.53 . . . . 55.100000000000001 111.197 -176.354 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -63.71 -50.49 68.96 Favored 'General case' 0 N--CA 1.477 0.879 0 C-N-CA 123.586 0.754 . . . . 60.210000000000001 111.634 175.397 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 8.3 mp -66.91 -42.05 86.08 Favored 'General case' 0 N--CA 1.488 1.473 0 C-N-CA 123.503 0.721 . . . . 73.299999999999997 112.715 -179.024 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 48' ' ' GLU . . . . . 0.413 ' HG2' ' O ' ' A' ' 44' ' ' LYS . 36.9 mm-40 -67.85 -45.8 73.57 Favored 'General case' 0 N--CA 1.477 0.886 0 C-N-CA 123.363 0.665 . . . . 73.010000000000005 110.755 -178.596 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 49' ' ' SER . . . . . 0.401 ' O ' ' HB2' ' A' ' 53' ' ' ASP . 62.3 m -66.07 -37.16 85.11 Favored 'General case' 0 N--CA 1.482 1.165 0 C-N-CA 122.626 0.37 . . . . 74.319999999999993 111.599 179.439 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -68.02 -49.63 60.31 Favored 'General case' 0 N--CA 1.489 1.512 0 C-N-CA 123.264 0.626 . . . . 73.209999999999994 112.135 179.113 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 51' ' ' PHE . . . . . . . . . . . . . 28.9 t80 -72.44 -28.81 63.17 Favored 'General case' 0 N--CA 1.484 1.263 0 C-N-CA 123.491 0.717 . . . . 72.120000000000005 111.563 -176.948 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -91.26 -11.65 37.51 Favored 'General case' 0 N--CA 1.488 1.461 0 C-N-CA 123.286 0.634 . . . . 54.200000000000003 112.208 177.997 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 53' ' ' ASP . . . . . 0.401 ' HB2' ' O ' ' A' ' 49' ' ' SER . 18.2 t70 -62.66 -50.49 70.98 Favored 'General case' 0 N--CA 1.484 1.246 0 C-N-CA 123.223 0.609 . . . . 74.430000000000007 109.93 175.846 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 35.0 t70 -136.82 99.68 4.1 Favored 'General case' 0 CA--C 1.551 0.992 0 CA-C-N 115.319 -0.855 . . . . 70.319999999999993 109.156 174.882 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 22.1 tt0 -124.34 24.06 8.12 Favored 'General case' 0 N--CA 1.487 1.389 0 C-N-CA 124.203 1.001 . . . . 61.229999999999997 109.731 -178.12 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 69.1 p -79.5 -5.96 55.94 Favored 'General case' 0 N--CA 1.485 1.305 0 C-N-CA 124.125 0.97 . . . . 74.400000000000006 113.106 -175.466 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 12.2 p90 -64.79 131.94 95.3 Favored Pre-proline 0 CA--C 1.563 1.477 0 C-N-CA 123.254 0.622 . . . . 73.540000000000006 110.866 179.037 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 23.8 Cg_exo -67.02 166.69 22.07 Favored 'Trans proline' 0 CA--C 1.565 2.037 0 C-N-CA 122.938 2.425 . . . . 64.310000000000002 112.779 173.323 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 36.3 Cg_endo -62.76 -1.99 3.13 Favored 'Trans proline' 0 C--N 1.387 2.566 0 C-N-CA 122.868 2.378 . . . . 74.430000000000007 114.849 174.612 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 45.2 mt-10 64.11 41.76 6.08 Favored 'General case' 0 N--CA 1.491 1.607 0 C-N-CA 125.081 1.352 . . . . 72.219999999999999 112.237 173.962 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 23.6 m . . . . . 0 N--CA 1.495 1.815 0 C-N-CA 125.514 1.526 . . . . 61.399999999999999 112.121 178.514 . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 1' ' ' PHE . . . . . . . . . . . . . 59.5 m-85 . . . . . 0 N--CA 1.485 1.322 0 CA-C-O 120.61 0.243 . . . . 73.120000000000005 110.707 . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 2' ' ' THR . . . . . 0.632 HG22 ' H ' ' A' ' 4' ' ' ILE . 36.7 m -108.13 134.7 50.64 Favored 'General case' 0 N--CA 1.484 1.226 0 C-N-CA 123.85 0.86 . . . . 70.239999999999995 110.93 -178.926 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 2.5 pt? -61.22 -17.46 53.36 Favored 'General case' 0 N--CA 1.49 1.57 0 C-N-CA 124.123 0.969 . . . . 75.010000000000005 113.202 179.175 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 4' ' ' ILE . . . . . 0.632 ' H ' HG22 ' A' ' 2' ' ' THR . 50.6 mm -86.17 -45.05 16.88 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.735 0 C-N-CA 123.369 0.668 . . . . 60.109999999999999 110.322 179.461 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 20.1 mm-40 -64.16 -33.77 76.55 Favored 'General case' 0 N--CA 1.481 1.08 0 C-N-CA 123.304 0.642 . . . . 72.209999999999994 111.799 -179.812 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 6' ' ' LEU . . . . . 0.4 ' HA ' HG12 ' A' ' 9' ' ' VAL . 3.5 pp -70.07 -34.0 72.64 Favored 'General case' 0 N--CA 1.477 0.921 0 O-C-N 123.156 0.285 . . . . 53.520000000000003 111.332 174.245 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -67.7 -37.69 82.63 Favored 'General case' 0 CA--C 1.561 1.398 0 C-N-CA 123.814 0.846 . . . . 74.120000000000005 110.904 176.759 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 87.4 mt -70.39 -49.37 54.09 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.707 0 C-N-CA 123.292 0.637 . . . . 62.399999999999999 111.99 178.996 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 9' ' ' VAL . . . . . 0.4 HG12 ' HA ' ' A' ' 6' ' ' LEU . 9.7 p -64.52 -39.66 86.36 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.901 0 C-N-CA 122.684 0.394 . . . . 74.329999999999998 111.789 -179.527 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 2.0 p -67.28 -30.0 47.71 Favored 'Isoleucine or valine' 0 CA--C 1.56 1.351 0 C-N-CA 122.435 0.294 . . . . 72.230000000000004 111.3 175.697 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -69.15 -52.76 24.89 Favored 'General case' 0 N--CA 1.483 1.219 0 C-N-CA 122.652 0.381 . . . . 54.130000000000003 111.583 177.533 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 12' ' ' ILE . . . . . 0.524 ' O ' ' HG ' ' A' ' 16' ' ' LEU . 21.3 pt -62.54 -41.5 92.24 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.967 0 C-N-CA 122.723 0.409 . . . . 71.129999999999995 111.46 -179.117 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 56.0 mt -62.15 -36.21 73.09 Favored 'Isoleucine or valine' 0 C--N 1.362 1.139 0 C-N-CA 124.277 1.031 . . . . 75.219999999999999 111.097 174.382 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -58.13 -36.43 81.94 Favored Glycine 0 C--N 1.355 1.596 0 O-C-N 123.553 0.533 . . . . 74.409999999999997 113.198 174.856 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 1.7 mp -75.98 -42.81 39.12 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.877 0 C-N-CA 123.06 0.544 . . . . 72.409999999999997 109.995 175.768 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.524 ' HG ' ' O ' ' A' ' 12' ' ' ILE . 37.9 mt -59.52 -36.59 76.4 Favored 'General case' 0 N--CA 1.489 1.488 0 C-N-CA 122.975 0.51 . . . . 71.530000000000001 112.006 -176.623 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -73.73 -52.43 13.23 Favored 'General case' 0 CA--C 1.546 0.826 0 C-N-CA 122.738 0.415 . . . . 62.020000000000003 110.228 175.143 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -53.87 -30.05 44.08 Favored 'General case' 0 N--CA 1.488 1.431 0 C-N-CA 124.226 1.01 . . . . 35.520000000000003 113.444 -178.168 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 19' ' ' ILE . . . . . 0.516 ' O ' ' HB3' ' A' ' 23' ' ' GLN . 2.8 pp -88.47 -35.94 8.55 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.297 0 N-CA-C 112.177 0.436 . . . . 73.040000000000006 112.177 175.501 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -71.74 -42.98 66.62 Favored 'General case' 0 N--CA 1.481 1.092 0 N-CA-C 112.872 0.693 . . . . 72.310000000000002 112.872 -170.985 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 1.9 mp -57.07 -54.13 57.83 Favored Pre-proline 0 CA--C 1.567 1.624 0 CA-C-O 118.723 -0.656 . . . . 64.530000000000001 111.591 -178.286 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 36.3 Cg_endo -64.72 -39.64 25.77 Favored 'Trans proline' 0 C--N 1.386 2.515 0 C-N-CA 121.493 1.462 . . . . 75.150000000000006 113.441 173.226 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 23' ' ' GLN . . . . . 0.516 ' HB3' ' O ' ' A' ' 19' ' ' ILE . 0.1 OUTLIER -64.94 -29.88 70.85 Favored 'General case' 0 N--CA 1.496 1.841 0 C-N-CA 122.77 0.428 . . . . 75.530000000000001 110.685 -175.669 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 24' ' ' PHE . . . . . . . . . . . . . 73.7 t80 -96.59 -37.94 10.17 Favored 'General case' 0 N--CA 1.485 1.276 0 CA-C-N 115.533 -0.758 . . . . 70.310000000000002 111.135 -173.61 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 25' ' ' SER . . . . . 0.456 ' O ' HG23 ' A' ' 29' ' ' VAL . 46.2 t -61.09 -57.51 12.25 Favored 'General case' 0 N--CA 1.477 0.884 0 N-CA-C 109.167 -0.679 . . . . 60.43 109.167 174.524 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -63.34 -22.02 66.62 Favored 'General case' 0 N--CA 1.482 1.159 0 C-N-CA 123.632 0.773 . . . . 64.230000000000004 112.658 177.275 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 27' ' ' TYR . . . . . 0.442 ' HB2' ' O ' ' A' ' 23' ' ' GLN . 75.7 t80 -67.23 -48.73 66.93 Favored 'General case' 0 N--CA 1.489 1.497 0 CA-C-O 121.278 0.561 . . . . 74.349999999999994 110.502 173.488 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 74.4 mtp180 -73.28 -27.27 61.46 Favored 'General case' 0 N--CA 1.472 0.643 0 CA-C-N 115.612 -0.722 . . . . 74.200000000000003 111.617 178.26 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 29' ' ' VAL . . . . . 0.456 HG23 ' O ' ' A' ' 25' ' ' SER . 55.5 t -73.62 -42.65 55.29 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.4 0 O-C-N 123.347 0.404 . . . . 73.519999999999996 110.494 178.636 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 30' ' ' LYS . . . . . 0.438 ' HG2' ' O ' ' A' ' 27' ' ' TYR . 11.7 ptmm? -68.59 -30.32 69.05 Favored 'General case' 0 N--CA 1.476 0.869 0 CA-C-N 116.311 -0.404 . . . . 74.109999999999999 110.147 177.29 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -80.09 -34.83 37.66 Favored 'General case' 0 N--CA 1.482 1.138 0 C-N-CA 122.903 0.481 . . . . 74.099999999999994 110.837 -179.3 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 39.8 t80 -72.26 -21.56 61.35 Favored 'General case' 0 N--CA 1.485 1.291 0 C-N-CA 123.544 0.738 . . . . 74.25 110.922 -179.282 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 2.9 m-20 -94.49 -45.72 7.3 Favored 'General case' 0 N--CA 1.478 0.929 0 C-N-CA 123.872 0.869 . . . . 75.109999999999999 111.658 175.025 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 42.4 t -65.33 -55.33 18.82 Favored 'General case' 0 N--CA 1.495 1.817 0 C-N-CA 122.835 0.454 . . . . 61.140000000000001 111.75 -176.63 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -62.23 -39.29 92.31 Favored 'General case' 0 N--CA 1.474 0.747 0 CA-C-N 115.954 -0.566 . . . . 61.219999999999999 111.578 179.152 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -61.29 -60.57 3.54 Favored 'General case' 0 N--CA 1.485 1.318 0 C-N-CA 123.158 0.583 . . . . 51.340000000000003 111.569 178.695 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 37.7 t -53.26 -50.54 64.62 Favored 'General case' 0 N--CA 1.479 1.007 0 C-N-CA 123.937 0.895 . . . . 50.140000000000001 111.913 -179.713 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 30.5 t -72.01 -29.8 64.56 Favored 'General case' 0 N--CA 1.478 0.952 0 N-CA-C 112.621 0.6 . . . . 62.229999999999997 112.621 -175.967 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 37.0 t70 -63.93 -49.73 71.44 Favored 'General case' 0 N--CA 1.484 1.245 0 C-N-CA 122.64 0.376 . . . . 74.450000000000003 111.075 172.69 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 88.3 mt -67.78 -35.48 78.75 Favored 'General case' 0 N--CA 1.481 1.118 0 CA-C-N 115.622 -0.717 . . . . 74.430000000000007 110.782 -174.981 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 99.6 mtt180 -70.66 -42.24 71.03 Favored 'General case' 0 N--CA 1.48 1.064 0 CA-C-N 115.054 -0.976 . . . . 73.439999999999998 110.681 175.363 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 65.2 t30 -64.75 -36.13 83.31 Favored 'General case' 0 N--CA 1.489 1.516 0 C-N-CA 123.462 0.705 . . . . 43.350000000000001 111.671 179.774 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 43' ' ' LEU . . . . . 0.447 ' O ' HD13 ' A' ' 47' ' ' LEU . 93.6 mt -76.64 -34.77 58.28 Favored 'General case' 0 N--CA 1.478 0.97 0 C-N-CA 122.976 0.511 . . . . 71.510000000000005 110.974 179.632 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 79.4 tttt -70.98 -48.29 54.13 Favored 'General case' 0 N--CA 1.472 0.658 0 N-CA-C 109.822 -0.436 . . . . 64.409999999999997 109.822 -178.396 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 6.2 t -65.47 -31.76 73.01 Favored 'General case' 0 N--CA 1.478 0.973 0 C-N-CA 123.863 0.865 . . . . 75.409999999999997 111.674 -177.481 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -61.63 -46.48 89.62 Favored 'General case' 0 N--CA 1.481 1.121 0 C-N-CA 124.024 0.93 . . . . 64.439999999999998 111.243 172.149 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 47' ' ' LEU . . . . . 0.447 HD13 ' O ' ' A' ' 43' ' ' LEU . 8.4 mp -66.92 -39.15 87.3 Favored 'General case' 0 N--CA 1.479 1.002 0 CA-C-N 115.622 -0.717 . . . . 72.219999999999999 111.675 176.326 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 49.8 mt-10 -66.95 -38.2 85.7 Favored 'General case' 0 N--CA 1.484 1.247 0 C-N-CA 122.872 0.469 . . . . 61.140000000000001 111.147 179.647 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 34.2 t -69.04 -27.61 65.81 Favored 'General case' 0 N--CA 1.479 1.011 0 C-N-CA 123.509 0.723 . . . . 41.310000000000002 111.145 175.393 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -74.83 -53.58 8.86 Favored 'General case' 0 N--CA 1.477 0.881 0 C-N-CA 123.283 0.633 . . . . 62.509999999999998 110.341 178.057 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 51' ' ' PHE . . . . . . . . . . . . . 57.9 m-85 -72.46 -14.52 61.7 Favored 'General case' 0 N--CA 1.487 1.377 0 C-N-CA 123.961 0.905 . . . . 63.5 112.466 -177.404 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -67.67 -19.11 65.14 Favored 'General case' 0 N--CA 1.486 1.357 0 C-N-CA 123.455 0.702 . . . . 72.420000000000002 111.731 172.31 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 20.5 t70 -78.41 -27.34 46.64 Favored 'General case' 0 CA--C 1.558 1.253 0 C-N-CA 123.548 0.739 . . . . 62.439999999999998 110.871 174.232 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 36.6 t70 65.63 91.41 0.08 Allowed 'General case' 0 CA--C 1.558 1.27 0 C-N-CA 125.397 1.479 . . . . 74.120000000000005 111.338 -176.112 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -89.94 -25.43 20.93 Favored 'General case' 0 N--CA 1.485 1.285 0 C-N-CA 123.904 0.882 . . . . 70.319999999999993 111.424 -176.406 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 47.4 p -122.27 78.16 1.47 Allowed 'General case' 0 N--CA 1.481 1.108 0 C-N-CA 123.517 0.727 . . . . 73.109999999999999 110.739 -179.444 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 48.4 p90 -65.98 143.85 98.59 Favored Pre-proline 0 N--CA 1.489 1.489 0 CA-C-N 115.71 -0.677 . . . . 74.340000000000003 111.088 175.163 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 70.3 Cg_endo -72.63 130.94 16.58 Favored 'Trans proline' 0 CA--C 1.566 2.082 0 C-N-CA 121.529 1.486 . . . . 75.439999999999998 111.775 175.149 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 16.3 Cg_exo -71.01 -179.43 3.47 Favored 'Trans proline' 0 C--N 1.376 2.011 0 C-N-CA 122.963 2.442 . . . . 73.450000000000003 112.913 174.132 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 31.2 mm-40 -62.65 129.93 42.75 Favored 'General case' 0 N--CA 1.483 1.2 0 C-N-CA 123.175 0.59 . . . . 54.32 111.826 179.906 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 39.4 t . . . . . 0 C--O 1.254 1.315 0 C-N-CA 123.866 0.866 . . . . 50.200000000000003 110.24 -179.465 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 2' ' ' THR . . . . . 0.57 HG23 ' H ' ' A' ' 5' ' ' GLU . 7.2 t . . . . . 0 N--CA 1.492 1.659 0 CA-C-O 121.179 0.514 . . . . 73.51 111.834 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 3' ' ' LEU . . . . . 0.577 HD13 HD12 ' A' ' 6' ' ' LEU . 4.3 mm? -61.23 -22.72 65.06 Favored 'General case' 0 N--CA 1.482 1.139 0 CA-C-N 115.743 -0.662 . . . . 72.3 111.147 174.802 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 1.5 mp -62.14 -45.73 98.08 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.427 0 C-N-CA 123.596 0.758 . . . . 54.54 110.474 177.338 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 5' ' ' GLU . . . . . 0.57 ' H ' HG23 ' A' ' 2' ' ' THR . 14.4 mm-40 -56.23 -47.32 78.7 Favored 'General case' 0 N--CA 1.484 1.244 0 C-N-CA 123.021 0.528 . . . . 74.14 111.422 174.856 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 6' ' ' LEU . . . . . 0.577 HD12 HD13 ' A' ' 3' ' ' LEU . 85.5 mt -64.08 -41.66 97.24 Favored 'General case' 0 N--CA 1.478 0.953 0 C-N-CA 123.436 0.694 . . . . 75.43 111.956 -179.759 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 90.9 mt -61.75 -45.43 93.94 Favored 'General case' 0 N--CA 1.48 1.067 0 C-N-CA 123.174 0.589 . . . . 73.21 111.82 177.672 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 87.1 mt -63.77 -47.94 88.73 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.801 0 C-N-CA 123.324 0.65 . . . . 63.21 112.235 176.998 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 50.3 t -62.01 -44.57 99.13 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.834 0 C-N-CA 123.38 0.672 . . . . 71.25 111.379 -178.953 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 40.2 t -67.82 -31.64 53.07 Favored 'Isoleucine or valine' 0 CA--C 1.555 1.173 0 C-N-CA 123.041 0.536 . . . . 54.12 111.355 176.427 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -68.5 -58.91 3.6 Favored 'General case' 0 N--CA 1.481 1.086 0 C-N-CA 122.44 0.296 . . . . 62.53 111.274 177.855 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 12' ' ' ILE . . . . . 0.545 ' O ' ' HG ' ' A' ' 16' ' ' LEU . 20.9 pt -60.58 -49.21 85.32 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.955 0 C-N-CA 123.464 0.706 . . . . 43.33 111.83 -176.387 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 71.3 mt -68.47 -30.41 47.4 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.934 0 C-N-CA 123.613 0.765 . . . . 73.21 110.665 178.994 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -61.04 -36.39 92.24 Favored Glycine 0 C--N 1.351 1.369 0 CA-C-N 115.938 -0.574 . . . . 42.54 112.968 175.256 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 17.4 mt -75.79 -45.92 36.9 Favored 'Isoleucine or valine' 0 C--N 1.354 0.795 0 C-N-CA 123.289 0.636 . . . . 62.52 110.11 176.194 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . 0.545 ' HG ' ' O ' ' A' ' 12' ' ' ILE . 36.5 mt -55.17 -43.25 74.13 Favored 'General case' 0 N--CA 1.485 1.294 0 O-C-N 124.055 0.847 . . . . 70.41 111.501 -178.81 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -75.1 -49.81 18.42 Favored 'General case' 0 N--CA 1.476 0.861 0 C-N-CA 123.071 0.548 . . . . 61.11 111.33 -177.857 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -55.28 -30.18 59.64 Favored 'General case' 0 N--CA 1.482 1.148 0 C-N-CA 123.665 0.786 . . . . 74.11 112.921 -178.037 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 2.8 pp -89.1 -37.52 10.11 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.974 0 N-CA-C 112.155 0.428 . . . . 71.23 112.155 173.624 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -65.96 -53.04 44.12 Favored 'General case' 0 N--CA 1.487 1.388 0 N-CA-C 113.052 0.76 . . . . 64.24 113.052 -171.093 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 2.4 mp -54.64 -56.3 28.65 Favored Pre-proline 0 CA--C 1.566 1.562 0 CA-C-O 118.629 -0.7 . . . . 72.3 112.494 -174.759 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 37.2 Cg_endo -65.31 -41.05 17.05 Favored 'Trans proline' 0 C--N 1.38 2.224 0 C-N-CA 121.576 1.517 . . . . 70.24 113.493 177.624 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 28.2 tt0 -63.87 -36.47 84.04 Favored 'General case' 0 N--CA 1.488 1.464 0 C-N-CA 123.369 0.668 . . . . 71.04 111.098 -176.13 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 24' ' ' PHE . . . . . . . . . . . . . 37.5 t80 -88.33 -36.24 16.74 Favored 'General case' 0 N--CA 1.485 1.31 0 CA-C-N 114.837 -1.074 . . . . 55.44 111.023 -174.84 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 31.3 t -60.3 -51.18 70.65 Favored 'General case' 0 N--CA 1.478 0.943 0 C-N-CA 122.991 0.517 . . . . 75.43 110.411 173.612 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -69.99 -21.29 63.24 Favored 'General case' 0 CA--C 1.551 0.998 0 CA-C-N 115.486 -0.779 . . . . 74.15 112.644 176.789 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 79.7 t80 -71.19 -48.47 51.41 Favored 'General case' 0 N--CA 1.488 1.427 0 C-N-CA 122.686 0.395 . . . . 54.41 110.995 175.361 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 73.5 mtp180 -67.62 -27.14 66.64 Favored 'General case' 0 N--CA 1.477 0.886 0 C-N-CA 123.015 0.526 . . . . 72.03 111.106 177.62 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 24.0 t -71.17 -49.03 51.37 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.892 0 CA-C-N 115.694 -0.685 . . . . 45.05 110.69 174.214 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 18.9 ptmt -70.73 -22.39 62.43 Favored 'General case' 0 N--CA 1.476 0.861 0 CA-C-O 119.427 -0.32 . . . . 71.11 111.024 -179.099 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -78.19 -36.57 47.21 Favored 'General case' 0 N--CA 1.48 1.052 0 CA-C-O 120.909 0.385 . . . . 72.41 110.132 176.501 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 88.6 t80 -63.76 -43.87 95.13 Favored 'General case' 0 C--O 1.218 -0.559 0 CA-C-N 115.059 -0.973 . . . . 75.4 109.935 174.652 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 82.5 m-20 -80.0 -31.82 39.72 Favored 'General case' 0 N--CA 1.484 1.247 0 C-N-CA 124.075 0.95 . . . . 70.41 112.608 -176.667 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 39.7 t -66.01 -51.56 57.19 Favored 'General case' 0 N--CA 1.492 1.662 0 C-N-CA 122.521 0.329 . . . . 64.55 110.235 173.907 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -65.91 -38.52 88.93 Favored 'General case' 0 CA--C 1.541 0.596 0 CA-C-N 115.596 -0.729 . . . . 53.15 111.706 177.505 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -61.95 -53.56 53.97 Favored 'General case' 0 N--CA 1.497 1.921 0 N-CA-C 112.3 0.481 . . . . 73.5 112.3 177.169 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 44.1 t -61.15 -49.48 77.07 Favored 'General case' 0 N--CA 1.483 1.186 0 C-N-CA 122.855 0.462 . . . . 52.53 111.282 179.466 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 64.4 m -66.4 -27.67 68.03 Favored 'General case' 0 N--CA 1.483 1.189 0 C-N-CA 123.312 0.645 . . . . 72.2 112.681 -178.621 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 32.1 t70 -63.17 -47.2 83.68 Favored 'General case' 0 N--CA 1.483 1.221 0 CA-C-O 121.336 0.589 . . . . 74.24 110.815 170.027 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 90.9 mt -74.28 -22.48 59.27 Favored 'General case' 0 N--CA 1.481 1.106 0 CA-C-N 115.274 -0.875 . . . . 74.23 112.188 -178.042 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 61.6 mtp180 -83.99 -60.8 1.99 Allowed 'General case' 0 N--CA 1.479 1.006 0 C-N-CA 123.457 0.703 . . . . 74.3 111.488 177.194 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 7.3 t30 -61.16 -38.46 86.54 Favored 'General case' 0 N--CA 1.483 1.223 0 C-N-CA 123.916 0.886 . . . . 61.11 112.988 -171.038 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 83.9 mt -78.22 -31.95 49.63 Favored 'General case' 0 N--CA 1.486 1.336 0 N-CA-C 111.654 0.242 . . . . 74.24 111.654 -178.99 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 40.6 ttmt -76.05 -44.96 36.68 Favored 'General case' 0 N--CA 1.474 0.76 0 C-N-CA 122.844 0.457 . . . . 45.43 110.519 -177.286 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 5.8 t -66.77 -32.84 74.4 Favored 'General case' 0 N--CA 1.478 0.951 0 CA-C-N 115.305 -0.861 . . . . 73.32 110.853 -179.736 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -67.2 -40.19 86.45 Favored 'General case' 0 N--CA 1.475 0.819 0 CA-C-N 114.98 -1.009 . . . . 74.03 111.557 172.964 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 8.0 tt -64.58 -47.01 80.27 Favored 'General case' 0 N--CA 1.482 1.14 0 C-N-CA 123.724 0.81 . . . . 70.2 110.465 176.218 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 40.3 mt-10 -65.55 -30.58 71.35 Favored 'General case' 0 N--CA 1.479 1.02 0 C-N-CA 123.54 0.736 . . . . 73.42 111.523 -179.444 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 23.5 t -81.01 -39.15 26.33 Favored 'General case' 0 N--CA 1.479 0.975 0 C-N-CA 123.012 0.525 . . . . 70.23 111.591 179.122 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -74.44 -36.72 63.39 Favored 'General case' 0 N--CA 1.486 1.344 0 C-N-CA 123.33 0.652 . . . . 71.02 111.724 -175.272 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 51' ' ' PHE . . . . . . . . . . . . . 88.4 m-85 . . . . . 0 N--CA 1.479 1.015 0 C-N-CA 124.044 0.938 . . . . 72.43 110.671 177.983 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 2.7 t . . . . . 0 N--CA 1.48 1.068 0 N-CA-C 110.207 -0.294 . . . . 74.02 110.207 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 83.1 mt -55.57 -25.24 37.05 Favored 'General case' 0 N--CA 1.482 1.173 0 C-N-CA 124.11 0.964 . . . . 73.34 112.168 -179.173 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 49.0 mm -64.72 -58.42 7.22 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.767 0 O-C-N 124.007 0.817 . . . . 62.35 110.798 178.733 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 18.3 mm-40 -67.95 -37.9 82.15 Favored 'General case' 0 N--CA 1.478 0.951 0 N-CA-C 111.912 0.338 . . . . 60.11 111.912 -176.359 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 70.6 mt -62.42 -41.6 98.81 Favored 'General case' 0 N--CA 1.485 1.296 0 C-N-CA 123.152 0.581 . . . . 63.21 111.973 176.249 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 37.6 tp -66.35 -39.45 89.2 Favored 'General case' 0 CA--C 1.549 0.939 0 C-N-CA 123.252 0.621 . . . . 62.11 111.82 178.165 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 83.4 mt -67.85 -44.03 85.66 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.873 0 C-N-CA 122.843 0.457 . . . . 75.01 111.789 176.957 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 53.6 t -60.44 -47.84 90.9 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.974 0 C-N-CA 123.157 0.583 . . . . 55.41 111.76 177.028 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 4.0 p -66.9 -29.24 45.64 Favored 'Isoleucine or valine' 0 CA--C 1.561 1.383 0 N-CA-C 111.636 0.235 . . . . 63.11 111.636 178.021 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -71.93 -51.8 20.34 Favored 'General case' 0 N--CA 1.483 1.177 0 C-N-CA 123.074 0.55 . . . . 62.45 111.899 178.515 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 12' ' ' ILE . . . . . 0.555 ' HA ' HD12 ' A' ' 15' ' ' ILE . 27.3 pt -64.69 -46.26 92.81 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.921 0 C-N-CA 123.141 0.577 . . . . 71.43 111.273 -175.805 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 81.9 mt -64.67 -29.31 47.0 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.093 0 C-N-CA 123.72 0.808 . . . . 75.2 110.642 176.405 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -61.26 -39.68 97.54 Favored Glycine 0 C--N 1.354 1.553 0 CA-C-N 116.0 -0.546 . . . . 44.32 112.843 172.515 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 15' ' ' ILE . . . . . 0.555 HD12 ' HA ' ' A' ' 12' ' ' ILE . 16.3 mt -73.38 -44.94 53.8 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.914 0 C-N-CA 123.618 0.767 . . . . 72.24 110.807 176.644 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . 0.52 ' HG ' ' O ' ' A' ' 12' ' ' ILE . 24.9 mt -59.06 -36.81 75.69 Favored 'General case' 0 N--CA 1.485 1.309 0 C-N-CA 123.4 0.68 . . . . 75.03 111.249 -177.315 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -70.53 -54.3 12.72 Favored 'General case' 0 CA--C 1.548 0.883 0 C-N-CA 123.131 0.572 . . . . 74.23 110.253 174.518 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -57.92 -21.35 43.26 Favored 'General case' 0 N--CA 1.48 1.035 0 N-CA-C 114.066 1.136 . . . . 51.34 114.066 -177.46 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 2.7 pp -97.54 -36.23 5.88 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.06 0 N-CA-C 112.283 0.475 . . . . 73.0 112.283 174.202 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -69.65 -45.87 67.44 Favored 'General case' 0 N--CA 1.49 1.538 0 N-CA-C 112.639 0.607 . . . . 74.01 112.639 -172.519 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 2.3 mp -57.93 -55.02 49.49 Favored Pre-proline 0 CA--C 1.571 1.759 0 CA-C-O 118.619 -0.705 . . . . 72.22 112.298 -179.177 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 55.6 Cg_endo -68.51 -34.98 18.68 Favored 'Trans proline' 0 C--N 1.383 2.382 0 C-N-CA 122.277 1.984 . . . . 74.1 114.025 177.538 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 26.5 tt0 -64.75 -36.93 85.89 Favored 'General case' 0 N--CA 1.49 1.568 0 CA-C-O 121.455 0.645 . . . . 71.15 110.274 -179.143 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 24' ' ' PHE . . . . . . . . . . . . . 58.4 t80 -86.55 -35.22 19.65 Favored 'General case' 0 N--CA 1.484 1.245 0 CA-C-N 114.636 -1.165 . . . . 75.13 110.763 -175.477 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . 0.446 ' O ' HG23 ' A' ' 29' ' ' VAL . 44.5 t -56.89 -55.28 36.52 Favored 'General case' 0 N--CA 1.478 0.93 0 C-N-CA 123.225 0.61 . . . . 74.42 110.319 169.985 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -61.65 -30.46 70.73 Favored 'General case' 0 N--CA 1.484 1.249 0 C-N-CA 124.26 1.024 . . . . 64.42 112.483 177.252 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 69.0 t80 -64.15 -51.69 62.66 Favored 'General case' 0 N--CA 1.478 0.926 0 C-N-CA 122.816 0.446 . . . . 71.43 110.154 175.342 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . 0.418 ' O ' ' HB2' ' A' ' 32' ' ' TYR . 80.7 mtp180 -67.49 -25.25 65.77 Favored 'General case' 0 N--CA 1.476 0.861 0 CA-C-N 115.429 -0.805 . . . . 74.53 111.796 179.709 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . 0.446 HG23 ' O ' ' A' ' 25' ' ' SER . 41.9 t -68.19 -54.49 21.71 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.393 0 O-C-N 123.43 0.456 . . . . 63.1 110.459 176.55 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.17 -24.38 64.06 Favored 'General case' 0 N--CA 1.478 0.926 0 CA-C-N 115.725 -0.671 . . . . 74.41 111.097 179.099 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -80.8 -31.39 35.68 Favored 'General case' 0 N--CA 1.484 1.24 0 C-N-CA 122.925 0.49 . . . . 70.24 110.783 -179.884 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 32' ' ' TYR . . . . . 0.418 ' HB2' ' O ' ' A' ' 28' ' ' ARG . 4.9 t80 -74.27 -19.19 60.58 Favored 'General case' 0 N--CA 1.484 1.268 0 C-N-CA 123.181 0.592 . . . . 71.44 110.372 177.897 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 17.9 m120 -91.94 -52.76 4.57 Favored 'General case' 0 N--CA 1.473 0.707 0 C-N-CA 123.721 0.808 . . . . 63.23 110.86 175.063 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 44.0 t -65.43 -59.37 4.08 Favored 'General case' 0 N--CA 1.484 1.259 0 C-N-CA 123.313 0.645 . . . . 65.34 111.683 -174.096 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -61.58 -40.54 95.14 Favored 'General case' 0 N--CA 1.479 0.977 0 N-CA-C 112.135 0.42 . . . . 74.42 112.135 -179.09 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -64.18 -46.42 84.06 Favored 'General case' 0 N--CA 1.485 1.294 0 C-N-CA 122.427 0.291 . . . . 62.24 111.015 -178.201 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 73.0 m -65.14 -44.01 90.01 Favored 'General case' 0 N--CA 1.476 0.839 0 CA-C-N 116.184 -0.462 . . . . 73.44 111.663 175.659 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 64.1 m -72.23 -35.36 68.84 Favored 'General case' 0 N--CA 1.484 1.256 0 N-CA-C 113.06 0.763 . . . . 72.24 113.06 -171.535 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 17.4 m-20 -64.1 -51.42 64.1 Favored 'General case' 0 N--CA 1.476 0.86 0 O-C-N 123.474 0.484 . . . . 63.45 110.339 170.53 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -64.24 -32.47 74.07 Favored 'General case' 0 N--CA 1.483 1.21 0 C-N-CA 123.021 0.529 . . . . 50.0 111.95 -176.115 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 88.6 mtm180 -79.78 -38.12 33.82 Favored 'General case' 0 N--CA 1.486 1.366 0 C-N-CA 122.787 0.435 . . . . 72.31 110.787 178.712 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 62.4 t30 -64.55 -35.91 82.51 Favored 'General case' 0 N--CA 1.49 1.536 0 C-N-CA 122.967 0.507 . . . . 72.52 111.192 175.425 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 96.2 mt -78.02 -35.99 49.22 Favored 'General case' 0 N--CA 1.48 1.043 0 C-N-CA 123.402 0.681 . . . . 74.45 110.985 179.058 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 6.2 tmmm? -72.02 -43.77 64.47 Favored 'General case' 0 N--CA 1.478 0.962 0 C-N-CA 122.74 0.416 . . . . 74.11 110.177 -177.955 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 2.0 t -67.22 -30.92 70.97 Favored 'General case' 0 N--CA 1.479 0.984 0 C-N-CA 123.781 0.832 . . . . 62.51 111.569 -179.892 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -63.59 -53.18 55.68 Favored 'General case' 0 N--CA 1.478 0.969 0 CA-C-N 115.37 -0.832 . . . . 61.41 111.038 173.817 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 10.8 mp -68.61 -27.02 65.66 Favored 'General case' 0 N--CA 1.487 1.418 0 C-N-CA 123.432 0.693 . . . . 74.23 112.111 177.297 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 9.5 tp10 -69.89 -51.44 33.13 Favored 'General case' 0 C--N 1.35 0.624 0 C-N-CA 124.348 1.059 . . . . 53.51 110.365 179.142 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 47.1 t -62.83 -36.58 83.67 Favored 'General case' 0 N--CA 1.481 1.092 0 C-N-CA 124.091 0.956 . . . . 65.35 111.756 177.207 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -61.97 -50.56 71.61 Favored 'General case' 0 N--CA 1.479 1.006 0 C-N-CA 123.638 0.775 . . . . 64.12 111.798 177.919 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 51' ' ' PHE . . . . . . . . . . . . . 32.5 t80 . . . . . 0 CA--C 1.56 1.331 0 C-N-CA 122.819 0.447 . . . . 73.41 111.348 178.552 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 2' ' ' THR . . . . . 0.544 HG23 ' H ' ' A' ' 5' ' ' GLU . 6.7 t . . . . . 0 N--CA 1.482 1.16 0 CA-C-O 121.236 0.541 . . . . 70.23 110.696 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 3' ' ' LEU . . . . . 0.468 ' HA ' HD12 ' A' ' 6' ' ' LEU . 9.2 mp -65.84 -17.43 64.64 Favored 'General case' 0 N--CA 1.478 0.958 0 CA-C-N 115.331 -0.849 . . . . 62.23 111.247 176.858 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 45.8 mm -67.86 -43.86 85.76 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.141 0 C-N-CA 123.136 0.574 . . . . 64.42 110.894 175.398 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 5' ' ' GLU . . . . . 0.544 ' H ' HG23 ' A' ' 2' ' ' THR . 25.6 mm-40 -58.86 -41.26 86.62 Favored 'General case' 0 N--CA 1.49 1.545 0 C-N-CA 123.089 0.555 . . . . 62.33 111.372 174.308 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 6' ' ' LEU . . . . . 0.468 HD12 ' HA ' ' A' ' 3' ' ' LEU . 71.5 mt -61.2 -47.48 85.95 Favored 'General case' 0 N--CA 1.482 1.134 0 C-N-CA 123.368 0.667 . . . . 72.52 111.223 175.13 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 60.4 tp -54.93 -42.94 72.88 Favored 'General case' 0 CA--C 1.554 1.104 0 C-N-CA 124.59 1.156 . . . . 74.24 112.238 176.305 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 94.8 mt -70.69 -40.54 77.07 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.091 0 C-N-CA 124.308 1.043 . . . . 73.31 111.993 178.88 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 46.1 t -62.52 -45.7 98.16 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.959 0 C-N-CA 123.325 0.65 . . . . 72.41 111.095 175.718 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 69.1 t -62.07 -36.79 76.16 Favored 'Isoleucine or valine' 0 CA--C 1.561 1.387 0 C-N-CA 123.281 0.633 . . . . 74.15 111.379 174.664 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -65.95 -51.6 57.12 Favored 'General case' 0 CA--C 1.553 1.081 0 C-N-CA 123.099 0.559 . . . . 73.33 112.276 178.688 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 12' ' ' ILE . . . . . 0.609 ' HA ' HD12 ' A' ' 15' ' ' ILE . 23.5 pt -68.41 -42.42 84.04 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.089 0 C-N-CA 123.159 0.584 . . . . 71.43 111.978 -175.199 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 79.3 mt -65.14 -32.68 59.34 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.028 0 C-N-CA 123.307 0.643 . . . . 75.03 110.51 174.807 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -60.82 -38.25 94.99 Favored Glycine 0 C--N 1.354 1.573 0 CA-C-N 115.831 -0.622 . . . . 71.44 112.833 174.992 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 15' ' ' ILE . . . . . 0.609 HD12 ' HA ' ' A' ' 12' ' ' ILE . 24.7 mt -69.87 -43.05 79.96 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.975 0 C-N-CA 123.877 0.871 . . . . 64.0 111.173 175.569 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . 0.492 ' HG ' ' O ' ' A' ' 12' ' ' ILE . 20.7 mt -63.95 -35.73 81.65 Favored 'General case' 0 N--CA 1.486 1.37 0 C-N-CA 122.969 0.508 . . . . 74.25 111.366 -178.766 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -73.24 -44.58 59.22 Favored 'General case' 0 N--CA 1.479 1.014 0 C-N-CA 123.216 0.606 . . . . 75.21 110.673 175.564 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -60.38 -28.56 68.31 Favored 'General case' 0 N--CA 1.483 1.209 0 C-N-CA 124.166 0.986 . . . . 55.3 113.267 -179.843 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 2.8 pp -89.75 -38.38 11.03 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.327 0 CA-C-N 118.101 0.41 . . . . 63.45 111.607 173.656 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -67.8 -54.42 19.22 Favored 'General case' 0 N--CA 1.487 1.386 0 N-CA-C 112.724 0.639 . . . . 63.43 112.724 -172.779 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 21.7 mt -53.07 -54.19 47.06 Favored Pre-proline 0 CA--C 1.566 1.576 0 N-CA-C 113.902 1.075 . . . . 73.15 113.902 -176.587 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 38.2 Cg_endo -65.66 -38.83 22.97 Favored 'Trans proline' 0 C--N 1.381 2.24 0 CA-C-N 121.636 1.62 . . . . 73.12 113.166 175.118 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 20.1 tt0 -62.98 -38.16 90.03 Favored 'General case' 0 N--CA 1.489 1.525 0 C-N-CA 123.462 0.705 . . . . 75.31 110.95 -177.102 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 24' ' ' PHE . . . . . . . . . . . . . 32.8 m-85 -91.9 -36.99 13.15 Favored 'General case' 0 N--CA 1.486 1.348 0 CA-C-N 115.046 -0.979 . . . . 72.41 111.746 -174.663 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 47.3 t -63.59 -46.75 84.41 Favored 'General case' 0 N--CA 1.492 1.639 0 CA-C-N 117.774 0.261 . . . . 70.14 111.189 173.777 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -67.14 -26.44 66.67 Favored 'General case' 0 N--CA 1.483 1.207 0 C-N-CA 122.909 0.484 . . . . 62.33 111.834 174.796 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 68.8 t80 -66.42 -55.15 17.14 Favored 'General case' 0 N--CA 1.485 1.284 0 C-N-CA 122.995 0.518 . . . . 74.44 111.131 178.897 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 35.6 ptt180 -65.45 -28.93 69.57 Favored 'General case' 0 N--CA 1.475 0.817 0 C-N-CA 123.473 0.709 . . . . 74.33 111.488 -175.841 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 78.6 t -77.35 -48.32 24.79 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.843 0 CA-C-N 115.976 -0.556 . . . . 63.03 110.422 179.085 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 15.1 pttp -67.79 -27.52 66.81 Favored 'General case' 0 N--CA 1.476 0.848 0 CA-C-N 116.171 -0.468 . . . . 72.4 110.557 178.709 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -81.28 -30.01 34.13 Favored 'General case' 0 C--N 1.366 1.292 0 N-CA-C 110.086 -0.339 . . . . 74.44 110.086 -179.798 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 62.2 t80 -62.75 -54.29 41.41 Favored 'General case' 0 C--N 1.352 0.7 0 CA-C-N 115.957 -0.565 . . . . 73.24 109.724 174.72 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 52.1 m-80 -69.35 -37.7 77.78 Favored 'General case' 0 N--CA 1.479 0.993 0 C-N-CA 123.637 0.775 . . . . 75.31 113.064 179.512 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 33.7 t -63.42 -55.89 20.65 Favored 'General case' 0 N--CA 1.498 1.953 0 CA-C-O 120.964 0.411 . . . . 34.21 111.502 178.734 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -68.12 -38.01 81.78 Favored 'General case' 0 CA--C 1.542 0.637 0 CA-C-N 115.435 -0.802 . . . . 74.13 112.027 -179.205 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -66.35 -52.79 43.42 Favored 'General case' 0 N--CA 1.499 1.983 0 N-CA-C 112.242 0.46 . . . . 62.44 112.242 179.735 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 50.7 m -58.16 -43.45 87.4 Favored 'General case' 0 N--CA 1.488 1.431 0 C-N-CA 123.1 0.56 . . . . 75.54 111.465 179.689 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 41.7 t -74.37 -32.08 62.62 Favored 'General case' 0 N--CA 1.481 1.121 0 CA-C-N 116.022 -0.535 . . . . 73.23 112.038 -179.275 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 24.1 t70 -59.09 -54.92 41.59 Favored 'General case' 0 N--CA 1.48 1.062 0 C-N-CA 122.926 0.49 . . . . 63.41 111.21 175.44 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 4.0 pp -75.4 -26.46 58.43 Favored 'General case' 0 N--CA 1.49 1.567 0 CA-C-N 116.125 -0.488 . . . . 74.13 111.455 -172.119 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 59.1 ttp180 -75.76 -40.99 54.41 Favored 'General case' 0 CA--C 1.545 0.785 0 C-N-CA 123.554 0.742 . . . . 75.03 110.87 175.788 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 64.1 t30 -67.62 -36.93 81.73 Favored 'General case' 0 N--CA 1.487 1.409 0 C-N-CA 123.301 0.641 . . . . 60.15 111.11 178.945 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 81.0 mt -73.3 -27.97 61.84 Favored 'General case' 0 N--CA 1.482 1.168 0 C-N-CA 122.891 0.476 . . . . 75.2 111.33 178.443 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . 0.463 ' HE3' ' HA ' ' A' ' 44' ' ' LYS . 0.1 OUTLIER -79.34 -44.72 21.01 Favored 'General case' 0 N--CA 1.469 0.506 0 C-N-CA 122.723 0.409 . . . . 61.34 110.215 -179.887 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 4.9 t -69.53 -34.43 74.24 Favored 'General case' 0 N--CA 1.48 1.033 0 O-C-N 123.715 0.634 . . . . 72.41 111.17 -177.637 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -69.1 -41.79 76.98 Favored 'General case' 0 N--CA 1.477 0.887 0 C-N-CA 123.718 0.807 . . . . 62.44 111.304 174.06 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 42.9 tp -66.32 -43.98 84.67 Favored 'General case' 0 N--CA 1.477 0.899 0 C-N-CA 123.481 0.712 . . . . 74.2 112.165 -179.78 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 12.9 pt-20 -74.05 -34.05 63.93 Favored 'General case' 0 N--CA 1.484 1.254 0 C-N-CA 122.798 0.439 . . . . 73.34 111.624 -177.199 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 79.4 p -72.32 -33.95 67.74 Favored 'General case' 0 N--CA 1.489 1.484 0 C-N-CA 122.725 0.41 . . . . 55.12 110.896 175.561 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -70.38 -41.91 72.44 Favored 'General case' 0 N--CA 1.479 0.986 0 CA-C-N 115.646 -0.706 . . . . 72.32 111.074 177.696 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 51' ' ' PHE . . . . . . . . . . . . . 69.7 t80 . . . . . 0 CA--C 1.553 1.059 0 C-N-CA 123.256 0.622 . . . . 74.44 110.67 179.998 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 55.1 m . . . . . 0 N--CA 1.476 0.845 0 N-CA-C 109.023 -0.732 . . . . 64.2 109.023 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 3' ' ' LEU . . . . . 0.506 HD13 HD12 ' A' ' 6' ' ' LEU . 3.3 mm? -62.27 -23.04 66.47 Favored 'General case' 0 N--CA 1.487 1.391 0 C-N-CA 123.192 0.597 . . . . 60.14 111.755 -177.594 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 47.8 mm -69.75 -49.37 58.42 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.118 0 C-N-CA 123.165 0.586 . . . . 72.32 110.475 171.397 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 40.8 mm-40 -59.35 -38.32 80.08 Favored 'General case' 0 N--CA 1.491 1.614 0 C-N-CA 123.337 0.655 . . . . 74.45 112.166 176.062 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 6' ' ' LEU . . . . . 0.506 HD12 HD13 ' A' ' 3' ' ' LEU . 78.6 mt -69.95 -39.75 75.84 Favored 'General case' 0 N--CA 1.48 1.033 0 C-N-CA 123.001 0.521 . . . . 72.45 111.31 176.883 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 2.1 tm? -60.01 -48.46 81.62 Favored 'General case' 0 CA--C 1.552 1.028 0 C-N-CA 123.632 0.773 . . . . 63.4 110.432 176.958 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 77.6 mt -68.84 -48.29 71.57 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.732 0 C-N-CA 123.997 0.919 . . . . 75.52 112.227 -177.568 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 7.1 p -60.57 -40.62 85.07 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.158 0 CA-C-N 118.22 0.463 . . . . 64.31 111.823 -178.29 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 54.0 t -67.16 -41.52 87.02 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.027 0 C-N-CA 123.328 0.651 . . . . 64.24 110.903 173.572 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -64.03 -52.43 59.5 Favored 'General case' 0 N--CA 1.484 1.242 0 C-N-CA 122.946 0.498 . . . . 63.35 111.987 -178.581 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 12' ' ' ILE . . . . . 0.51 ' O ' ' HG ' ' A' ' 16' ' ' LEU . 28.6 pt -64.09 -47.21 91.23 Favored 'Isoleucine or valine' 0 C--N 1.355 0.815 0 C-N-CA 123.362 0.665 . . . . 70.03 111.474 -175.817 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 79.0 mt -64.21 -31.04 51.8 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.054 0 C-N-CA 123.322 0.649 . . . . 63.04 110.443 177.929 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -65.26 -40.52 96.69 Favored Glycine 0 C--N 1.352 1.445 0 CA-C-N 115.714 -0.675 . . . . 74.14 112.9 174.084 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 22.4 mt -69.05 -44.77 80.91 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.052 0 C-N-CA 123.63 0.772 . . . . 61.03 110.833 175.382 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . 0.51 ' HG ' ' O ' ' A' ' 12' ' ' ILE . 16.3 mt -60.99 -37.14 81.44 Favored 'General case' 0 N--CA 1.48 1.047 0 C-N-CA 123.345 0.658 . . . . 72.34 111.043 -178.314 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -74.24 -49.33 23.73 Favored 'General case' 0 CA--C 1.551 1.002 0 C-N-CA 122.959 0.504 . . . . 74.33 110.944 176.352 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -55.82 -29.94 60.6 Favored 'General case' 0 N--CA 1.491 1.594 0 C-N-CA 124.017 0.927 . . . . 74.31 113.248 -178.787 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 2.8 pp -86.97 -37.66 11.44 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.833 0 CA-C-O 119.601 -0.237 . . . . 74.5 111.472 172.432 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -61.95 -53.98 48.06 Favored 'General case' 0 N--CA 1.487 1.411 0 C-N-CA 124.009 0.924 . . . . 75.12 113.274 -172.098 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 3.0 mp -56.46 -54.62 51.35 Favored Pre-proline 0 CA--C 1.572 1.817 0 CA-C-O 118.444 -0.789 . . . . 54.13 112.614 -175.094 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 36.7 Cg_endo -64.85 -39.33 26.0 Favored 'Trans proline' 0 C--N 1.381 2.268 0 C-N-CA 122.166 1.911 . . . . 75.22 113.305 176.385 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 5.1 tt0 -60.05 -43.55 95.3 Favored 'General case' 0 N--CA 1.489 1.512 0 C-N-CA 123.944 0.898 . . . . 65.51 110.523 -179.075 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 24' ' ' PHE . . . . . . . . . . . . . 16.0 m-85 -87.67 -28.28 21.92 Favored 'General case' 0 N--CA 1.485 1.324 0 CA-C-N 114.819 -1.082 . . . . 74.32 111.319 -172.281 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 74.3 m -59.62 -59.41 5.48 Favored 'General case' 0 N--CA 1.481 1.122 0 N-CA-C 109.549 -0.537 . . . . 74.22 109.549 167.264 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -62.0 -26.95 68.52 Favored 'General case' 0 N--CA 1.485 1.289 0 C-N-CA 124.02 0.928 . . . . 51.31 112.715 -179.714 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 27' ' ' TYR . . . . . 0.428 ' O ' ' HG2' ' A' ' 30' ' ' LYS . 57.3 t80 -70.03 -52.92 20.2 Favored 'General case' 0 N--CA 1.484 1.252 0 C-N-CA 123.476 0.71 . . . . 65.41 110.885 176.21 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 82.4 mtp180 -71.84 -20.68 61.79 Favored 'General case' 0 N--CA 1.475 0.81 0 CA-C-N 115.812 -0.631 . . . . 73.1 111.524 179.505 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 38.9 t -76.82 -44.51 32.68 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.445 0 C-N-CA 122.744 0.418 . . . . 64.21 110.397 174.996 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . 0.428 ' HG2' ' O ' ' A' ' 27' ' ' TYR . 17.1 ptmt -71.15 -26.79 63.14 Favored 'General case' 0 N--CA 1.479 1.001 0 O-C-N 123.391 0.432 . . . . 73.51 110.34 178.57 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -81.81 -32.88 31.07 Favored 'General case' 0 C--N 1.362 1.111 0 C-N-CA 123.059 0.544 . . . . 54.25 110.453 178.176 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 41.5 t80 -65.39 -46.23 80.89 Favored 'General case' 0 C--O 1.21 -0.996 0 N-CA-C 108.888 -0.782 . . . . 75.42 108.888 174.772 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 8.2 t30 -66.64 -45.07 80.22 Favored 'General case' 0 CA--C 1.547 0.832 0 C-N-CA 125.034 1.334 . . . . 74.4 111.982 177.294 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 42.4 t -63.99 -56.7 13.17 Favored 'General case' 0 N--CA 1.491 1.618 0 C-N-CA 123.27 0.628 . . . . 55.11 111.877 -179.094 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -65.91 -36.42 83.34 Favored 'General case' 0 N--CA 1.475 0.779 0 C-N-CA 123.139 0.576 . . . . 51.24 111.992 -179.248 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -69.47 -40.75 76.91 Favored 'General case' 0 N--CA 1.496 1.83 0 CA-C-N 117.764 0.256 . . . . 71.11 111.639 177.954 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 47.2 t -62.59 -44.58 95.96 Favored 'General case' 0 N--CA 1.484 1.242 0 C-N-CA 123.155 0.582 . . . . 72.22 110.816 175.375 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 70.9 m -71.04 -26.4 63.07 Favored 'General case' 0 N--CA 1.483 1.207 0 C-N-CA 122.942 0.497 . . . . 72.2 111.853 178.303 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 28.2 t70 -66.31 -51.17 60.05 Favored 'General case' 0 CA--C 1.551 0.993 0 C-N-CA 123.252 0.621 . . . . 73.14 110.416 172.929 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 4.0 pp -78.25 -18.34 55.48 Favored 'General case' 0 N--CA 1.49 1.569 0 N-CA-C 112.082 0.401 . . . . 63.44 112.082 -174.853 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 41' ' ' ARG . . . . . 0.413 ' HA ' ' HD3' ' A' ' 41' ' ' ARG . 26.9 mmt180 -84.13 -59.49 2.39 Favored 'General case' 0 N--CA 1.48 1.06 0 CA-C-O 118.93 -0.557 . . . . 74.53 112.113 172.695 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 49.5 t-20 -60.56 -42.6 96.95 Favored 'General case' 0 N--CA 1.497 1.887 0 C-N-CA 123.034 0.534 . . . . 62.35 111.824 -174.432 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . 0.439 ' O ' HD23 ' A' ' 47' ' ' LEU . 96.7 mt -75.08 -28.25 60.24 Favored 'General case' 0 N--CA 1.486 1.335 0 C-N-CA 122.43 0.292 . . . . 73.51 111.471 -175.312 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 29.4 ttpp -79.42 -48.1 14.56 Favored 'General case' 0 N--CA 1.474 0.765 0 N-CA-C 109.664 -0.495 . . . . 74.34 109.664 178.613 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 3.9 t -70.22 -27.21 64.29 Favored 'General case' 0 N--CA 1.487 1.424 0 C-N-CA 124.174 0.99 . . . . 71.11 112.071 -174.455 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -60.92 -50.77 72.08 Favored 'General case' 0 N--CA 1.478 0.97 0 O-C-N 123.74 0.65 . . . . 72.24 110.914 173.146 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 47' ' ' LEU . . . . . 0.439 HD23 ' O ' ' A' ' 43' ' ' LEU . 4.2 mm? -65.68 -36.16 82.84 Favored 'General case' 0 N--CA 1.487 1.41 0 C-N-CA 123.609 0.763 . . . . 73.51 111.569 175.98 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 48.7 mt-10 -68.04 -33.75 75.16 Favored 'General case' 0 N--CA 1.483 1.211 0 C-N-CA 122.968 0.507 . . . . 74.11 111.499 176.579 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 44.1 t -83.08 -23.16 33.22 Favored 'General case' 0 N--CA 1.485 1.302 0 C-N-CA 123.313 0.645 . . . . 43.33 111.84 177.736 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -79.0 -30.13 44.09 Favored 'General case' 0 N--CA 1.486 1.331 0 C-N-CA 123.6 0.76 . . . . 51.51 112.551 -175.268 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 51' ' ' PHE . . . . . . . . . . . . . 78.1 t80 . . . . . 0 N--CA 1.477 0.898 0 C-N-CA 123.434 0.694 . . . . 64.42 110.135 -177.966 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 31.4 p . . . . . 0 N--CA 1.483 1.201 0 CA-C-O 121.032 0.444 . . . . 72.01 111.822 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 3.3 mm? -64.63 -19.29 65.6 Favored 'General case' 0 N--CA 1.484 1.255 0 CA-C-N 115.574 -0.739 . . . . 62.4 111.05 171.931 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 49.6 mm -73.64 -48.57 39.93 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.026 0 C-N-CA 123.163 0.585 . . . . 54.03 110.668 178.878 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 47.1 mt-10 -56.64 -44.35 81.18 Favored 'General case' 0 N--CA 1.489 1.49 0 C-N-CA 123.396 0.679 . . . . 74.31 111.267 175.971 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 82.3 mt -59.18 -47.0 86.94 Favored 'General case' 0 N--CA 1.481 1.106 0 C-N-CA 123.439 0.696 . . . . 72.4 111.579 174.213 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 37.1 tp -56.7 -40.37 75.49 Favored 'General case' 0 CA--C 1.549 0.926 0 C-N-CA 123.454 0.701 . . . . 73.14 112.138 178.706 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 82.4 mt -66.52 -50.43 66.9 Favored 'Isoleucine or valine' 0 C--N 1.355 0.825 0 C-N-CA 123.972 0.909 . . . . 72.52 111.275 178.458 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 86.8 t -58.25 -44.11 87.31 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.974 0 C-N-CA 123.583 0.753 . . . . 75.03 111.343 179.18 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 70.0 t -67.07 -36.15 76.28 Favored 'Isoleucine or valine' 0 CA--C 1.554 1.121 0 C-N-CA 122.896 0.478 . . . . 75.24 111.695 176.429 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -67.18 -53.55 29.35 Favored 'General case' 0 N--CA 1.483 1.188 0 C-N-CA 122.607 0.363 . . . . 75.52 111.325 179.991 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 12' ' ' ILE . . . . . 0.628 HG13 HD12 ' A' ' 13' ' ' ILE . 33.4 pt -64.1 -48.4 86.0 Favored 'Isoleucine or valine' 0 CA--C 1.554 1.107 0 C-N-CA 123.439 0.696 . . . . 61.25 111.651 -175.829 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 13' ' ' ILE . . . . . 0.628 HD12 HG13 ' A' ' 12' ' ' ILE . 1.8 mp -64.84 -32.97 60.41 Favored 'Isoleucine or valine' 0 C--N 1.372 1.566 0 C-N-CA 123.066 0.546 . . . . 75.11 109.986 175.479 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -59.53 -37.63 92.44 Favored Glycine 0 C--N 1.352 1.424 0 O-C-N 123.578 0.549 . . . . 63.43 113.328 177.641 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 18.5 mt -72.12 -44.65 64.93 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.989 0 C-N-CA 123.372 0.669 . . . . 65.31 110.784 176.043 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . 0.521 ' HG ' ' O ' ' A' ' 12' ' ' ILE . 22.7 mt -59.63 -37.89 79.87 Favored 'General case' 0 N--CA 1.488 1.442 0 C-N-CA 123.428 0.691 . . . . 72.33 111.136 179.41 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -74.1 -48.7 27.9 Favored 'General case' 0 N--CA 1.474 0.754 0 C-N-CA 123.603 0.761 . . . . 52.52 110.918 178.498 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -56.41 -27.76 57.45 Favored 'General case' 0 N--CA 1.486 1.33 0 C-N-CA 123.91 0.884 . . . . 71.2 112.803 -178.176 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 2.8 pp -91.39 -37.92 9.82 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.175 0 N-CA-C 112.035 0.383 . . . . 64.23 112.035 172.89 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -66.93 -50.1 63.45 Favored 'General case' 0 N--CA 1.489 1.498 0 N-CA-C 113.141 0.793 . . . . 75.31 113.141 -171.089 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 2.5 mp -59.35 -54.24 58.11 Favored Pre-proline 0 CA--C 1.567 1.623 0 CA-C-O 118.534 -0.746 . . . . 74.24 112.509 -175.392 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 30.2 Cg_endo -63.44 -39.74 35.05 Favored 'Trans proline' 0 C--N 1.384 2.43 0 C-N-CA 121.921 1.747 . . . . 64.44 113.43 176.514 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 8.9 tt0 -64.88 -37.29 87.13 Favored 'General case' 0 N--CA 1.483 1.199 0 CA-C-N 115.366 -0.834 . . . . 75.3 110.566 -177.04 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 24' ' ' PHE . . . . . . . . . . . . . 71.6 t80 -83.05 -36.86 24.6 Favored 'General case' 0 N--CA 1.484 1.234 0 CA-C-N 114.701 -1.136 . . . . 73.34 110.898 -176.243 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 40.6 t -57.39 -44.69 84.71 Favored 'General case' 0 N--CA 1.48 1.053 0 C-N-CA 123.139 0.575 . . . . 53.01 110.941 172.108 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -72.57 -32.8 66.3 Favored 'General case' 0 N--CA 1.477 0.907 0 CA-C-N 115.878 -0.601 . . . . 64.34 111.873 176.077 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 76.5 t80 -68.48 -47.44 67.06 Favored 'General case' 0 N--CA 1.493 1.684 0 C-N-CA 124.135 0.974 . . . . 75.54 112.223 -176.437 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 10.4 ptm180 -75.2 -24.72 57.82 Favored 'General case' 0 N--CA 1.475 0.802 0 CA-C-N 115.303 -0.862 . . . . 64.3 110.914 -175.274 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 86.2 t -84.01 -34.14 9.84 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.555 0 CA-C-O 121.143 0.497 . . . . 51.31 109.966 175.851 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 30.0 tttt -61.77 -35.28 77.67 Favored 'General case' 0 CA--C 1.546 0.823 0 C-N-CA 123.703 0.801 . . . . 74.12 110.172 167.301 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -68.72 -39.45 80.4 Favored 'General case' 0 N--CA 1.48 1.07 0 C-N-CA 123.239 0.616 . . . . 31.32 110.724 178.111 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 76.0 t80 -59.16 -59.7 5.04 Favored 'General case' 0 C--O 1.212 -0.871 0 CA-C-N 115.714 -0.675 . . . . 75.4 110.084 173.908 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 3.9 m-20 -56.8 -44.15 81.66 Favored 'General case' 0 N--CA 1.486 1.325 0 C-N-CA 124.06 0.944 . . . . 73.44 113.128 -179.512 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 46.9 t -68.04 -57.16 6.59 Favored 'General case' 0 N--CA 1.487 1.401 0 C-N-CA 123.289 0.635 . . . . 64.4 110.842 -177.151 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -65.9 -36.14 82.57 Favored 'General case' 0 N--CA 1.48 1.037 0 N-CA-C 112.3 0.482 . . . . 72.23 112.3 -178.758 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -69.08 -47.83 64.26 Favored 'General case' 0 N--CA 1.495 1.803 0 N-CA-C 111.921 0.341 . . . . 51.32 111.921 179.175 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 67.3 m -69.23 -33.26 73.0 Favored 'General case' 0 N--CA 1.486 1.372 0 C-N-CA 122.62 0.368 . . . . 63.13 111.762 179.179 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 32.2 t -78.96 -26.14 43.51 Favored 'General case' 0 N--CA 1.486 1.342 0 C-N-CA 123.071 0.549 . . . . 42.52 111.339 178.284 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 27.1 t70 -67.63 -48.27 67.21 Favored 'General case' 0 N--CA 1.476 0.865 0 C-N-CA 123.146 0.578 . . . . 74.01 110.123 169.165 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 92.2 mt -67.13 -30.97 71.11 Favored 'General case' 0 N--CA 1.483 1.193 0 C-N-CA 123.144 0.578 . . . . 64.33 110.974 -179.497 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 50.1 ttm-85 -71.78 -45.79 60.45 Favored 'General case' 0 CA--C 1.541 0.626 0 C-N-CA 123.269 0.628 . . . . 74.41 110.266 175.178 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 63.3 t30 -64.28 -39.76 94.58 Favored 'General case' 0 N--CA 1.482 1.139 0 C-N-CA 123.605 0.762 . . . . 75.44 111.863 -179.047 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 93.9 mt -75.91 -30.93 58.93 Favored 'General case' 0 N--CA 1.479 1.009 0 C-N-CA 123.247 0.619 . . . . 74.31 111.292 179.889 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 23.8 ttmm -73.55 -47.52 40.13 Favored 'General case' 0 N--CA 1.477 0.918 0 C-N-CA 123.039 0.536 . . . . 75.02 110.21 -178.483 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 3.6 t -68.69 -32.83 72.92 Favored 'General case' 0 N--CA 1.475 0.811 0 CA-C-N 114.592 -1.185 . . . . 75.41 111.362 -178.436 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -70.68 -43.6 68.74 Favored 'General case' 0 N--CA 1.474 0.727 0 CA-C-N 115.356 -0.838 . . . . 74.11 111.236 173.791 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 14.4 tp -70.52 -37.23 74.1 Favored 'General case' 0 N--CA 1.487 1.377 0 C-N-CA 123.108 0.563 . . . . 54.04 111.611 -175.77 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 12.2 pt-20 -74.16 -30.85 62.46 Favored 'General case' 0 N--CA 1.482 1.137 0 CA-C-N 116.187 -0.461 . . . . 75.2 111.071 178.217 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 24.9 t -82.28 -14.9 54.7 Favored 'General case' 0 N--CA 1.487 1.414 0 C-N-CA 123.027 0.531 . . . . 51.21 112.103 174.296 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -83.2 -49.37 9.52 Favored 'General case' 0 N--CA 1.485 1.305 0 C-N-CA 123.568 0.747 . . . . 74.25 111.159 -179.12 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 51' ' ' PHE . . . . . . . . . . . . . 25.6 m-85 . . . . . 0 N--CA 1.47 0.539 0 CA-C-N 115.845 -0.616 . . . . 63.22 110.498 179.713 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 2' ' ' THR . . . . . 0.518 HG23 ' H ' ' A' ' 5' ' ' GLU . 6.7 t . . . . . 0 N--CA 1.487 1.417 0 N-CA-C 111.745 0.276 . . . . 73.21 111.745 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 3' ' ' LEU . . . . . 0.532 HD13 HD12 ' A' ' 6' ' ' LEU . 3.4 mm? -63.22 -24.2 67.77 Favored 'General case' 0 N--CA 1.483 1.212 0 CA-C-N 115.538 -0.756 . . . . 61.1 110.63 174.317 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 41.3 mm -59.24 -49.69 82.54 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.297 0 C-N-CA 123.725 0.81 . . . . 54.22 111.22 179.301 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 5' ' ' GLU . . . . . 0.518 ' H ' HG23 ' A' ' 2' ' ' THR . 43.8 mm-40 -65.5 -35.55 81.2 Favored 'General case' 0 N--CA 1.479 1.02 0 CA-C-N 116.079 -0.509 . . . . 71.41 111.854 177.639 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 6' ' ' LEU . . . . . 0.532 HD12 HD13 ' A' ' 3' ' ' LEU . 82.4 mt -64.31 -38.63 91.72 Favored 'General case' 0 N--CA 1.483 1.206 0 C-N-CA 122.617 0.367 . . . . 63.04 111.571 176.258 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 7' ' ' LEU . . . . . 0.434 ' HG ' ' O ' ' A' ' 3' ' ' LEU . 91.8 mt -60.77 -44.24 97.02 Favored 'General case' 0 N--CA 1.485 1.28 0 C-N-CA 123.327 0.651 . . . . 74.05 111.213 174.321 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 96.7 mt -68.66 -53.22 28.67 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.78 0 C-N-CA 124.087 0.955 . . . . 63.23 112.565 -179.163 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 71.0 t -57.63 -43.45 83.5 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.027 0 C-N-CA 123.705 0.802 . . . . 74.44 112.005 -177.209 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 72.9 t -68.42 -33.77 62.06 Favored 'Isoleucine or valine' 0 CA--C 1.559 1.32 0 C-N-CA 122.627 0.371 . . . . 74.43 111.952 176.919 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -73.46 -49.72 25.38 Favored 'General case' 0 N--CA 1.485 1.283 0 CA-C-N 118.091 0.405 . . . . 74.11 111.841 -179.52 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 12' ' ' ILE . . . . . 0.432 ' O ' ' HG ' ' A' ' 16' ' ' LEU . 25.8 pt -64.93 -43.11 96.28 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.151 0 C-N-CA 123.744 0.818 . . . . 74.21 112.064 -175.488 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 78.8 mt -73.38 -30.1 29.47 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.882 0 C-N-CA 123.881 0.873 . . . . 54.23 109.893 176.305 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -62.01 -36.24 92.59 Favored Glycine 0 C--N 1.355 1.624 0 CA-C-N 115.604 -0.725 . . . . 71.41 113.046 174.858 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 15' ' ' ILE . . . . . 0.425 HD12 ' HA ' ' A' ' 12' ' ' ILE . 21.5 mt -69.51 -47.21 73.37 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.892 0 C-N-CA 123.407 0.683 . . . . 64.31 110.549 173.544 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . 0.432 ' HG ' ' O ' ' A' ' 12' ' ' ILE . 14.6 mt -59.94 -35.73 75.54 Favored 'General case' 0 N--CA 1.484 1.241 0 O-C-N 123.562 0.539 . . . . 72.32 112.172 -176.073 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -72.2 -52.16 17.79 Favored 'General case' 0 N--CA 1.478 0.939 0 CA-C-O 121.289 0.566 . . . . 63.24 110.662 174.87 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -64.51 -19.55 65.66 Favored 'General case' 0 N--CA 1.479 1.005 0 N-CA-C 114.175 1.176 . . . . 72.32 114.175 -176.837 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 2.7 pp -94.57 -43.33 13.09 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.178 0 CA-C-N 118.458 0.572 . . . . 65.21 111.441 173.441 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -72.39 -46.9 53.17 Favored 'General case' 0 N--CA 1.491 1.577 0 N-CA-C 112.542 0.571 . . . . 44.51 112.542 -170.483 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 23.4 mt -59.35 -54.41 56.43 Favored Pre-proline 0 CA--C 1.561 1.379 0 CA-C-O 118.091 -0.957 . . . . 73.43 113.063 -177.988 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 39.2 Cg_endo -65.43 -37.87 28.39 Favored 'Trans proline' 0 C--N 1.38 2.221 0 C-N-CA 121.821 1.681 . . . . 74.34 112.773 176.554 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 27.4 tt0 -66.07 -35.63 81.03 Favored 'General case' 0 N--CA 1.485 1.284 0 C-N-CA 123.349 0.66 . . . . 74.31 110.291 -178.124 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 24' ' ' PHE . . . . . . . . . . . . . 66.8 t80 -87.37 -38.03 16.55 Favored 'General case' 0 N--CA 1.489 1.49 0 CA-C-N 115.563 -0.744 . . . . 74.31 111.082 -176.959 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . 0.404 ' O ' HG23 ' A' ' 29' ' ' VAL . 74.7 m -56.15 -49.21 74.61 Favored 'General case' 0 N--CA 1.488 1.453 0 C-N-CA 122.358 0.263 . . . . 74.21 110.721 171.008 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -67.3 -30.76 70.7 Favored 'General case' 0 N--CA 1.483 1.216 0 C-N-CA 123.264 0.626 . . . . 54.42 112.19 175.932 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 61.2 t80 -68.38 -53.36 24.41 Favored 'General case' 0 N--CA 1.479 1.007 0 C-N-CA 123.16 0.584 . . . . 71.4 110.906 -179.044 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 1.8 ptm180 -69.59 -18.24 63.6 Favored 'General case' 0 N--CA 1.475 0.815 0 C-N-CA 123.317 0.647 . . . . 73.42 111.443 -175.415 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . 0.404 HG23 ' O ' ' A' ' 25' ' ' SER . 52.9 t -76.5 -51.43 19.51 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.183 0 CA-C-O 120.906 0.384 . . . . 75.03 110.45 171.436 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 21.2 ptmt -73.41 -18.7 61.12 Favored 'General case' 0 N--CA 1.482 1.154 0 CA-C-N 115.819 -0.628 . . . . 64.44 111.882 -178.572 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -87.15 -33.2 19.49 Favored 'General case' 0 N--CA 1.486 1.375 0 C-N-CA 123.459 0.704 . . . . 72.44 109.822 179.09 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 69.8 t80 -69.77 -22.32 63.36 Favored 'General case' 0 N--CA 1.483 1.211 0 CA-C-N 115.566 -0.743 . . . . 71.12 109.967 171.58 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 7.6 t30 -84.33 -51.23 7.14 Favored 'General case' 0 N--CA 1.475 0.785 0 C-N-CA 124.221 1.008 . . . . 61.42 111.218 173.106 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 46.5 t -67.67 -54.95 15.4 Favored 'General case' 0 N--CA 1.492 1.631 0 C-N-CA 123.247 0.619 . . . . 64.4 112.181 -172.427 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -61.41 -39.25 90.06 Favored 'General case' 0 N--CA 1.474 0.762 0 CA-C-N 115.981 -0.554 . . . . 72.12 111.296 178.572 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -70.36 -43.3 70.46 Favored 'General case' 0 N--CA 1.483 1.176 0 O-C-N 123.359 0.412 . . . . 75.44 111.808 -178.424 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 40.2 t -59.11 -43.91 91.94 Favored 'General case' 0 N--CA 1.491 1.6 0 C-N-CA 123.53 0.732 . . . . 74.35 111.514 178.249 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 44.6 t -79.08 -27.54 43.03 Favored 'General case' 0 N--CA 1.475 0.823 0 CA-C-N 115.411 -0.813 . . . . 72.25 112.059 -179.211 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 26.6 t70 -66.6 -47.17 73.55 Favored 'General case' 0 N--CA 1.481 1.083 0 C-N-CA 122.82 0.448 . . . . 75.45 110.809 172.414 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 97.2 mt -71.82 -31.73 66.85 Favored 'General case' 0 N--CA 1.481 1.091 0 C-N-CA 123.423 0.689 . . . . 71.21 110.829 -177.288 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 50.4 ttp180 -74.08 -31.99 63.07 Favored 'General case' 0 CA--C 1.548 0.882 0 CA-C-N 115.842 -0.617 . . . . 73.42 110.3 173.347 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 42' ' ' ASN . . . . . 0.468 ' HA ' HG22 ' A' ' 45' ' ' THR . 18.0 t-20 -68.63 -31.38 70.48 Favored 'General case' 0 N--CA 1.485 1.285 0 C-N-CA 122.802 0.441 . . . . 70.33 111.14 173.916 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 96.3 mt -66.67 -37.33 84.54 Favored 'General case' 0 N--CA 1.486 1.358 0 C-N-CA 123.022 0.529 . . . . 75.25 110.391 172.719 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 17.8 tppt? -72.61 -47.66 46.06 Favored 'General case' 0 N--CA 1.473 0.677 0 C-N-CA 123.682 0.793 . . . . 61.01 110.258 -176.761 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 45' ' ' THR . . . . . 0.468 HG22 ' HA ' ' A' ' 42' ' ' ASN . 2.9 t -68.3 -31.16 70.39 Favored 'General case' 0 N--CA 1.485 1.285 0 C-N-CA 123.872 0.869 . . . . 63.3 111.489 -177.52 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -65.51 -52.43 52.76 Favored 'General case' 0 N--CA 1.473 0.687 0 CA-C-N 115.18 -0.918 . . . . 74.31 110.569 173.929 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 91.7 mt -66.36 -27.75 68.12 Favored 'General case' 0 N--CA 1.485 1.301 0 C-N-CA 123.643 0.777 . . . . 70.2 112.494 176.535 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 13.1 tp10 -71.78 -53.36 13.63 Favored 'General case' 0 C--N 1.349 0.571 0 C-N-CA 124.304 1.042 . . . . 72.32 111.108 -179.577 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 46.8 t -67.46 -34.76 77.83 Favored 'General case' 0 N--CA 1.48 1.075 0 CA-C-N 115.542 -0.754 . . . . 74.15 111.569 178.897 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -65.94 -52.14 52.39 Favored 'General case' 0 N--CA 1.482 1.126 0 C-N-CA 123.347 0.659 . . . . 63.2 111.555 177.263 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 51' ' ' PHE . . . . . . . . . . . . . 73.9 t80 . . . . . 0 N--CA 1.492 1.635 0 C-N-CA 123.334 0.654 . . . . 72.21 111.231 -178.923 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 2' ' ' THR . . . . . 0.663 ' HB ' ' HG2' ' A' ' 5' ' ' GLU . 25.8 m . . . . . 0 N--CA 1.479 0.979 0 N-CA-C 109.908 -0.404 . . . . 60.32 109.908 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 7.7 tt -57.15 -33.31 67.27 Favored 'General case' 0 N--CA 1.488 1.473 0 C-N-CA 123.53 0.732 . . . . 64.23 110.745 176.594 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 4' ' ' ILE . . . . . 0.57 ' H ' HG22 ' A' ' 2' ' ' THR . 48.7 mm -65.95 -37.34 79.61 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.251 0 C-N-CA 123.093 0.557 . . . . 73.33 111.461 -178.223 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 5' ' ' GLU . . . . . 0.663 ' HG2' ' HB ' ' A' ' 2' ' ' THR . 11.2 mm-40 -56.68 -45.55 81.67 Favored 'General case' 0 N--CA 1.491 1.577 0 C-N-CA 123.296 0.639 . . . . 70.51 110.726 173.586 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 53.8 mt -65.43 -42.6 92.27 Favored 'General case' 0 N--CA 1.479 1.004 0 C-N-CA 123.625 0.77 . . . . 64.03 111.385 177.887 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -56.73 -48.91 76.7 Favored 'General case' 0 CA--C 1.552 1.041 0 C-N-CA 124.364 1.066 . . . . 73.31 110.294 178.089 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 95.2 mt -65.88 -43.77 92.92 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.791 0 C-N-CA 124.254 1.022 . . . . 63.32 112.143 -179.249 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 49.6 t -62.91 -45.45 98.84 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.061 0 C-N-CA 122.868 0.467 . . . . 73.04 111.396 178.383 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 71.6 t -66.58 -32.8 59.66 Favored 'Isoleucine or valine' 0 CA--C 1.562 1.431 0 C-N-CA 122.7 0.4 . . . . 73.1 111.016 175.36 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -67.23 -55.63 13.22 Favored 'General case' 0 CA--C 1.552 1.031 0 C-N-CA 123.065 0.546 . . . . 53.34 111.584 179.219 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 12' ' ' ILE . . . . . 0.477 ' O ' ' HG ' ' A' ' 16' ' ' LEU . 23.7 pt -61.28 -46.03 97.43 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.125 0 C-N-CA 123.461 0.705 . . . . 72.44 111.45 -176.869 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 77.1 mt -65.76 -32.16 56.95 Favored 'Isoleucine or valine' 0 CA--C 1.551 1.002 0 C-N-CA 124.138 0.975 . . . . 64.53 110.598 176.853 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -60.35 -39.69 96.49 Favored Glycine 0 C--N 1.349 1.293 0 CA-C-N 115.685 -0.689 . . . . 72.32 112.882 172.911 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 1.8 mp -72.99 -40.32 58.98 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.06 0 N-CA-C 109.757 -0.46 . . . . 73.54 109.757 176.869 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . 0.477 ' HG ' ' O ' ' A' ' 12' ' ' ILE . 28.2 mt -58.83 -40.28 83.72 Favored 'General case' 0 N--CA 1.491 1.59 0 C-N-CA 123.113 0.565 . . . . 55.44 111.681 179.973 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -74.32 -45.77 45.19 Favored 'General case' 0 N--CA 1.479 1.009 0 C-N-CA 123.287 0.635 . . . . 72.23 110.864 176.833 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -59.18 -32.39 69.87 Favored 'General case' 0 N--CA 1.482 1.171 0 C-N-CA 123.99 0.916 . . . . 72.25 113.275 -178.871 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 2.8 pp -86.01 -37.71 12.02 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.153 0 C-N-CA 122.327 0.251 . . . . 75.4 111.324 175.628 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -63.44 -55.18 26.31 Favored 'General case' 0 N--CA 1.486 1.342 0 C-N-CA 123.792 0.837 . . . . 72.14 112.954 -174.799 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 21.5 mt -54.09 -54.51 46.6 Favored Pre-proline 0 CA--C 1.563 1.444 0 N-CA-C 113.66 0.985 . . . . 64.34 113.66 -174.956 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 37.7 Cg_endo -66.08 -40.42 15.87 Favored 'Trans proline' 0 C--N 1.378 2.103 0 CA-C-N 121.619 1.614 . . . . 72.5 112.894 176.107 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 23' ' ' GLN . . . . . 0.414 ' O ' ' HB2' ' A' ' 27' ' ' TYR . 5.7 tt0 -59.58 -41.75 90.94 Favored 'General case' 0 N--CA 1.485 1.314 0 C-N-CA 123.565 0.746 . . . . 65.33 110.829 -177.566 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 24' ' ' PHE . . . . . . . . . . . . . 19.1 m-85 -92.59 -33.9 14.24 Favored 'General case' 0 N--CA 1.484 1.234 0 CA-C-N 114.65 -1.159 . . . . 61.11 112.005 -172.068 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . 0.429 ' O ' HG23 ' A' ' 29' ' ' VAL . 43.3 t -61.82 -53.34 57.26 Favored 'General case' 0 N--CA 1.49 1.545 0 N-CA-C 110.284 -0.265 . . . . 62.42 110.284 170.764 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -63.58 -27.38 69.21 Favored 'General case' 0 N--CA 1.48 1.037 0 C-N-CA 123.384 0.673 . . . . 73.44 112.333 176.308 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 27' ' ' TYR . . . . . 0.414 ' HB2' ' O ' ' A' ' 23' ' ' GLN . 66.6 t80 -66.22 -48.48 70.44 Favored 'General case' 0 N--CA 1.482 1.171 0 C-N-CA 122.975 0.51 . . . . 61.21 111.386 176.904 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 13.7 mmt180 -67.65 -29.72 69.1 Favored 'General case' 0 N--CA 1.476 0.853 0 O-C-N 124.067 0.854 . . . . 73.33 111.548 -179.212 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . 0.429 HG23 ' O ' ' A' ' 25' ' ' SER . 87.8 t -72.7 -48.69 44.95 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.382 0 N-CA-C 109.359 -0.608 . . . . 60.35 109.359 176.486 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 8.1 tttp -55.14 -40.41 70.53 Favored 'General case' 0 CA--C 1.549 0.931 0 C-N-CA 124.722 1.209 . . . . 74.51 111.213 172.986 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -73.83 -45.22 52.59 Favored 'General case' 0 N--CA 1.476 0.845 0 C-N-CA 122.918 0.487 . . . . 72.04 110.78 -174.045 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 53.7 t80 -64.18 -37.44 87.48 Favored 'General case' 0 CA--C 1.544 0.737 0 O-C-N 123.829 0.706 . . . . 72.11 110.676 179.636 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 93.1 m-20 -72.99 -41.68 64.06 Favored 'General case' 0 N--CA 1.485 1.287 0 C-N-CA 123.774 0.83 . . . . 71.32 112.192 178.905 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 64.7 m -68.85 -49.81 55.18 Favored 'General case' 0 N--CA 1.496 1.843 0 C-N-CA 123.184 0.594 . . . . 75.12 110.935 -179.28 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -62.61 -40.11 95.92 Favored 'General case' 0 N--CA 1.476 0.842 0 CA-C-N 115.564 -0.744 . . . . 52.33 111.333 176.345 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -61.89 -46.33 89.87 Favored 'General case' 0 N--CA 1.496 1.832 0 O-C-N 123.465 0.478 . . . . 71.52 112.219 174.793 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 67.8 m -60.34 -43.44 96.45 Favored 'General case' 0 N--CA 1.494 1.727 0 C-N-CA 123.563 0.745 . . . . 73.24 111.329 179.206 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 37.6 m -73.36 -33.72 65.23 Favored 'General case' 0 N--CA 1.476 0.834 0 CA-C-N 115.362 -0.835 . . . . 73.43 111.607 179.248 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 29.5 t70 -60.49 -52.93 63.09 Favored 'General case' 0 N--CA 1.48 1.029 0 C-N-CA 123.52 0.728 . . . . 72.02 111.338 175.872 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 4.2 pp -71.22 -31.51 67.67 Favored 'General case' 0 N--CA 1.486 1.347 0 CA-C-N 116.194 -0.457 . . . . 65.44 111.143 -172.063 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 36.2 ttm180 -80.67 -40.74 24.94 Favored 'General case' 0 CA--C 1.548 0.891 0 C-N-CA 123.131 0.572 . . . . 64.42 110.92 -179.275 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 42' ' ' ASN . . . . . 0.476 ' HA ' HG22 ' A' ' 45' ' ' THR . 19.9 t-20 -68.04 -38.07 82.09 Favored 'General case' 0 N--CA 1.489 1.501 0 N-CA-C 112.183 0.438 . . . . 71.01 112.183 -178.738 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 86.9 mt -69.99 -29.07 66.07 Favored 'General case' 0 N--CA 1.484 1.23 0 C-N-CA 122.48 0.312 . . . . 54.22 111.369 179.005 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . 0.429 ' O ' ' HG2' ' A' ' 48' ' ' GLU . 86.4 tttt -78.15 -45.08 24.2 Favored 'General case' 0 CA--C 1.542 0.655 0 CA-C-N 115.906 -0.588 . . . . 72.32 110.423 176.394 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 45' ' ' THR . . . . . 0.476 HG22 ' HA ' ' A' ' 42' ' ' ASN . 1.5 t -68.23 -30.11 69.1 Favored 'General case' 0 N--CA 1.487 1.399 0 C-N-CA 123.374 0.669 . . . . 42.13 110.832 -176.65 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -58.27 -43.91 88.15 Favored 'General case' 0 N--CA 1.474 0.762 0 CA-C-N 115.02 -0.991 . . . . 63.14 110.582 169.5 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -68.09 -39.67 82.81 Favored 'General case' 0 CA--C 1.567 1.606 0 C-N-CA 123.608 0.763 . . . . 71.41 110.832 175.016 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 48' ' ' GLU . . . . . 0.429 ' HG2' ' O ' ' A' ' 44' ' ' LYS . 25.0 mm-40 -65.49 -33.74 76.64 Favored 'General case' 0 N--CA 1.487 1.404 0 C-N-CA 123.498 0.719 . . . . 74.51 111.662 -178.309 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 43.3 t -84.15 -55.81 4.0 Favored 'General case' 0 N--CA 1.478 0.94 0 C-N-CA 122.803 0.441 . . . . 71.43 111.952 176.408 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -60.5 -53.21 60.26 Favored 'General case' 0 N--CA 1.479 1.017 0 C-N-CA 123.414 0.686 . . . . 24.22 112.408 -175.457 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 51' ' ' PHE . . . . . . . . . . . . . 80.1 t80 . . . . . 0 N--CA 1.481 1.09 0 CA-C-O 120.665 0.269 . . . . 72.23 111.607 -173.72 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 2' ' ' THR . . . . . 0.714 HG22 ' H ' ' A' ' 4' ' ' ILE . 19.7 m . . . . . 0 N--CA 1.484 1.275 0 CA-C-O 120.6 0.238 . . . . 54.53 111.455 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 3' ' ' LEU . . . . . 0.411 ' O ' ' HG ' ' A' ' 7' ' ' LEU . 2.5 pt? -57.41 -27.87 62.76 Favored 'General case' 0 N--CA 1.484 1.225 0 C-N-CA 123.603 0.761 . . . . 70.4 112.449 175.218 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 4' ' ' ILE . . . . . 0.714 ' H ' HG22 ' A' ' 2' ' ' THR . 51.8 mm -84.42 -44.94 17.97 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.109 0 C-N-CA 123.37 0.668 . . . . 75.43 110.996 -176.708 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 5' ' ' GLU . . . . . 0.456 ' O ' HG23 ' A' ' 9' ' ' VAL . 22.4 mm-40 -58.69 -39.66 81.38 Favored 'General case' 0 N--CA 1.481 1.093 0 O-C-N 123.432 0.457 . . . . 72.2 111.357 176.126 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 2.4 pp -69.34 -31.61 70.16 Favored 'General case' 0 N--CA 1.484 1.226 0 C-N-CA 122.351 0.26 . . . . 65.31 111.33 178.923 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 7' ' ' LEU . . . . . 0.411 ' HG ' ' O ' ' A' ' 3' ' ' LEU . 90.5 mt -64.15 -37.34 87.12 Favored 'General case' 0 N--CA 1.484 1.241 0 C-N-CA 122.464 0.305 . . . . 64.21 111.579 172.035 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 84.0 mt -68.7 -43.48 83.04 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.078 0 C-N-CA 123.252 0.621 . . . . 73.45 111.645 175.446 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . 0.456 HG23 ' O ' ' A' ' 5' ' ' GLU . 95.9 t -59.53 -48.34 87.64 Favored 'Isoleucine or valine' 0 CA--C 1.556 1.196 0 C-N-CA 123.657 0.783 . . . . 74.02 111.928 175.323 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . 0.405 HG12 ' HA ' ' A' ' 7' ' ' LEU . 5.5 p -69.77 -25.13 27.71 Favored 'Isoleucine or valine' 0 CA--C 1.557 1.215 0 C-N-CA 122.77 0.428 . . . . 75.03 111.374 179.281 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -68.66 -55.61 10.88 Favored 'General case' 0 C--N 1.36 1.038 0 C-N-CA 122.766 0.426 . . . . 63.2 111.366 175.196 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 12' ' ' ILE . . . . . 0.557 ' HA ' HD12 ' A' ' 15' ' ' ILE . 23.1 pt -65.15 -45.46 93.97 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.966 0 C-N-CA 123.3 0.64 . . . . 72.22 111.819 -177.703 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 72.5 mt -68.15 -28.84 42.43 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.918 0 C-N-CA 123.562 0.745 . . . . 51.04 110.479 174.712 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -61.71 -38.75 96.42 Favored Glycine 0 C--N 1.346 1.109 0 CA-C-N 116.046 -0.525 . . . . 62.55 112.822 173.057 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 15' ' ' ILE . . . . . 0.557 HD12 ' HA ' ' A' ' 12' ' ' ILE . 14.4 mt -70.71 -44.32 76.55 Favored 'Isoleucine or valine' 0 C--N 1.352 0.682 0 C-N-CA 123.064 0.545 . . . . 62.5 109.929 175.387 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . 0.485 ' HG ' ' O ' ' A' ' 12' ' ' ILE . 22.0 mt -58.57 -40.42 83.05 Favored 'General case' 0 N--CA 1.482 1.165 0 O-C-N 123.791 0.682 . . . . 65.32 111.501 179.669 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -72.01 -51.92 19.5 Favored 'General case' 0 N--CA 1.476 0.843 0 C-N-CA 123.053 0.541 . . . . 71.21 110.754 179.171 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -55.09 -30.79 60.43 Favored 'General case' 0 N--CA 1.482 1.152 0 C-N-CA 123.981 0.913 . . . . 72.23 112.879 -179.132 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 2.7 pp -88.26 -34.51 7.19 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.256 0 N-CA-C 112.551 0.575 . . . . 71.13 112.551 174.529 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -65.79 -52.32 51.78 Favored 'General case' 0 N--CA 1.484 1.251 0 C-N-CA 123.074 0.55 . . . . 41.44 112.264 -173.268 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 2.1 mp -54.61 -54.12 52.52 Favored Pre-proline 0 CA--C 1.574 1.894 0 N-CA-C 112.851 0.686 . . . . 63.12 112.851 -174.733 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 36.7 Cg_endo -65.13 -42.25 14.35 Favored 'Trans proline' 0 C--N 1.38 2.221 0 CA-C-N 121.065 1.416 . . . . 74.24 113.115 175.113 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 28.8 tt0 -62.76 -34.41 77.16 Favored 'General case' 0 N--CA 1.486 1.357 0 C-N-CA 123.358 0.663 . . . . 74.14 111.001 -177.859 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 24' ' ' PHE . . . . . . . . . . . . . 84.3 t80 -84.42 -42.06 16.04 Favored 'General case' 0 N--CA 1.484 1.229 0 C-N-CA 123.912 0.885 . . . . 51.15 110.49 -174.137 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 26.4 t -67.16 -28.34 68.04 Favored 'General case' 0 N--CA 1.479 1.004 0 CA-C-N 116.402 -0.363 . . . . 71.35 110.582 175.253 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -79.94 -29.81 39.79 Favored 'General case' 0 C--O 1.214 -0.808 0 C-N-CA 123.109 0.564 . . . . 55.54 111.717 172.737 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 78.7 t80 -71.97 -45.8 59.72 Favored 'General case' 0 N--CA 1.487 1.408 0 C-N-CA 123.89 0.876 . . . . 72.34 111.722 -175.539 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 39.3 ptt180 -68.23 -29.32 68.12 Favored 'General case' 0 N--CA 1.477 0.92 0 CA-C-N 115.181 -0.918 . . . . 52.22 111.309 179.74 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 79.3 t -83.3 -34.89 11.38 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.375 0 CA-C-N 115.699 -0.682 . . . . 73.11 110.136 178.896 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 10.8 tttp -61.25 -42.87 99.37 Favored 'General case' 0 C--O 1.214 -0.769 0 C-N-CA 124.061 0.944 . . . . 51.23 109.783 168.69 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -71.04 -42.46 69.46 Favored 'General case' 0 N--CA 1.476 0.842 0 N-CA-C 109.935 -0.395 . . . . 74.35 109.935 -176.686 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 74.9 t80 -62.53 -62.48 1.71 Allowed 'General case' 0 C--O 1.215 -0.715 0 CA-C-N 115.57 -0.741 . . . . 72.43 110.977 178.828 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 85.4 m-20 -66.95 -44.46 80.51 Favored 'General case' 0 N--CA 1.485 1.275 0 N-CA-C 113.664 0.987 . . . . 73.24 113.664 -174.535 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 47.0 t -68.01 -52.85 30.9 Favored 'General case' 0 N--CA 1.497 1.918 0 CA-C-N 117.636 0.198 . . . . 75.33 111.09 -176.321 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -62.8 -41.36 99.25 Favored 'General case' 0 C--O 1.212 -0.882 0 O-C-N 123.446 0.466 . . . . 41.0 111.27 177.765 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -59.82 -50.44 73.78 Favored 'General case' 0 N--CA 1.498 1.937 0 N-CA-C 112.24 0.459 . . . . 52.14 112.24 178.379 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 66.8 m -63.81 -37.55 87.8 Favored 'General case' 0 N--CA 1.486 1.356 0 C-N-CA 123.331 0.652 . . . . 73.12 111.891 -179.277 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 79.9 p -80.97 -25.52 37.26 Favored 'General case' 0 N--CA 1.482 1.135 0 C-N-CA 122.844 0.458 . . . . 72.14 111.997 -178.626 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 39' ' ' ASP . . . . . 0.438 ' O ' ' HG ' ' A' ' 43' ' ' LEU . 94.6 m-20 -65.69 -52.65 49.75 Favored 'General case' 0 C--O 1.211 -0.958 0 N-CA-C 109.336 -0.616 . . . . 72.34 109.336 167.254 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 98.5 mt -64.37 -29.83 70.89 Favored 'General case' 0 N--CA 1.481 1.11 0 C-N-CA 123.483 0.713 . . . . 75.32 111.63 -176.516 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 47.4 ttp180 -75.29 -43.21 52.34 Favored 'General case' 0 CA--C 1.546 0.809 0 C-N-CA 123.536 0.734 . . . . 73.4 110.663 175.213 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 62.4 t30 -69.68 -34.49 74.03 Favored 'General case' 0 N--CA 1.488 1.471 0 C-N-CA 123.467 0.707 . . . . 54.53 112.221 -179.78 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . 0.438 ' HG ' ' O ' ' A' ' 39' ' ' ASP . 89.8 mt -77.21 -32.01 55.61 Favored 'General case' 0 N--CA 1.478 0.949 0 C-N-CA 123.007 0.523 . . . . 75.22 110.12 179.37 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . 0.415 ' O ' ' HG2' ' A' ' 48' ' ' GLU . 38.8 ttpt -77.55 -36.87 51.82 Favored 'General case' 0 N--CA 1.477 0.885 0 C-N-CA 122.913 0.485 . . . . 53.2 110.602 179.091 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 1.7 t -70.57 -30.93 67.77 Favored 'General case' 0 N--CA 1.485 1.298 0 CA-C-O 121.369 0.604 . . . . 74.31 110.753 179.438 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -66.42 -43.86 84.55 Favored 'General case' 0 N--CA 1.479 1.003 0 CA-C-N 114.86 -1.064 . . . . 64.54 111.101 168.915 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 36.5 tp -63.71 -34.52 78.07 Favored 'General case' 0 CA--C 1.554 1.13 0 C-N-CA 123.648 0.779 . . . . 72.13 111.308 177.132 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 48' ' ' GLU . . . . . 0.415 ' HG2' ' O ' ' A' ' 44' ' ' LYS . 80.9 mm-40 -67.32 -47.84 69.34 Favored 'General case' 0 N--CA 1.474 0.762 0 C-N-CA 123.582 0.753 . . . . 71.05 110.115 173.356 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 40.5 t -57.63 -44.13 85.33 Favored 'General case' 0 N--CA 1.483 1.215 0 C-N-CA 123.681 0.792 . . . . 60.45 112.852 -176.435 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -72.41 -52.28 16.66 Favored 'General case' 0 N--CA 1.481 1.091 0 C-N-CA 123.407 0.683 . . . . 50.03 112.66 178.863 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 51' ' ' PHE . . . . . . . . . . . . . 41.5 t80 . . . . . 0 N--CA 1.486 1.357 0 CA-C-N 115.635 -0.712 . . . . 70.13 111.45 -170.344 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 4.7 t . . . . . 0 N--CA 1.481 1.078 0 CA-C-O 120.557 0.218 . . . . 70.52 110.605 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 9.3 mp -59.95 -18.97 49.4 Favored 'General case' 0 N--CA 1.481 1.1 0 C-N-CA 123.272 0.629 . . . . 70.15 111.01 176.244 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 50.3 mm -64.07 -49.79 79.91 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.102 0 C-N-CA 123.505 0.722 . . . . 73.54 110.822 174.962 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 40.8 mm-40 -57.95 -47.71 82.1 Favored 'General case' 0 N--CA 1.49 1.544 0 C-N-CA 123.376 0.67 . . . . 45.51 111.512 -179.753 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 46.9 mt -68.88 -32.7 72.55 Favored 'General case' 0 CA--C 1.547 0.853 0 CA-C-N 115.576 -0.738 . . . . 71.12 111.382 -178.108 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 42.3 tp -66.77 -37.15 84.02 Favored 'General case' 0 CA--C 1.549 0.906 0 C-N-CA 123.976 0.911 . . . . 73.2 111.659 173.855 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 96.2 mt -68.95 -50.11 56.97 Favored 'Isoleucine or valine' 0 C--N 1.35 0.606 0 C-N-CA 123.636 0.775 . . . . 71.44 111.245 176.946 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 88.3 t -60.07 -43.03 91.85 Favored 'Isoleucine or valine' 0 CA--C 1.554 1.107 0 C-N-CA 123.119 0.568 . . . . 70.05 111.482 179.345 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 2.7 p -69.24 -31.45 49.87 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.093 0 O-C-N 122.328 -0.233 . . . . 73.32 111.595 177.482 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -68.24 -57.52 5.85 Favored 'General case' 0 C--N 1.363 1.162 0 C-N-CA 123.141 0.576 . . . . 53.32 111.193 179.308 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 12' ' ' ILE . . . . . 0.507 ' O ' ' HG ' ' A' ' 16' ' ' LEU . 21.9 pt -60.33 -46.99 94.18 Favored 'Isoleucine or valine' 0 CA--C 1.554 1.101 0 C-N-CA 123.776 0.83 . . . . 73.12 112.055 -177.943 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 1.7 mp -62.03 -35.48 68.72 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.558 0 C-N-CA 123.721 0.808 . . . . 52.25 110.345 174.887 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -62.07 -39.64 97.88 Favored Glycine 0 C--N 1.352 1.418 0 CA-C-N 115.554 -0.748 . . . . 71.31 113.067 176.241 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 15' ' ' ILE . . . . . 0.486 HD12 ' HA ' ' A' ' 12' ' ' ILE . 21.7 mt -69.59 -40.49 79.59 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.917 0 C-N-CA 123.507 0.723 . . . . 62.34 111.088 176.686 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . 0.507 ' HG ' ' O ' ' A' ' 12' ' ' ILE . 21.8 mt -57.75 -40.06 78.84 Favored 'General case' 0 N--CA 1.489 1.491 0 C-N-CA 123.207 0.603 . . . . 74.14 111.192 178.647 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -76.84 -49.18 16.38 Favored 'General case' 0 N--CA 1.48 1.026 0 C-N-CA 123.391 0.676 . . . . 65.01 111.478 179.067 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -59.43 -26.18 64.96 Favored 'General case' 0 N--CA 1.483 1.2 0 C-N-CA 124.182 0.993 . . . . 71.14 113.263 -176.485 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 19' ' ' ILE . . . . . 0.417 HD12 ' N ' ' A' ' 20' ' ' ALA . 2.8 pp -87.22 -38.51 12.2 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.382 0 CA-C-N 117.915 0.325 . . . . 74.11 111.741 170.556 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . 0.417 ' N ' HD12 ' A' ' 19' ' ' ILE . . . -65.19 -56.85 10.47 Favored 'General case' 0 N--CA 1.478 0.934 0 C-N-CA 123.568 0.747 . . . . 72.2 112.807 -170.276 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 2.6 mp -58.9 -50.99 85.0 Favored Pre-proline 0 CA--C 1.571 1.777 0 N-CA-C 113.228 0.825 . . . . 71.15 113.228 -173.503 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 37.7 Cg_endo -65.99 -36.51 30.04 Favored 'Trans proline' 0 C--N 1.382 2.338 0 C-N-CA 121.72 1.613 . . . . 63.05 113.354 176.395 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 22.0 tt0 -65.31 -36.88 85.42 Favored 'General case' 0 N--CA 1.489 1.504 0 CA-C-O 121.489 0.661 . . . . 62.22 109.788 178.851 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 24' ' ' PHE . . . . . . . . . . . . . 64.3 t80 -76.04 -39.92 54.56 Favored 'General case' 0 N--CA 1.484 1.261 0 CA-C-N 113.994 -1.457 . . . . 72.24 110.689 -177.951 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 44.4 t -58.3 -52.25 66.38 Favored 'General case' 0 N--CA 1.478 0.947 0 C-N-CA 123.769 0.828 . . . . 75.05 110.582 173.9 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -64.11 -28.56 69.85 Favored 'General case' 0 N--CA 1.484 1.232 0 C-N-CA 123.683 0.793 . . . . 72.23 112.269 176.636 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 47.8 t80 -75.69 -46.01 33.67 Favored 'General case' 0 N--CA 1.484 1.271 0 C-N-CA 123.085 0.554 . . . . 74.13 111.442 -176.503 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 14.3 ptm180 -73.78 -23.69 59.74 Favored 'General case' 0 N--CA 1.474 0.749 0 CA-C-N 115.42 -0.809 . . . . 62.3 111.082 -179.499 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 28.3 t -69.32 -58.79 4.64 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.781 0 N-CA-C 109.389 -0.597 . . . . 52.2 109.389 171.328 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . 0.434 ' O ' ' HB3' ' A' ' 34' ' ' SER . 21.1 ptmt -65.98 -17.24 64.55 Favored 'General case' 0 N--CA 1.486 1.366 0 N-CA-C 112.253 0.464 . . . . 63.52 112.253 -179.223 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -72.95 -46.17 53.96 Favored 'General case' 0 N--CA 1.479 0.99 0 CA-C-O 121.334 0.588 . . . . 73.22 109.696 172.633 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 12.5 t80 -89.36 -9.99 48.31 Favored 'General case' 0 N--CA 1.488 1.447 0 CA-C-N 115.244 -0.889 . . . . 75.02 112.195 -173.59 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 29.6 m-80 -101.5 -58.8 1.81 Allowed 'General case' 0 N--CA 1.47 0.574 0 CA-C-N 115.552 -0.749 . . . . 71.35 110.479 172.93 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . 0.434 ' HB3' ' O ' ' A' ' 30' ' ' LYS . 47.2 t -83.54 -52.03 6.82 Favored 'General case' 0 N--CA 1.496 1.849 0 CA-C-N 116.745 -0.207 . . . . 71.24 111.552 -168.405 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -69.15 -32.28 71.53 Favored 'General case' 0 N--CA 1.486 1.348 0 C-N-CA 122.165 0.186 . . . . 60.31 111.148 179.546 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -72.12 -38.52 69.26 Favored 'General case' 0 N--CA 1.478 0.97 0 C-N-CA 122.745 0.418 . . . . 62.2 111.25 176.028 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 36.4 t -66.11 -32.39 73.82 Favored 'General case' 0 N--CA 1.494 1.773 0 C-N-CA 122.526 0.331 . . . . 53.24 111.443 174.355 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 38' ' ' SER . . . . . 0.504 ' HA ' ' HB3' ' A' ' 41' ' ' ARG . 52.7 m -80.37 -23.52 40.44 Favored 'General case' 0 N--CA 1.48 1.062 0 C-N-CA 123.489 0.716 . . . . 74.2 111.323 177.798 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 39' ' ' ASP . . . . . 0.441 ' O ' ' HG ' ' A' ' 43' ' ' LEU . 24.0 t70 -68.79 -46.94 67.39 Favored 'General case' 0 CA--C 1.553 1.072 0 C-N-CA 122.985 0.514 . . . . 74.45 110.597 168.718 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 11.1 mp -69.68 -27.76 65.29 Favored 'General case' 0 N--CA 1.482 1.152 0 C-N-CA 123.378 0.671 . . . . 71.43 111.481 176.634 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 41' ' ' ARG . . . . . 0.504 ' HB3' ' HA ' ' A' ' 38' ' ' SER . 51.5 ttt180 -69.78 -41.02 75.68 Favored 'General case' 0 N--CA 1.478 0.975 0 C-N-CA 123.701 0.8 . . . . 75.35 110.033 171.738 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 52.9 t30 -60.15 -36.04 76.67 Favored 'General case' 0 CA--C 1.554 1.108 0 C-N-CA 123.793 0.837 . . . . 65.24 111.2 175.33 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . 0.441 ' HG ' ' O ' ' A' ' 39' ' ' ASP . 77.4 mt -79.76 -35.76 38.25 Favored 'General case' 0 N--CA 1.478 0.974 0 C-N-CA 123.272 0.629 . . . . 64.21 111.38 178.171 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 22.5 tptm -70.24 -45.31 66.73 Favored 'General case' 0 N--CA 1.481 1.087 0 N-CA-C 109.912 -0.403 . . . . 73.22 109.912 -177.343 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 45' ' ' THR . . . . . 0.496 ' HA ' ' HG2' ' A' ' 48' ' ' GLU . 3.2 t -67.44 -33.63 75.55 Favored 'General case' 0 N--CA 1.473 0.71 0 CA-C-N 114.864 -1.062 . . . . 63.32 111.158 179.622 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -63.39 -52.24 62.48 Favored 'General case' 0 N--CA 1.477 0.882 0 C-N-CA 123.461 0.705 . . . . 73.4 111.356 176.388 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 10.8 mp -67.08 -46.33 74.59 Favored 'General case' 0 N--CA 1.478 0.964 0 C-N-CA 123.01 0.524 . . . . 73.03 112.156 -179.887 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 48' ' ' GLU . . . . . 0.496 ' HG2' ' HA ' ' A' ' 45' ' ' THR . 11.1 pt-20 -67.51 -33.55 75.32 Favored 'General case' 0 N--CA 1.487 1.398 0 CA-C-N 117.935 0.334 . . . . 72.23 111.22 -176.407 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 48.2 t -74.86 -32.97 62.03 Favored 'General case' 0 N--CA 1.478 0.961 0 C-N-CA 123.242 0.617 . . . . 73.44 111.031 175.951 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -70.63 -44.36 67.33 Favored 'General case' 0 N--CA 1.489 1.512 0 CA-C-O 121.207 0.527 . . . . 72.23 110.722 -178.674 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 51' ' ' PHE . . . . . . . . . . . . . 58.1 m-85 . . . . . 0 CA--C 1.549 0.93 0 CA-C-N 115.238 -0.892 . . . . 73.41 111.614 175.703 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 57.5 p . . . . . 0 N--CA 1.487 1.377 0 CA-C-O 120.7 0.286 . . . . 51.24 111.206 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 9.3 tt -61.07 -23.45 65.48 Favored 'General case' 0 N--CA 1.486 1.369 0 C-N-CA 123.347 0.659 . . . . 73.13 110.32 171.603 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 51.4 mm -83.0 -43.42 18.47 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.692 0 CA-C-N 115.586 -0.734 . . . . 72.25 110.001 -178.542 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 70.7 mm-40 -56.76 -42.83 80.03 Favored 'General case' 0 N--CA 1.483 1.203 0 C-N-CA 123.55 0.74 . . . . 65.12 111.658 173.943 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 2.4 pp -71.19 -37.91 72.13 Favored 'General case' 0 N--CA 1.476 0.869 0 O-C-N 123.31 0.382 . . . . 74.31 110.924 178.651 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -61.48 -46.66 89.1 Favored 'General case' 0 CA--C 1.551 1.011 0 C-N-CA 122.941 0.496 . . . . 74.54 110.765 177.978 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 95.2 mt -67.65 -49.88 66.08 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.721 0 C-N-CA 123.857 0.863 . . . . 70.43 112.341 -177.938 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 7.2 p -60.38 -41.13 86.21 Favored 'Isoleucine or valine' 0 CA--C 1.555 1.137 0 CA-C-N 118.194 0.452 . . . . 52.1 111.852 -177.05 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 74.1 t -68.81 -39.83 80.57 Favored 'Isoleucine or valine' 0 CA--C 1.555 1.16 0 C-N-CA 122.909 0.484 . . . . 72.33 111.307 174.858 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -64.27 -51.57 62.91 Favored 'General case' 0 N--CA 1.487 1.379 0 C-N-CA 122.835 0.454 . . . . 64.23 111.855 -178.733 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 12' ' ' ILE . . . . . 0.549 ' O ' ' HG ' ' A' ' 16' ' ' LEU . 22.9 pt -62.28 -48.14 89.76 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.776 0 C-N-CA 123.533 0.733 . . . . 73.52 111.471 -176.464 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 86.2 mt -63.69 -31.72 54.13 Favored 'Isoleucine or valine' 0 C--N 1.361 1.097 0 C-N-CA 123.306 0.642 . . . . 63.12 110.925 177.99 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -60.92 -40.66 98.68 Favored Glycine 0 C--N 1.35 1.341 0 CA-C-N 115.562 -0.745 . . . . 74.04 112.961 174.134 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 15' ' ' ILE . . . . . 0.529 HD12 ' HA ' ' A' ' 12' ' ' ILE . 14.5 mt -71.35 -43.78 73.09 Favored 'Isoleucine or valine' 0 C--N 1.355 0.811 0 C-N-CA 123.282 0.633 . . . . 73.11 110.465 177.061 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . 0.549 ' HG ' ' O ' ' A' ' 12' ' ' ILE . 34.5 mt -58.23 -39.62 79.59 Favored 'General case' 0 N--CA 1.486 1.356 0 C-N-CA 123.54 0.736 . . . . 73.22 111.283 -177.578 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -73.49 -48.68 31.49 Favored 'General case' 0 N--CA 1.478 0.97 0 C-N-CA 123.016 0.526 . . . . 74.52 110.913 177.559 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -63.96 -23.9 67.52 Favored 'General case' 0 N--CA 1.482 1.149 0 N-CA-C 113.53 0.937 . . . . 62.14 113.53 -176.756 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 2.8 pp -89.76 -38.26 10.86 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.28 0 CA-C-N 118.213 0.461 . . . . 70.31 111.359 172.362 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -63.6 -47.63 80.67 Favored 'General case' 0 N--CA 1.486 1.373 0 C-N-CA 123.429 0.692 . . . . 65.22 112.789 -175.177 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 27.5 mt -57.43 -54.62 53.03 Favored Pre-proline 0 CA--C 1.563 1.462 0 CA-C-O 118.097 -0.954 . . . . 74.44 113.281 -176.692 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 39.4 Cg_endo -66.13 -37.42 25.41 Favored 'Trans proline' 0 C--N 1.378 2.09 0 CA-C-N 121.504 1.573 . . . . 64.42 113.093 174.149 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 23.8 tt0 -63.34 -37.1 85.95 Favored 'General case' 0 N--CA 1.49 1.573 0 C-N-CA 123.519 0.728 . . . . 71.52 110.802 -177.671 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 24' ' ' PHE . . . . . . . . . . . . . 70.1 t80 -93.8 -36.46 12.25 Favored 'General case' 0 N--CA 1.487 1.407 0 CA-C-N 114.685 -1.143 . . . . 71.54 111.315 -173.055 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . 0.505 ' O ' HG23 ' A' ' 29' ' ' VAL . 39.5 t -59.55 -53.26 60.1 Favored 'General case' 0 N--CA 1.486 1.334 0 N-CA-C 110.05 -0.352 . . . . 61.01 110.05 170.983 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -65.13 -28.15 69.23 Favored 'General case' 0 N--CA 1.488 1.474 0 C-N-CA 123.668 0.787 . . . . 61.35 112.518 176.866 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 84.6 t80 -63.25 -51.07 67.68 Favored 'General case' 0 N--CA 1.487 1.38 0 CA-C-O 120.835 0.35 . . . . 75.41 110.209 172.697 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 57.0 mtp180 -65.82 -24.63 66.95 Favored 'General case' 0 N--CA 1.47 0.571 0 CA-C-N 115.465 -0.789 . . . . 74.23 111.721 179.475 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . 0.505 HG23 ' O ' ' A' ' 25' ' ' SER . 79.6 t -68.98 -56.29 12.52 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.09 0 N-CA-C 109.871 -0.418 . . . . 74.45 109.871 174.341 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 48.4 pttt -67.6 -24.68 65.51 Favored 'General case' 0 CA--C 1.546 0.814 0 CA-C-N 115.491 -0.777 . . . . 73.44 111.545 -176.85 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -81.65 -37.64 27.17 Favored 'General case' 0 N--CA 1.485 1.305 0 CA-C-O 121.313 0.578 . . . . 71.41 110.002 -178.522 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 21.4 t80 -76.94 -16.03 59.49 Favored 'General case' 0 N--CA 1.483 1.178 0 CA-C-N 115.048 -0.978 . . . . 74.4 111.079 -179.85 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 85.6 m-20 -94.89 -50.76 4.98 Favored 'General case' 0 N--CA 1.478 0.95 0 C-N-CA 123.798 0.839 . . . . 71.42 111.857 173.957 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 46.9 t -70.54 -52.8 19.23 Favored 'General case' 0 N--CA 1.501 2.085 0 N-CA-C 111.864 0.32 . . . . 70.33 111.864 -172.16 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -66.44 -29.78 70.0 Favored 'General case' 0 N--CA 1.479 0.99 0 C-N-CA 122.998 0.519 . . . . 54.44 111.706 179.089 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -65.99 -59.02 4.23 Favored 'General case' 0 N--CA 1.482 1.161 0 C-N-CA 122.848 0.459 . . . . 61.35 111.136 174.144 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 66.2 m -53.65 -40.55 65.96 Favored 'General case' 0 N--CA 1.482 1.143 0 C-N-CA 123.846 0.858 . . . . 74.12 111.984 179.174 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 47.7 t -76.0 -38.31 57.5 Favored 'General case' 0 N--CA 1.48 1.072 0 C-N-CA 123.105 0.562 . . . . 74.32 112.446 -176.945 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 38.5 t70 -63.72 -47.02 82.77 Favored 'General case' 0 N--CA 1.483 1.183 0 CA-C-O 121.266 0.555 . . . . 72.44 111.435 176.981 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 70.0 mt -78.66 -32.63 47.26 Favored 'General case' 0 N--CA 1.476 0.849 0 CA-C-N 115.113 -0.948 . . . . 73.33 110.78 -172.658 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 17.3 ttp180 -71.68 -35.28 70.25 Favored 'General case' 0 N--CA 1.479 1.002 0 C-N-CA 122.602 0.361 . . . . 71.13 110.244 174.643 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 28.6 t-20 -61.23 -39.76 91.49 Favored 'General case' 0 N--CA 1.485 1.316 0 C-N-CA 123.232 0.613 . . . . 71.11 111.258 171.903 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 87.2 mt -69.58 -34.12 73.69 Favored 'General case' 0 N--CA 1.48 1.026 0 C-N-CA 122.757 0.423 . . . . 52.0 111.072 177.849 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 55.8 tptt -80.58 -35.41 34.27 Favored 'General case' 0 CA--C 1.548 0.866 0 C-N-CA 123.574 0.749 . . . . 74.43 111.214 -176.636 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 3.2 t -74.35 -38.57 63.2 Favored 'General case' 0 N--CA 1.482 1.129 0 CA-C-O 121.226 0.536 . . . . 62.04 110.389 -178.022 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -71.69 -35.66 70.33 Favored 'General case' 0 N--CA 1.478 0.961 0 CA-C-N 115.193 -0.912 . . . . 61.42 111.21 174.012 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 69.8 tp -57.77 -62.65 1.65 Allowed 'General case' 0 C--N 1.359 1.021 0 O-C-N 123.89 0.744 . . . . 73.52 110.705 175.118 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 33.4 mm-40 -59.89 -32.92 71.18 Favored 'General case' 0 N--CA 1.489 1.502 0 C-N-CA 123.661 0.784 . . . . 71.34 112.583 -173.435 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 25.3 t -61.63 -52.23 65.22 Favored 'General case' 0 CA--C 1.551 1.004 0 CA-C-N 115.439 -0.8 . . . . 70.14 111.18 178.267 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -78.38 -34.1 48.42 Favored 'General case' 0 N--CA 1.486 1.36 0 C-N-CA 123.43 0.692 . . . . 41.45 112.33 -179.018 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 51' ' ' PHE . . . . . . . . . . . . . 75.1 t80 . . . . . 0 N--CA 1.488 1.456 0 C-N-CA 125.25 1.42 . . . . 72.44 110.572 -176.146 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 72.4 p . . . . . 0 N--CA 1.491 1.598 0 CA-C-O 120.488 0.185 . . . . 74.51 110.851 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 2.4 pt? -60.72 -21.33 62.83 Favored 'General case' 0 N--CA 1.489 1.494 0 C-N-CA 123.567 0.747 . . . . 75.3 111.348 171.179 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 49.2 mm -69.33 -47.57 72.56 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.087 0 C-N-CA 123.821 0.848 . . . . 73.31 110.316 176.353 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 22.9 mm-40 -59.94 -42.22 93.55 Favored 'General case' 0 N--CA 1.484 1.229 0 C-N-CA 123.441 0.696 . . . . 74.14 111.355 175.41 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 83.4 mt -63.75 -37.34 86.98 Favored 'General case' 0 N--CA 1.487 1.408 0 C-N-CA 123.19 0.596 . . . . 72.44 111.835 176.508 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 6.7 tt -64.51 -43.09 95.16 Favored 'General case' 0 CA--C 1.548 0.883 0 C-N-CA 124.026 0.931 . . . . 63.32 110.108 176.416 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 96.0 mt -67.95 -42.1 85.26 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.943 0 C-N-CA 123.546 0.738 . . . . 74.54 111.762 179.193 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 79.1 t -63.48 -45.72 97.1 Favored 'Isoleucine or valine' 0 CA--C 1.556 1.177 0 C-N-CA 123.325 0.65 . . . . 73.33 111.601 176.764 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 3.1 p -69.36 -26.48 31.58 Favored 'Isoleucine or valine' 0 CA--C 1.56 1.338 0 C-N-CA 122.368 0.267 . . . . 74.22 111.603 177.864 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -73.89 -55.35 6.29 Favored 'General case' 0 N--CA 1.48 1.046 0 C-N-CA 123.242 0.617 . . . . 73.23 111.272 178.673 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 12' ' ' ILE . . . . . 0.535 ' O ' ' HG ' ' A' ' 16' ' ' LEU . 16.3 pt -57.3 -53.28 45.81 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.039 0 C-N-CA 122.943 0.497 . . . . 72.3 111.435 -179.853 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 80.1 mt -66.6 -32.81 59.71 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.967 0 C-N-CA 123.777 0.831 . . . . 71.12 110.869 -179.56 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -60.81 -42.37 99.49 Favored Glycine 0 C--N 1.353 1.481 0 O-C-N 123.628 0.58 . . . . 74.44 113.651 176.796 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 1.8 mp -75.74 -34.93 29.57 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.255 0 C-N-CA 122.856 0.462 . . . . 62.54 110.408 177.249 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . 0.535 ' HG ' ' O ' ' A' ' 12' ' ' ILE . 19.3 mt -62.31 -39.06 91.79 Favored 'General case' 0 N--CA 1.489 1.523 0 C-N-CA 122.377 0.271 . . . . 73.55 111.089 176.409 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -74.28 -39.9 62.66 Favored 'General case' 0 N--CA 1.477 0.888 0 C-N-CA 123.529 0.732 . . . . 71.43 110.944 177.501 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -62.48 -24.06 67.25 Favored 'General case' 0 N--CA 1.483 1.176 0 C-N-CA 123.894 0.878 . . . . 74.3 112.947 178.835 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 2.8 pp -96.85 -37.63 7.25 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.208 0 N-CA-C 111.846 0.313 . . . . 72.54 111.846 171.723 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -67.62 -48.47 66.67 Favored 'General case' 0 N--CA 1.493 1.713 0 N-CA-C 112.891 0.701 . . . . 73.14 112.891 -173.011 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 27.9 mt -58.79 -52.56 73.85 Favored Pre-proline 0 CA--C 1.556 1.199 0 CA-C-O 118.059 -0.972 . . . . 74.21 113.18 -178.565 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 42.9 Cg_endo -67.09 -36.96 20.16 Favored 'Trans proline' 0 C--N 1.378 2.101 0 CA-C-N 121.77 1.668 . . . . 54.44 113.123 174.115 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 28.6 tt0 -66.64 -32.45 73.78 Favored 'General case' 0 N--CA 1.491 1.599 0 C-N-CA 122.854 0.462 . . . . 64.32 110.52 -177.627 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 24' ' ' PHE . . . . . . . . . . . . . 85.5 t80 -90.09 -40.06 12.51 Favored 'General case' 0 N--CA 1.487 1.396 0 CA-C-N 115.366 -0.833 . . . . 63.11 111.406 -178.5 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 34.8 t -56.91 -55.24 37.08 Favored 'General case' 0 N--CA 1.488 1.449 0 C-N-CA 122.849 0.459 . . . . 55.3 110.837 172.645 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -61.89 -26.32 68.08 Favored 'General case' 0 N--CA 1.487 1.399 0 C-N-CA 123.357 0.663 . . . . 74.53 112.571 175.336 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 57.5 t80 -70.81 -51.74 24.89 Favored 'General case' 0 N--CA 1.48 1.052 0 C-N-CA 123.119 0.568 . . . . 72.43 111.104 178.534 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 13.6 ptm180 -70.53 -21.57 62.71 Favored 'General case' 0 N--CA 1.475 0.824 0 C-N-CA 123.184 0.593 . . . . 74.32 111.108 -177.707 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 49.1 t -73.96 -52.79 19.39 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.969 0 CA-C-N 115.989 -0.551 . . . . 64.24 109.884 172.939 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 21.1 ptmt -70.74 -15.92 62.73 Favored 'General case' 0 N--CA 1.489 1.485 0 C-N-CA 122.773 0.429 . . . . 74.43 111.379 179.17 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -76.64 -36.46 57.39 Favored 'General case' 0 N--CA 1.481 1.1 0 CA-C-O 121.547 0.689 . . . . 64.01 109.737 172.964 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 33.4 t80 -83.61 -19.04 36.2 Favored 'General case' 0 N--CA 1.48 1.036 0 CA-C-N 115.133 -0.94 . . . . 74.31 111.87 -179.735 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -92.63 -56.46 3.01 Favored 'General case' 0 N--CA 1.473 0.722 0 CA-C-N 115.556 -0.747 . . . . 75.2 111.069 175.97 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 46.0 t -88.97 -51.71 5.47 Favored 'General case' 0 N--CA 1.497 1.882 0 CA-C-N 116.247 -0.433 . . . . 64.05 111.585 -168.802 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -71.7 -24.8 61.88 Favored 'General case' 0 N--CA 1.484 1.275 0 C-N-CA 122.656 0.382 . . . . 64.43 111.966 -178.148 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -79.43 -37.25 37.5 Favored 'General case' 0 N--CA 1.481 1.1 0 C-N-CA 122.478 0.311 . . . . 71.04 110.805 174.246 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 37.9 t -61.62 -43.47 98.8 Favored 'General case' 0 N--CA 1.494 1.748 0 C-N-CA 123.075 0.55 . . . . 75.15 111.507 173.245 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 80.1 p -75.83 -27.51 57.89 Favored 'General case' 0 N--CA 1.481 1.107 0 C-N-CA 124.127 0.971 . . . . 54.15 111.637 -177.909 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 16.8 t70 -63.08 -48.03 80.35 Favored 'General case' 0 CA--C 1.553 1.071 0 O-C-N 123.419 0.449 . . . . 64.35 110.712 169.159 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . 0.471 HD23 HD12 ' A' ' 43' ' ' LEU . 96.2 mt -71.04 -26.94 63.31 Favored 'General case' 0 N--CA 1.484 1.253 0 C-N-CA 123.199 0.6 . . . . 64.44 111.244 179.317 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 27.9 tpt180 -72.22 -37.84 69.09 Favored 'General case' 0 CA--C 1.548 0.883 0 C-N-CA 123.894 0.878 . . . . 64.11 110.136 174.845 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 44.7 t-20 -65.95 -38.89 89.77 Favored 'General case' 0 CA--C 1.56 1.329 0 C-N-CA 124.197 0.999 . . . . 55.35 110.36 174.447 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . 0.471 HD12 HD23 ' A' ' 40' ' ' LEU . 96.0 mt -69.5 -33.08 72.33 Favored 'General case' 0 N--CA 1.482 1.125 0 C-N-CA 123.167 0.587 . . . . 65.01 110.979 175.97 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . 0.451 ' O ' ' HG2' ' A' ' 48' ' ' GLU . 60.7 tttp -73.78 -46.42 45.71 Favored 'General case' 0 N--CA 1.474 0.767 0 CA-C-N 116.102 -0.499 . . . . 65.33 110.51 179.93 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 3.7 t -64.01 -32.27 73.75 Favored 'General case' 0 N--CA 1.487 1.389 0 C-N-CA 123.573 0.749 . . . . 70.3 111.168 -174.58 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -68.88 -43.46 75.28 Favored 'General case' 0 N--CA 1.478 0.945 0 CA-C-N 115.035 -0.984 . . . . 74.3 111.679 171.521 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 9.7 tt -60.7 -39.89 90.21 Favored 'General case' 0 N--CA 1.483 1.179 0 C-N-CA 123.976 0.911 . . . . 70.32 110.609 176.514 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 48' ' ' GLU . . . . . 0.451 ' HG2' ' O ' ' A' ' 44' ' ' LYS . 60.8 mm-40 -65.31 -47.87 75.06 Favored 'General case' 0 N--CA 1.476 0.85 0 C-N-CA 123.244 0.618 . . . . 74.53 110.499 179.988 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 59.5 m -61.33 -31.92 71.79 Favored 'General case' 0 N--CA 1.483 1.186 0 C-N-CA 123.356 0.663 . . . . 74.45 112.08 179.543 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -78.5 -52.1 9.01 Favored 'General case' 0 N--CA 1.482 1.156 0 C-N-CA 123.205 0.602 . . . . 72.52 111.965 -178.507 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 51' ' ' PHE . . . . . . . . . . . . . 70.6 m-85 . . . . . 0 N--CA 1.482 1.138 0 N-CA-C 113.482 0.919 . . . . 55.24 113.482 -170.207 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 38.8 p . . . . . 0 N--CA 1.495 1.775 0 CA-C-O 121.081 0.467 . . . . 75.44 111.229 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 44.4 mt -67.84 -19.04 65.01 Favored 'General case' 0 N--CA 1.484 1.271 0 C-N-CA 124.112 0.965 . . . . 75.51 111.846 178.64 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 46.6 mm -87.65 -48.96 14.96 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.167 0 CA-C-N 115.437 -0.801 . . . . 74.14 111.083 -175.362 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 9.0 tp10 -54.12 -47.66 71.61 Favored 'General case' 0 N--CA 1.475 0.78 0 C-N-CA 124.046 0.938 . . . . 55.02 110.959 175.941 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 3.0 pp -64.7 -37.08 86.37 Favored 'General case' 0 N--CA 1.48 1.069 0 C-N-CA 122.843 0.457 . . . . 74.34 111.951 -178.539 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 61.2 tp -59.31 -45.66 90.69 Favored 'General case' 0 CA--C 1.547 0.864 0 C-N-CA 123.495 0.718 . . . . 74.2 111.36 175.093 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 94.1 mt -68.4 -39.74 81.26 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.039 0 C-N-CA 124.272 1.029 . . . . 74.31 111.967 178.779 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 48.5 t -60.82 -47.9 91.23 Favored 'Isoleucine or valine' 0 CA--C 1.554 1.13 0 C-N-CA 123.645 0.778 . . . . 73.32 111.454 175.485 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 76.7 t -64.39 -32.16 56.49 Favored 'Isoleucine or valine' 0 CA--C 1.558 1.269 0 C-N-CA 123.323 0.649 . . . . 74.43 111.571 176.086 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -65.73 -57.22 8.54 Favored 'General case' 0 N--CA 1.482 1.156 0 C-N-CA 122.983 0.513 . . . . 72.14 111.584 176.181 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 12' ' ' ILE . . . . . 0.574 ' HA ' HD12 ' A' ' 15' ' ' ILE . 22.5 pt -66.14 -42.39 91.17 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.011 0 C-N-CA 123.548 0.739 . . . . 62.42 112.054 -175.122 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 58.2 mt -65.2 -34.88 73.57 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.13 0 C-N-CA 123.764 0.825 . . . . 71.12 110.57 174.149 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -60.67 -37.33 93.31 Favored Glycine 0 C--N 1.353 1.525 0 CA-C-N 115.674 -0.694 . . . . 42.11 112.67 174.402 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 15' ' ' ILE . . . . . 0.574 HD12 ' HA ' ' A' ' 12' ' ' ILE . 21.8 mt -71.31 -46.96 62.45 Favored 'Isoleucine or valine' 0 C--N 1.353 0.742 0 C-N-CA 123.577 0.751 . . . . 72.42 110.976 175.872 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . 0.481 ' HG ' ' O ' ' A' ' 12' ' ' ILE . 21.4 mt -56.2 -43.47 78.51 Favored 'General case' 0 N--CA 1.488 1.472 0 C-N-CA 123.378 0.671 . . . . 73.4 111.35 -178.554 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -74.78 -47.53 30.4 Favored 'General case' 0 CA--C 1.544 0.749 0 C-N-CA 123.36 0.664 . . . . 40.3 111.209 -178.078 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -63.91 -23.01 67.18 Favored 'General case' 0 N--CA 1.484 1.253 0 N-CA-C 113.037 0.755 . . . . 70.44 113.037 -177.926 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 2.7 pp -90.3 -38.19 10.58 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.195 0 CA-C-N 118.151 0.432 . . . . 72.34 111.502 171.973 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -63.96 -50.31 69.1 Favored 'General case' 0 N--CA 1.487 1.401 0 C-N-CA 123.549 0.74 . . . . 70.34 112.704 -175.309 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 28.5 mt -55.44 -55.51 39.21 Favored Pre-proline 0 CA--C 1.558 1.271 0 CA-C-O 118.149 -0.929 . . . . 53.35 113.308 -175.621 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 40.4 Cg_endo -66.31 -40.77 13.91 Favored 'Trans proline' 0 C--N 1.379 2.171 0 CA-C-N 121.323 1.508 . . . . 63.12 112.991 175.979 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 21.3 tt0 -62.56 -38.03 88.44 Favored 'General case' 0 N--CA 1.486 1.366 0 C-N-CA 123.273 0.629 . . . . 74.05 111.034 -175.595 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 24' ' ' PHE . . . . . . . . . . . . . 26.7 m-85 -96.28 -32.39 12.44 Favored 'General case' 0 N--CA 1.485 1.316 0 CA-C-N 115.082 -0.963 . . . . 63.15 112.104 -173.348 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 47.0 t -62.96 -55.11 28.72 Favored 'General case' 0 N--CA 1.49 1.567 0 N-CA-C 109.853 -0.425 . . . . 74.11 109.853 171.181 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -62.18 -27.06 68.71 Favored 'General case' 0 N--CA 1.483 1.204 0 C-N-CA 123.913 0.885 . . . . 43.33 112.495 177.749 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 87.9 t80 -65.42 -54.07 33.95 Favored 'General case' 0 N--CA 1.484 1.275 0 C-N-CA 122.745 0.418 . . . . 72.23 110.726 175.053 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 49.8 mtp180 -69.99 -24.3 63.29 Favored 'General case' 0 N--CA 1.481 1.121 0 C-N-CA 123.485 0.714 . . . . 73.21 111.8 -178.578 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 24.7 t -72.48 -46.17 56.72 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.266 0 CA-C-N 116.02 -0.537 . . . . 75.32 110.6 175.471 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 18.8 ptmt -79.02 -16.9 56.23 Favored 'General case' 0 N--CA 1.48 1.029 0 CA-C-N 115.715 -0.675 . . . . 72.31 111.114 178.178 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -81.9 -29.18 32.49 Favored 'General case' 0 N--CA 1.486 1.364 0 C-N-CA 123.233 0.613 . . . . 61.11 110.129 174.013 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 62.5 t80 -62.79 -53.77 49.14 Favored 'General case' 0 C--O 1.21 -1.013 0 N-CA-C 108.945 -0.761 . . . . 72.43 108.945 168.559 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 3.4 m-20 -57.23 -43.24 82.69 Favored 'General case' 0 N--CA 1.487 1.384 0 C-N-CA 123.898 0.879 . . . . 73.41 112.334 175.477 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 35.5 t -62.54 -65.94 0.61 Allowed 'General case' 0 N--CA 1.484 1.258 0 C-N-CA 123.17 0.588 . . . . 74.33 111.11 -179.86 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -65.09 -31.36 72.54 Favored 'General case' 0 N--CA 1.481 1.081 0 N-CA-C 113.016 0.747 . . . . 73.21 113.016 -176.165 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -69.46 -60.57 2.25 Favored 'General case' 0 N--CA 1.492 1.668 0 CA-C-N 117.608 0.186 . . . . 65.14 111.248 177.29 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 48.7 m -66.37 -25.06 66.62 Favored 'General case' 0 N--CA 1.484 1.257 0 C-N-CA 123.023 0.529 . . . . 72.33 112.401 -177.909 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 42.4 t -75.98 -39.26 56.28 Favored 'General case' 0 N--CA 1.491 1.603 0 C-N-CA 123.021 0.528 . . . . 64.03 111.088 176.163 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 28.2 t70 -58.01 -50.73 72.4 Favored 'General case' 0 N--CA 1.481 1.116 0 C-N-CA 123.059 0.544 . . . . 74.13 110.369 170.186 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 95.1 mt -65.01 -38.81 92.15 Favored 'General case' 0 N--CA 1.478 0.943 0 CA-C-N 115.066 -0.97 . . . . 71.44 110.937 -176.155 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 36.4 ttt180 -71.37 -54.49 10.58 Favored 'General case' 0 CA--C 1.542 0.644 0 C-N-CA 123.385 0.674 . . . . 64.22 110.678 -179.134 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 2.8 t-20 -57.55 -41.64 81.37 Favored 'General case' 0 N--CA 1.488 1.473 0 C-N-CA 124.059 0.943 . . . . 70.0 112.348 -175.06 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 98.1 mt -72.44 -47.14 51.35 Favored 'General case' 0 N--CA 1.48 1.069 0 C-N-CA 122.924 0.49 . . . . 70.23 111.083 -179.675 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 36.4 ttpt -67.27 -46.33 73.97 Favored 'General case' 0 N--CA 1.481 1.09 0 C-N-CA 123.525 0.73 . . . . 73.43 110.967 -173.893 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 45' ' ' THR . . . . . 0.519 ' HA ' ' HG2' ' A' ' 48' ' ' GLU . 1.8 t -71.76 -33.86 68.99 Favored 'General case' 0 N--CA 1.472 0.655 0 CA-C-N 115.056 -0.974 . . . . 72.24 111.357 -173.936 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -68.81 -43.06 76.38 Favored 'General case' 0 N--CA 1.475 0.791 0 CA-C-N 115.885 -0.598 . . . . 71.52 110.492 176.513 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 1.8 pp -75.96 -32.99 59.78 Favored 'General case' 0 N--CA 1.481 1.104 0 C-N-CA 122.653 0.381 . . . . 74.4 111.61 -177.073 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 48' ' ' GLU . . . . . 0.519 ' HG2' ' HA ' ' A' ' 45' ' ' THR . 11.0 pt-20 -78.6 -36.07 44.81 Favored 'General case' 0 N--CA 1.489 1.513 0 CA-C-N 117.756 0.253 . . . . 53.05 111.314 -178.208 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 67.8 m -68.59 -35.0 76.75 Favored 'General case' 0 N--CA 1.485 1.315 0 C-N-CA 123.083 0.553 . . . . 74.53 110.326 173.334 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -65.83 -42.9 89.99 Favored 'General case' 0 N--CA 1.474 0.739 0 CA-C-N 115.397 -0.819 . . . . 73.52 110.657 172.825 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 51' ' ' PHE . . . . . . . . . . . . . 61.0 t80 . . . . . 0 N--CA 1.483 1.182 0 C-N-CA 123.783 0.833 . . . . 74.31 111.468 178.994 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 2' ' ' THR . . . . . 0.595 HG22 ' H ' ' A' ' 4' ' ' ILE . 22.1 m . . . . . 0 N--CA 1.482 1.165 0 CA-C-O 120.631 0.253 . . . . 73.34 111.3 . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 2.8 mm? -64.63 -18.16 64.68 Favored 'General case' 0 N--CA 1.49 1.563 0 C-N-CA 123.923 0.889 . . . . 73.43 111.908 178.859 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 4' ' ' ILE . . . . . 0.595 ' H ' HG22 ' A' ' 2' ' ' THR . 50.6 mm -71.18 -39.68 73.78 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.267 0 C-N-CA 123.599 0.76 . . . . 72.22 110.276 175.223 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 43.3 mt-10 -54.82 -48.26 73.04 Favored 'General case' 0 N--CA 1.485 1.275 0 C-N-CA 123.044 0.538 . . . . 65.23 111.407 175.671 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -60.96 -37.29 81.86 Favored 'General case' 0 N--CA 1.488 1.454 0 O-C-N 123.567 0.542 . . . . 73.5 110.733 -179.311 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 34.0 tp -68.6 -34.06 75.12 Favored 'General case' 0 CA--C 1.551 1.016 0 C-N-CA 123.455 0.702 . . . . 73.3 112.222 179.77 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 89.1 mt -73.62 -45.69 50.25 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.639 0 C-N-CA 123.355 0.662 . . . . 72.05 110.943 175.392 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 73.3 t -62.1 -42.93 96.93 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.868 0 C-N-CA 123.624 0.77 . . . . 51.32 111.618 179.493 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 6.1 p -68.93 -31.45 50.59 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.074 0 O-C-N 122.205 -0.309 . . . . 74.14 111.519 177.321 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -69.07 -53.49 20.07 Favored 'General case' 0 C--N 1.361 1.087 0 C-N-CA 122.775 0.43 . . . . 73.1 111.437 178.661 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 12' ' ' ILE . . . . . 0.587 ' HA ' HD12 ' A' ' 15' ' ' ILE . 29.6 pt -65.17 -45.57 93.58 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.953 0 C-N-CA 123.306 0.643 . . . . 63.25 111.636 -178.346 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 1.7 mp -61.93 -32.89 55.6 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.532 0 C-N-CA 123.717 0.807 . . . . 74.4 110.457 174.253 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -58.91 -40.3 95.11 Favored Glycine 0 C--N 1.355 1.614 0 O-C-N 123.5 0.5 . . . . 53.11 112.618 174.146 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 15' ' ' ILE . . . . . 0.587 HD12 ' HA ' ' A' ' 12' ' ' ILE . 19.2 mt -72.13 -46.81 57.09 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.748 0 C-N-CA 124.049 0.94 . . . . 71.14 110.902 175.843 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . 0.527 ' HG ' ' O ' ' A' ' 12' ' ' ILE . 25.6 mt -59.74 -37.77 79.89 Favored 'General case' 0 N--CA 1.482 1.137 0 C-N-CA 123.549 0.739 . . . . 63.11 111.6 -176.749 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -75.97 -48.03 22.7 Favored 'General case' 0 N--CA 1.474 0.756 0 C-N-CA 123.103 0.561 . . . . 63.21 110.381 178.344 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -56.92 -26.85 60.09 Favored 'General case' 0 N--CA 1.481 1.087 0 N-CA-C 113.249 0.833 . . . . 70.44 113.249 -179.139 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 2.8 pp -91.18 -38.27 10.37 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.982 0 N-CA-C 111.758 0.281 . . . . 63.13 111.758 172.117 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -64.72 -50.41 67.04 Favored 'General case' 0 N--CA 1.489 1.483 0 N-CA-C 113.204 0.816 . . . . 71.13 113.204 -171.374 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 2.4 mp -63.78 -53.06 53.21 Favored Pre-proline 0 CA--C 1.563 1.451 0 CA-C-O 118.544 -0.741 . . . . 71.22 112.461 -174.035 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 36.7 Cg_endo -63.7 -35.49 57.68 Favored 'Trans proline' 0 C--N 1.38 2.194 0 C-N-CA 121.895 1.73 . . . . 70.03 113.374 175.025 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 29.9 tt0 -66.14 -38.78 88.96 Favored 'General case' 0 N--CA 1.487 1.382 0 C-N-CA 123.034 0.533 . . . . 71.32 110.259 179.899 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 24' ' ' PHE . . . . . . . . . . . . . 79.9 t80 -79.69 -38.79 32.75 Favored 'General case' 0 N--CA 1.487 1.423 0 CA-C-N 114.742 -1.117 . . . . 71.13 110.67 -176.241 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . 0.404 ' O ' HG23 ' A' ' 29' ' ' VAL . 47.8 t -56.44 -59.19 5.33 Favored 'General case' 0 N--CA 1.475 0.798 0 C-N-CA 123.696 0.798 . . . . 75.02 109.244 172.25 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -57.56 -29.31 64.32 Favored 'General case' 0 N--CA 1.48 1.057 0 C-N-CA 124.141 0.976 . . . . 54.1 112.652 177.444 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 64.3 t80 -75.19 -47.92 26.04 Favored 'General case' 0 N--CA 1.483 1.196 0 C-N-CA 123.173 0.589 . . . . 62.32 111.361 -177.145 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 40.6 ptt180 -78.28 -21.38 49.84 Favored 'General case' 0 N--CA 1.48 1.044 0 CA-C-N 115.589 -0.732 . . . . 72.05 110.935 -178.92 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . 0.404 HG23 ' O ' ' A' ' 25' ' ' SER . 42.9 t -72.99 -54.42 15.83 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.027 0 N-CA-C 109.485 -0.561 . . . . 72.33 109.485 172.797 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 14.3 ptmm? -65.29 -20.27 66.33 Favored 'General case' 0 N--CA 1.489 1.519 0 C-N-CA 122.49 0.316 . . . . 64.43 111.235 178.541 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -68.62 -44.86 73.34 Favored 'General case' 0 N--CA 1.476 0.859 0 CA-C-O 121.404 0.621 . . . . 64.23 109.94 170.531 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 30.9 t80 -83.8 -12.02 56.24 Favored 'General case' 0 N--CA 1.481 1.108 0 CA-C-N 114.97 -1.013 . . . . 73.31 112.543 -177.066 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -96.57 -54.11 3.35 Favored 'General case' 0 N--CA 1.478 0.971 0 C-N-CA 123.441 0.696 . . . . 73.34 110.432 176.874 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 46.6 t -77.7 -51.24 10.89 Favored 'General case' 0 N--CA 1.494 1.754 0 CA-C-N 115.98 -0.555 . . . . 72.02 111.658 -171.139 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -68.72 -28.73 67.09 Favored 'General case' 0 N--CA 1.483 1.182 0 C-N-CA 122.602 0.361 . . . . 53.33 111.567 179.647 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -69.98 -42.82 72.62 Favored 'General case' 0 N--CA 1.482 1.14 0 C-N-CA 122.49 0.316 . . . . 62.42 111.024 175.122 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . 0.42 ' O ' ' HG2' ' A' ' 41' ' ' ARG . 71.1 m -59.86 -46.84 88.02 Favored 'General case' 0 N--CA 1.482 1.169 0 C-N-CA 122.807 0.443 . . . . 61.21 110.797 173.406 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 50.6 m -66.69 -31.55 72.29 Favored 'General case' 0 N--CA 1.481 1.113 0 C-N-CA 123.664 0.785 . . . . 72.43 112.031 -178.354 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 28.8 t70 -60.21 -51.03 71.29 Favored 'General case' 0 N--CA 1.477 0.882 0 C-N-CA 123.24 0.616 . . . . 75.44 110.454 171.052 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 85.7 mt -70.89 -30.93 67.42 Favored 'General case' 0 N--CA 1.481 1.119 0 C-N-CA 123.388 0.675 . . . . 51.42 111.585 -175.769 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 41' ' ' ARG . . . . . 0.42 ' HG2' ' O ' ' A' ' 37' ' ' SER . 14.7 mmt180 -78.32 -32.74 49.41 Favored 'General case' 0 N--CA 1.48 1.067 0 CA-C-N 115.777 -0.647 . . . . 72.31 110.408 177.853 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 64.1 t30 -64.93 -38.87 92.4 Favored 'General case' 0 N--CA 1.484 1.248 0 C-N-CA 123.14 0.576 . . . . 74.3 110.432 172.56 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . 0.491 ' O ' HD13 ' A' ' 47' ' ' LEU . 94.3 mt -70.42 -42.69 71.29 Favored 'General case' 0 N--CA 1.479 1.0 0 C-N-CA 123.304 0.641 . . . . 64.14 110.407 178.607 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . 0.483 ' O ' ' HG2' ' A' ' 48' ' ' GLU . 3.7 tppp? -68.84 -51.06 44.55 Favored 'General case' 0 N--CA 1.466 0.353 0 CA-C-N 115.934 -0.576 . . . . 63.13 110.074 -175.487 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 1.7 t -61.84 -33.6 74.46 Favored 'General case' 0 N--CA 1.486 1.328 0 C-N-CA 123.933 0.893 . . . . 60.32 111.786 -178.392 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -63.62 -47.69 80.35 Favored 'General case' 0 N--CA 1.482 1.165 0 C-N-CA 123.757 0.823 . . . . 72.12 111.41 174.926 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 47' ' ' LEU . . . . . 0.491 HD13 ' O ' ' A' ' 43' ' ' LEU . 9.2 mp -65.49 -41.22 93.49 Favored 'General case' 0 CA--C 1.554 1.118 0 CA-C-N 115.51 -0.768 . . . . 75.13 111.791 176.559 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 48' ' ' GLU . . . . . 0.483 ' HG2' ' O ' ' A' ' 44' ' ' LYS . 11.2 mm-40 -65.48 -41.96 92.73 Favored 'General case' 0 N--CA 1.482 1.161 0 C-N-CA 122.553 0.341 . . . . 75.24 110.839 -178.346 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 68.1 m -69.79 -28.01 65.38 Favored 'General case' 0 N--CA 1.485 1.315 0 C-N-CA 123.191 0.596 . . . . 63.32 112.037 177.725 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -75.66 -53.15 9.02 Favored 'General case' 0 N--CA 1.48 1.036 0 C-N-CA 122.891 0.476 . . . . 72.32 110.765 -178.15 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 51' ' ' PHE . . . . . . . . . . . . . 44.9 m-85 . . . . . 0 N--CA 1.482 1.15 0 CA-C-N 115.176 -0.92 . . . . 71.32 112.569 -174.868 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 66.2 p . . . . . 0 N--CA 1.494 1.751 0 N-CA-C 112.066 0.395 . . . . 72.24 112.066 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 3' ' ' LEU . . . . . 0.403 HD23 HD12 ' A' ' 6' ' ' LEU . 63.0 mt -57.33 -23.41 48.64 Favored 'General case' 0 N--CA 1.487 1.396 0 C-N-CA 123.828 0.851 . . . . 64.1 111.54 174.285 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 50.7 mm -66.79 -53.29 36.08 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.873 0 CA-C-N 115.155 -0.929 . . . . 72.33 110.339 172.83 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 48.2 mm-40 -64.45 -31.76 73.11 Favored 'General case' 0 N--CA 1.485 1.318 0 C-N-CA 123.546 0.738 . . . . 65.42 112.366 179.654 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 6' ' ' LEU . . . . . 0.403 HD12 HD23 ' A' ' 3' ' ' LEU . 92.9 mt -66.59 -45.33 79.57 Favored 'General case' 0 N--CA 1.481 1.085 0 C-N-CA 123.242 0.617 . . . . 43.43 110.923 173.935 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 40.9 tp -58.85 -43.28 90.75 Favored 'General case' 0 CA--C 1.551 1.004 0 C-N-CA 123.411 0.685 . . . . 72.11 111.488 175.378 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 96.6 mt -67.99 -47.36 79.26 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.866 0 C-N-CA 124.227 1.011 . . . . 71.34 112.927 179.626 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 8.3 p -64.67 -40.24 88.39 Favored 'Isoleucine or valine' 0 C--N 1.357 0.901 0 CA-C-N 118.44 0.563 . . . . 35.32 111.481 -177.812 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 76.6 t -66.67 -39.14 83.07 Favored 'Isoleucine or valine' 0 CA--C 1.555 1.141 0 C-N-CA 123.13 0.572 . . . . 73.11 111.026 173.827 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -64.91 -47.42 77.84 Favored 'General case' 0 N--CA 1.482 1.133 0 C-N-CA 122.941 0.497 . . . . 74.2 111.853 -179.84 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 12' ' ' ILE . . . . . 0.618 ' HA ' HD12 ' A' ' 15' ' ' ILE . 2.7 pp -68.89 -40.16 80.81 Favored 'Isoleucine or valine' 0 C--N 1.355 0.81 0 CA-C-O 119.042 -0.504 . . . . 72.32 111.416 -177.261 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 58.5 mt -60.92 -33.32 55.11 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.253 0 C-N-CA 123.564 0.746 . . . . 75.32 110.95 173.289 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -59.87 -43.44 98.01 Favored Glycine 0 C--N 1.352 1.444 0 CA-C-N 115.882 -0.599 . . . . 74.43 112.548 173.111 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 15' ' ' ILE . . . . . 0.618 HD12 ' HA ' ' A' ' 12' ' ' ILE . 18.7 mt -70.33 -43.94 77.97 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.738 0 C-N-CA 123.528 0.731 . . . . 74.02 111.066 178.455 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . 0.513 ' HG ' ' O ' ' A' ' 12' ' ' ILE . 23.8 mt -57.62 -41.67 81.8 Favored 'General case' 0 N--CA 1.483 1.18 0 C-N-CA 123.346 0.658 . . . . 64.44 111.121 -177.996 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -70.72 -51.16 29.22 Favored 'General case' 0 N--CA 1.474 0.757 0 CA-C-O 121.239 0.543 . . . . 60.33 110.8 178.592 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -61.35 -21.59 64.15 Favored 'General case' 0 CA--C 1.55 0.979 0 N-CA-C 113.372 0.878 . . . . 73.22 113.372 -177.266 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 2.7 pp -94.2 -39.18 10.19 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.09 0 CA-C-N 118.004 0.366 . . . . 72.01 111.782 172.387 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -69.56 -52.78 23.03 Favored 'General case' 0 N--CA 1.485 1.295 0 N-CA-C 112.42 0.526 . . . . 62.51 112.42 -171.415 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 2.4 mp -54.51 -54.97 42.72 Favored Pre-proline 0 CA--C 1.568 1.641 0 CA-C-O 118.119 -0.943 . . . . 73.12 112.272 -176.722 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 29.0 Cg_endo -63.2 -42.75 21.44 Favored 'Trans proline' 0 C--N 1.381 2.282 0 C-N-CA 121.963 1.775 . . . . 74.15 113.64 176.823 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 6.3 tt0 -62.76 -42.29 99.61 Favored 'General case' 0 N--CA 1.486 1.366 0 C-N-CA 124.061 0.944 . . . . 75.51 110.996 -175.333 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 24' ' ' PHE . . . . . . . . . . . . . 44.4 m-85 -90.62 -25.68 20.02 Favored 'General case' 0 N--CA 1.482 1.128 0 CA-C-N 114.27 -1.332 . . . . 72.33 111.136 -174.764 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 43.9 t -63.62 -59.23 4.87 Favored 'General case' 0 N--CA 1.48 1.04 0 N-CA-C 108.644 -0.872 . . . . 52.45 108.644 170.069 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -55.84 -32.65 63.81 Favored 'General case' 0 N--CA 1.479 1.019 0 C-N-CA 123.841 0.856 . . . . 72.13 112.971 177.222 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 19.6 t80 -72.74 -49.6 30.02 Favored 'General case' 0 N--CA 1.486 1.353 0 C-N-CA 123.168 0.587 . . . . 62.43 111.822 -179.6 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 70.4 mtp180 -81.36 -16.19 53.05 Favored 'General case' 0 N--CA 1.48 1.072 0 C-N-CA 123.286 0.635 . . . . 62.54 111.62 -177.076 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 73.5 t -90.17 -32.43 5.52 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.635 0 C-N-CA 122.651 0.381 . . . . 74.42 110.828 175.365 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 19.3 ptmt -74.14 -23.83 59.33 Favored 'General case' 0 N--CA 1.488 1.464 0 N-CA-C 109.279 -0.637 . . . . 72.43 109.279 170.121 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -72.74 -36.56 67.77 Favored 'General case' 0 C--N 1.359 0.988 0 C-N-CA 122.778 0.431 . . . . 63.15 110.094 171.887 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 83.1 t80 -60.02 -56.41 22.05 Favored 'General case' 0 N--CA 1.478 0.926 0 CA-C-N 115.688 -0.687 . . . . 64.2 110.02 171.71 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 5.4 m-20 -55.49 -53.71 52.92 Favored 'General case' 0 N--CA 1.48 1.057 0 C-N-CA 124.505 1.122 . . . . 71.11 112.683 177.985 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 32.1 t -66.87 -52.33 44.8 Favored 'General case' 0 N--CA 1.492 1.63 0 C-N-CA 122.92 0.488 . . . . 62.22 111.811 -173.821 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -64.0 -42.51 97.14 Favored 'General case' 0 N--CA 1.475 0.82 0 CA-C-O 119.094 -0.479 . . . . 62.32 111.832 179.347 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -66.33 -48.38 70.45 Favored 'General case' 0 N--CA 1.495 1.825 0 N-CA-C 111.942 0.349 . . . . 64.04 111.942 -177.931 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . 0.494 ' O ' ' HG2' ' A' ' 41' ' ' ARG . 70.9 m -63.38 -49.44 73.81 Favored 'General case' 0 N--CA 1.483 1.183 0 C-N-CA 123.284 0.634 . . . . 74.32 111.612 179.689 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 47.1 t -72.78 -26.63 61.6 Favored 'General case' 0 N--CA 1.486 1.365 0 N-CA-C 112.337 0.495 . . . . 63.12 112.337 -177.678 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 27.6 t70 -62.52 -49.79 73.94 Favored 'General case' 0 N--CA 1.482 1.131 0 C-N-CA 122.758 0.423 . . . . 64.02 111.206 171.514 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . 0.417 ' HG ' ' O ' ' A' ' 37' ' ' SER . 4.0 pp -72.34 -21.92 61.25 Favored 'General case' 0 N--CA 1.488 1.44 0 CA-C-O 120.758 0.314 . . . . 72.31 111.315 -175.274 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 41' ' ' ARG . . . . . 0.494 ' HG2' ' O ' ' A' ' 37' ' ' SER . 27.1 mmt180 -80.1 -39.72 29.01 Favored 'General case' 0 N--CA 1.485 1.281 0 C-N-CA 123.13 0.572 . . . . 75.51 110.758 171.95 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 42' ' ' ASN . . . . . 0.411 ' O ' HG22 ' A' ' 45' ' ' THR . 61.1 t30 -68.02 -40.77 82.88 Favored 'General case' 0 N--CA 1.488 1.464 0 C-N-CA 123.534 0.734 . . . . 74.11 112.408 -178.095 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 4.3 pp -72.89 -29.87 63.49 Favored 'General case' 0 N--CA 1.485 1.318 0 O-C-N 122.083 -0.386 . . . . 52.54 110.727 177.025 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 44.5 tttm -67.86 -40.22 83.68 Favored 'General case' 0 N--CA 1.471 0.612 0 C-N-CA 123.517 0.727 . . . . 64.42 109.81 174.708 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 45' ' ' THR . . . . . 0.54 ' HA ' ' HG2' ' A' ' 48' ' ' GLU . 0.9 OUTLIER -77.97 -31.49 50.82 Favored 'General case' 0 N--CA 1.483 1.18 0 CA-C-N 115.414 -0.812 . . . . 70.11 111.258 -171.501 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -63.57 -46.77 84.36 Favored 'General case' 0 CA--C 1.547 0.836 0 C-N-CA 123.986 0.914 . . . . 51.35 110.888 171.306 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 87.2 mt -67.83 -43.6 79.18 Favored 'General case' 0 N--CA 1.481 1.123 0 C-N-CA 123.729 0.811 . . . . 73.31 112.581 179.354 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 48' ' ' GLU . . . . . 0.54 ' HG2' ' HA ' ' A' ' 45' ' ' THR . 11.3 pt-20 -71.95 -26.74 62.4 Favored 'General case' 0 N--CA 1.483 1.207 0 O-C-N 122.153 -0.342 . . . . 43.13 111.395 -176.246 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 57.1 m -73.05 -30.0 63.39 Favored 'General case' 0 N--CA 1.49 1.559 0 C-N-CA 122.954 0.501 . . . . 73.5 111.209 169.823 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -76.52 -27.7 56.1 Favored 'General case' 0 N--CA 1.482 1.17 0 C-N-CA 124.151 0.981 . . . . 55.15 112.428 -176.41 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 51' ' ' PHE . . . . . . . . . . . . . 96.5 m-85 . . . . . 0 N--CA 1.483 1.211 0 C-N-CA 123.965 0.906 . . . . 74.34 111.04 177.711 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 2' ' ' THR . . . . . 0.603 HG22 ' H ' ' A' ' 4' ' ' ILE . 16.6 m . . . . . 0 N--CA 1.487 1.385 0 N-CA-C 112.462 0.541 . . . . 73.43 112.462 . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 49.7 tp -57.5 -26.51 61.41 Favored 'General case' 0 N--CA 1.483 1.179 0 C-N-CA 124.124 0.97 . . . . 71.54 111.808 175.649 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 4' ' ' ILE . . . . . 0.603 ' H ' HG22 ' A' ' 2' ' ' THR . 52.1 mm -67.37 -41.97 86.91 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.148 0 CA-C-N 115.959 -0.564 . . . . 75.32 110.717 175.622 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 5' ' ' GLU . . . . . 0.409 ' HA ' HD12 ' A' ' 8' ' ' ILE . 44.3 mt-10 -64.68 -36.35 84.0 Favored 'General case' 0 N--CA 1.488 1.461 0 C-N-CA 123.543 0.737 . . . . 64.13 111.123 175.854 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 6' ' ' LEU . . . . . 0.448 ' HA ' HG12 ' A' ' 9' ' ' VAL . 77.2 mt -69.11 -33.49 73.57 Favored 'General case' 0 N--CA 1.476 0.83 0 CA-C-N 115.524 -0.762 . . . . 74.22 111.296 174.289 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 26.9 tp -69.55 -33.35 72.64 Favored 'General case' 0 CA--C 1.56 1.327 0 C-N-CA 123.156 0.582 . . . . 74.42 111.346 174.522 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 8' ' ' ILE . . . . . 0.439 HG13 ' O ' ' A' ' 4' ' ' ILE . 77.8 mt -68.68 -49.39 65.0 Favored 'Isoleucine or valine' 0 C--N 1.363 1.178 0 C-N-CA 123.399 0.68 . . . . 71.15 111.412 175.935 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . 0.448 HG12 ' HA ' ' A' ' 6' ' ' LEU . 8.6 p -63.31 -38.1 81.23 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.972 0 C-N-CA 122.787 0.435 . . . . 61.12 111.852 -179.33 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 44.4 t -66.9 -36.57 77.49 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.064 0 C-N-CA 123.155 0.582 . . . . 75.21 111.889 172.418 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -66.94 -56.42 10.29 Favored 'General case' 0 N--CA 1.485 1.286 0 N-CA-C 111.821 0.304 . . . . 74.44 111.821 178.284 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 12' ' ' ILE . . . . . 0.526 ' O ' ' HG ' ' A' ' 16' ' ' LEU . 28.8 pt -59.9 -50.82 78.65 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.913 0 C-N-CA 122.992 0.517 . . . . 61.42 111.83 -175.473 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 81.4 mt -69.73 -31.12 47.33 Favored 'Isoleucine or valine' 0 C--N 1.36 1.064 0 C-N-CA 123.589 0.756 . . . . 63.23 110.092 -179.233 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -61.28 -34.27 87.56 Favored Glycine 0 C--N 1.349 1.284 0 CA-C-N 115.894 -0.594 . . . . 73.02 113.533 174.335 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 1.7 mp -79.85 -44.61 23.05 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.99 0 C-N-CA 122.934 0.494 . . . . 61.33 110.085 175.484 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . 0.526 ' HG ' ' O ' ' A' ' 12' ' ' ILE . 31.9 mt -54.52 -42.64 71.06 Favored 'General case' 0 N--CA 1.488 1.43 0 C-N-CA 123.13 0.572 . . . . 74.14 111.324 -179.463 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -77.06 -48.73 17.03 Favored 'General case' 0 CA--C 1.55 0.969 0 C-N-CA 123.356 0.662 . . . . 75.42 111.378 179.337 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -55.78 -27.19 49.79 Favored 'General case' 0 N--CA 1.493 1.711 0 N-CA-C 113.182 0.808 . . . . 44.4 113.182 -178.863 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 2.8 pp -90.54 -35.85 7.71 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.105 0 N-CA-C 112.067 0.395 . . . . 71.5 112.067 173.097 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -67.63 -45.71 74.58 Favored 'General case' 0 N--CA 1.484 1.228 0 C-N-CA 123.224 0.609 . . . . 50.51 111.972 -172.639 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 1.9 mp -59.4 -52.98 70.46 Favored Pre-proline 0 CA--C 1.571 1.766 0 CA-C-O 118.486 -0.768 . . . . 60.4 112.478 -177.141 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 40.1 Cg_endo -66.66 -36.4 25.19 Favored 'Trans proline' 0 C--N 1.381 2.27 0 C-N-CA 121.911 1.74 . . . . 71.23 113.498 173.356 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 28.8 tt0 -66.58 -30.93 71.34 Favored 'General case' 0 N--CA 1.495 1.815 0 C-N-CA 123.133 0.573 . . . . 71.03 111.16 -178.096 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 24' ' ' PHE . . . . . . . . . . . . . 75.1 t80 -91.15 -40.13 11.75 Favored 'General case' 0 N--CA 1.489 1.482 0 CA-C-N 115.179 -0.919 . . . . 65.44 110.782 -176.6 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . 0.442 ' O ' HG23 ' A' ' 29' ' ' VAL . 48.2 t -60.41 -55.47 33.15 Favored 'General case' 0 N--CA 1.479 1.003 0 C-N-CA 123.204 0.602 . . . . 64.45 110.051 174.669 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -64.7 -22.64 67.03 Favored 'General case' 0 N--CA 1.483 1.21 0 C-N-CA 123.74 0.816 . . . . 74.34 112.525 177.252 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 80.4 t80 -66.95 -47.59 71.17 Favored 'General case' 0 N--CA 1.48 1.063 0 CA-C-O 121.088 0.471 . . . . 64.25 110.206 172.92 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 19.9 mtp180 -72.41 -23.1 61.04 Favored 'General case' 0 N--CA 1.474 0.759 0 CA-C-N 115.196 -0.911 . . . . 65.0 111.173 179.806 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . 0.442 HG23 ' O ' ' A' ' 25' ' ' SER . 68.7 t -69.59 -50.79 47.43 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.184 0 N-CA-C 109.909 -0.404 . . . . 63.15 109.909 173.791 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . 0.469 ' HA ' ' HB3' ' A' ' 33' ' ' ASN . 14.7 ptmm? -75.71 -13.96 60.33 Favored 'General case' 0 N--CA 1.484 1.246 0 C-N-CA 122.862 0.465 . . . . 71.44 111.782 178.836 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -74.14 -40.69 62.45 Favored 'General case' 0 N--CA 1.481 1.088 0 CA-C-O 121.647 0.737 . . . . 65.11 109.593 172.393 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 32' ' ' TYR . . . . . 0.444 ' O ' ' HB3' ' A' ' 36' ' ' ALA . 36.2 t80 -85.77 -18.83 31.88 Favored 'General case' 0 N--CA 1.48 1.034 0 CA-C-N 115.068 -0.969 . . . . 73.31 111.582 -179.29 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 33' ' ' ASN . . . . . 0.469 ' HB3' ' HA ' ' A' ' 30' ' ' LYS . 27.8 t-20 -84.6 -63.24 1.37 Allowed 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 115.585 -0.734 . . . . 63.33 109.971 174.965 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 20.3 m -80.45 -51.46 8.79 Favored 'General case' 0 N--CA 1.487 1.409 0 CA-C-N 115.258 -0.883 . . . . 70.35 111.379 -166.539 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -70.21 -38.64 75.34 Favored 'General case' 0 N--CA 1.481 1.097 0 N-CA-C 111.613 0.227 . . . . 63.15 111.613 -178.281 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . 0.444 ' HB3' ' O ' ' A' ' 32' ' ' TYR . . . -69.82 -41.11 75.42 Favored 'General case' 0 N--CA 1.482 1.17 0 N-CA-C 111.425 0.157 . . . . 71.25 111.425 -179.07 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 68.0 m -67.38 -28.76 68.2 Favored 'General case' 0 N--CA 1.487 1.377 0 C-N-CA 122.45 0.3 . . . . 72.12 111.807 172.776 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 43.0 t -72.14 -37.88 69.34 Favored 'General case' 0 N--CA 1.484 1.256 0 C-N-CA 122.69 0.396 . . . . 44.34 111.128 176.399 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 33.1 m-20 -62.85 -49.05 76.42 Favored 'General case' 0 CA--C 1.544 0.72 0 C-N-CA 123.253 0.621 . . . . 75.24 111.084 170.013 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 73.5 mt -66.56 -32.69 74.2 Favored 'General case' 0 N--CA 1.487 1.405 0 C-N-CA 122.473 0.309 . . . . 62.53 111.066 -176.139 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 33.7 ttm180 -73.08 -47.68 42.42 Favored 'General case' 0 CA--C 1.537 0.444 0 C-N-CA 123.353 0.661 . . . . 74.1 110.016 177.871 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 66.2 t30 -62.71 -33.51 75.27 Favored 'General case' 0 N--CA 1.484 1.271 0 CA-C-N 115.436 -0.802 . . . . 63.5 112.162 179.748 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 91.7 mt -79.57 -37.8 35.56 Favored 'General case' 0 N--CA 1.481 1.1 0 C-N-CA 123.0 0.52 . . . . 72.21 110.717 179.938 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . 0.463 ' O ' ' HG2' ' A' ' 48' ' ' GLU . 0.8 OUTLIER -74.31 -43.54 56.33 Favored 'General case' 0 N--CA 1.476 0.845 0 N-CA-C 109.645 -0.502 . . . . 63.43 109.645 -176.077 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 3.0 t -65.82 -31.12 71.91 Favored 'General case' 0 N--CA 1.483 1.201 0 C-N-CA 123.428 0.691 . . . . 60.35 110.916 178.141 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -69.36 -31.92 70.65 Favored 'General case' 0 N--CA 1.479 1.001 0 CA-C-N 115.209 -0.905 . . . . 72.32 111.477 173.605 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 97.9 mt -67.45 -50.35 59.58 Favored 'General case' 0 N--CA 1.483 1.212 0 C-N-CA 122.768 0.427 . . . . 65.12 110.779 170.842 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 48' ' ' GLU . . . . . 0.463 ' HG2' ' O ' ' A' ' 44' ' ' LYS . 5.7 mm-40 -60.76 -35.05 75.44 Favored 'General case' 0 N--CA 1.493 1.702 0 C-N-CA 122.954 0.502 . . . . 73.25 110.797 -179.438 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 37.9 t -67.41 -58.77 4.16 Favored 'General case' 0 CA--C 1.54 0.583 0 CA-C-N 115.457 -0.792 . . . . 44.53 110.499 175.272 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -60.85 -38.13 84.46 Favored 'General case' 0 N--CA 1.487 1.415 0 C-N-CA 123.813 0.845 . . . . 74.1 112.17 -172.03 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 51' ' ' PHE . . . . . . . . . . . . . 2.7 m-85 . . . . . 0 CA--C 1.542 0.65 0 CA-C-N 115.061 -0.972 . . . . 73.32 110.366 178.968 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 2' ' ' THR . . . . . 0.477 HG23 ' H ' ' A' ' 5' ' ' GLU . 4.1 t . . . . . 0 N--CA 1.488 1.449 0 CA-C-O 120.668 0.27 . . . . 73.14 110.982 . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 4.6 pp -63.36 -18.18 63.38 Favored 'General case' 0 N--CA 1.481 1.078 0 C-N-CA 123.942 0.897 . . . . 74.13 111.391 177.423 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 50.2 mm -64.06 -54.68 28.4 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.807 0 C-N-CA 123.436 0.695 . . . . 75.12 110.325 174.702 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 5' ' ' GLU . . . . . 0.477 ' H ' HG23 ' A' ' 2' ' ' THR . 42.7 mm-40 -66.84 -29.84 69.87 Favored 'General case' 0 N--CA 1.481 1.087 0 C-N-CA 122.958 0.503 . . . . 63.13 112.113 178.476 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 95.0 mt -67.62 -42.1 82.92 Favored 'General case' 0 N--CA 1.481 1.122 0 C-N-CA 122.966 0.507 . . . . 64.24 111.403 174.068 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -60.69 -50.37 73.76 Favored 'General case' 0 CA--C 1.555 1.172 0 C-N-CA 123.817 0.847 . . . . 65.35 109.962 176.283 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 96.5 mt -63.79 -46.37 94.61 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.869 0 C-N-CA 124.207 1.003 . . . . 55.02 112.603 -178.749 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 6.4 p -65.37 -38.83 83.49 Favored 'Isoleucine or valine' 0 CA--C 1.551 1.011 0 C-N-CA 122.694 0.398 . . . . 72.15 111.181 -178.482 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 8.9 t -66.12 -37.41 79.7 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.083 0 C-N-CA 123.403 0.681 . . . . 41.43 111.578 172.485 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -66.27 -51.68 55.05 Favored 'General case' 0 N--CA 1.48 1.031 0 C-N-CA 123.02 0.528 . . . . 51.43 111.546 -179.066 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 12' ' ' ILE . . . . . 0.545 ' HA ' HD12 ' A' ' 15' ' ' ILE . 20.8 pt -67.49 -44.71 86.5 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.935 0 C-N-CA 123.231 0.613 . . . . 73.23 111.823 -176.878 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 82.4 mt -64.37 -32.67 58.59 Favored 'Isoleucine or valine' 0 C--N 1.361 1.099 0 C-N-CA 123.614 0.766 . . . . 73.15 110.427 174.35 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -61.77 -36.95 93.5 Favored Glycine 0 C--N 1.349 1.291 0 CA-C-N 115.558 -0.746 . . . . 63.14 112.914 175.169 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 15' ' ' ILE . . . . . 0.545 HD12 ' HA ' ' A' ' 12' ' ' ILE . 22.9 mt -70.76 -42.91 77.62 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.904 0 C-N-CA 123.852 0.861 . . . . 74.52 110.705 175.343 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . 0.508 ' HG ' ' O ' ' A' ' 12' ' ' ILE . 28.6 mt -60.99 -38.36 85.71 Favored 'General case' 0 N--CA 1.482 1.137 0 C-N-CA 123.361 0.664 . . . . 63.23 111.256 -179.948 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -74.36 -48.32 28.8 Favored 'General case' 0 CA--C 1.55 0.966 0 C-N-CA 123.218 0.607 . . . . 72.41 110.754 176.251 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -57.74 -22.83 48.85 Favored 'General case' 0 N--CA 1.487 1.379 0 N-CA-C 113.602 0.964 . . . . 61.14 113.602 -179.287 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 2.8 pp -94.79 -35.56 6.22 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.218 0 N-CA-C 112.07 0.396 . . . . 73.2 112.07 171.687 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -66.71 -46.66 74.83 Favored 'General case' 0 N--CA 1.484 1.275 0 C-N-CA 123.381 0.673 . . . . 74.25 112.471 -172.586 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 2.2 mp -61.78 -53.67 58.35 Favored Pre-proline 0 CA--C 1.574 1.881 0 CA-C-O 118.739 -0.648 . . . . 75.14 112.533 -177.053 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 34.3 Cg_endo -64.53 -37.53 37.58 Favored 'Trans proline' 0 C--N 1.384 2.411 0 C-N-CA 122.256 1.97 . . . . 74.21 113.523 175.013 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 26.0 tt0 -64.98 -38.89 92.45 Favored 'General case' 0 N--CA 1.487 1.381 0 C-N-CA 123.196 0.598 . . . . 50.23 110.502 -178.098 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 24' ' ' PHE . . . . . . . . . . . . . 72.8 t80 -81.99 -34.28 29.74 Favored 'General case' 0 N--CA 1.487 1.393 0 CA-C-N 114.998 -1.001 . . . . 72.05 110.291 -176.068 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . 0.513 ' O ' HG23 ' A' ' 29' ' ' VAL . 48.4 t -53.76 -59.21 4.92 Favored 'General case' 0 N--CA 1.478 0.97 0 C-N-CA 123.108 0.563 . . . . 64.34 109.868 168.866 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -65.18 -21.32 66.75 Favored 'General case' 0 N--CA 1.482 1.132 0 C-N-CA 124.319 1.047 . . . . 72.2 112.784 179.302 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 57.4 t80 -72.37 -45.02 61.66 Favored 'General case' 0 N--CA 1.483 1.188 0 C-N-CA 123.06 0.544 . . . . 74.24 111.076 174.911 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 27.8 mmm180 -70.2 -25.86 63.61 Favored 'General case' 0 N--CA 1.482 1.153 0 C-N-CA 123.545 0.738 . . . . 73.32 110.334 176.366 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . 0.513 HG23 ' O ' ' A' ' 25' ' ' SER . 91.1 t -69.5 -48.02 68.81 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.152 0 CA-C-N 115.75 -0.659 . . . . 75.15 109.41 172.359 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . 0.517 ' O ' ' HB3' ' A' ' 34' ' ' SER . 55.9 mttp -66.44 -21.28 66.2 Favored 'General case' 0 N--CA 1.488 1.455 0 C-N-CA 123.293 0.637 . . . . 72.41 112.297 175.799 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -68.1 -53.05 28.23 Favored 'General case' 0 N--CA 1.473 0.685 0 O-C-N 121.893 -0.504 . . . . 75.11 109.685 171.719 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 62.9 t80 -69.2 -64.08 0.94 Allowed 'General case' 0 C--O 1.219 -0.53 0 CA-C-N 115.274 -0.875 . . . . 73.14 111.235 -177.435 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 2.8 m-20 -56.91 -55.43 34.69 Favored 'General case' 0 N--CA 1.482 1.137 0 C-N-CA 125.213 1.405 . . . . 53.32 113.518 -177.414 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . 0.517 ' HB3' ' O ' ' A' ' 30' ' ' LYS . 44.1 t -73.76 -44.62 55.58 Favored 'General case' 0 N--CA 1.493 1.712 0 N-CA-C 111.685 0.254 . . . . 52.41 111.685 -170.486 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -68.18 -30.3 69.37 Favored 'General case' 0 N--CA 1.479 1.008 0 CA-C-O 119.596 -0.24 . . . . 71.1 111.445 176.856 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -64.48 -46.92 80.95 Favored 'General case' 0 N--CA 1.494 1.76 0 N-CA-C 111.908 0.336 . . . . 74.4 111.908 170.529 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 71.1 m -63.62 -41.94 98.24 Favored 'General case' 0 N--CA 1.489 1.504 0 C-N-CA 123.374 0.67 . . . . 45.23 111.742 -179.562 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 80.9 p -77.64 -26.45 50.47 Favored 'General case' 0 N--CA 1.48 1.043 0 C-N-CA 123.441 0.696 . . . . 50.41 111.638 -179.211 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 31.2 t70 -62.48 -51.62 66.74 Favored 'General case' 0 N--CA 1.479 0.998 0 C-N-CA 123.17 0.588 . . . . 55.34 110.011 169.265 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 95.3 mt -64.14 -36.92 85.61 Favored 'General case' 0 N--CA 1.479 1.004 0 CA-C-N 115.498 -0.774 . . . . 73.55 110.859 -178.266 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 20.6 tpt85 -66.98 -44.15 81.17 Favored 'General case' 0 CA--C 1.547 0.83 0 C-N-CA 123.788 0.835 . . . . 74.44 110.475 176.647 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 63.5 t30 -66.94 -35.46 80.04 Favored 'General case' 0 N--CA 1.482 1.132 0 C-N-CA 123.762 0.825 . . . . 74.31 111.591 179.739 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 92.2 mt -72.71 -36.9 67.91 Favored 'General case' 0 N--CA 1.482 1.171 0 C-N-CA 123.135 0.574 . . . . 73.13 110.18 177.665 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 23.2 tptm -73.59 -41.65 62.6 Favored 'General case' 0 CA--C 1.538 0.505 0 CA-C-O 121.383 0.611 . . . . 73.21 110.077 -174.18 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 5.1 t -73.62 -32.58 64.13 Favored 'General case' 0 CA--C 1.547 0.846 0 CA-C-N 115.899 -0.592 . . . . 71.13 111.876 -177.419 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -79.96 -60.67 2.25 Favored 'General case' 0 N--CA 1.482 1.169 0 C-N-CA 123.383 0.673 . . . . 74.22 111.938 179.889 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -65.14 -44.31 89.03 Favored 'General case' 0 N--CA 1.479 1.02 0 C-N-CA 123.038 0.535 . . . . 54.55 112.034 -175.616 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 56.8 mm-40 -73.9 -16.31 61.11 Favored 'General case' 0 N--CA 1.485 1.324 0 CA-C-N 118.215 0.462 . . . . 74.32 112.12 -177.837 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 36.8 t -71.13 -36.25 72.04 Favored 'General case' 0 N--CA 1.485 1.298 0 CA-C-O 121.048 0.451 . . . . 75.01 110.058 168.88 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -69.86 -40.66 75.62 Favored 'General case' 0 N--CA 1.48 1.03 0 C-N-CA 123.756 0.823 . . . . 70.53 111.152 178.681 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 51' ' ' PHE . . . . . . . . . . . . . 60.5 m-85 . . . . . 0 N--CA 1.478 0.967 0 CA-C-N 115.863 -0.608 . . . . 74.4 110.358 176.217 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 2' ' ' THR . . . . . 0.477 HG23 ' H ' ' A' ' 5' ' ' GLU . 5.7 t . . . . . 0 N--CA 1.488 1.443 0 CA-C-O 121.207 0.527 . . . . 65.43 111.732 . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 3' ' ' LEU . . . . . 0.494 HD13 HD12 ' A' ' 6' ' ' LEU . 3.2 mm? -68.8 -17.99 64.11 Favored 'General case' 0 N--CA 1.479 0.995 0 CA-C-N 115.038 -0.983 . . . . 70.21 111.028 175.913 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 50.4 mm -65.05 -51.21 69.22 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.216 0 C-N-CA 123.194 0.598 . . . . 63.1 110.572 176.886 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 5' ' ' GLU . . . . . 0.477 ' H ' HG23 ' A' ' 2' ' ' THR . 18.9 mm-40 -62.76 -41.09 99.06 Favored 'General case' 0 N--CA 1.481 1.097 0 C-N-CA 123.001 0.52 . . . . 75.42 111.689 177.725 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 6' ' ' LEU . . . . . 0.494 HD12 HD13 ' A' ' 3' ' ' LEU . 90.9 mt -62.54 -37.33 85.69 Favored 'General case' 0 N--CA 1.489 1.524 0 C-N-CA 123.051 0.541 . . . . 73.41 111.96 174.182 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 34.4 tp -64.75 -41.15 96.13 Favored 'General case' 0 N--CA 1.476 0.861 0 C-N-CA 123.817 0.847 . . . . 51.4 111.736 178.504 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 93.4 mt -69.47 -43.81 80.44 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.768 0 C-N-CA 123.654 0.781 . . . . 74.21 111.226 178.333 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 82.9 t -61.92 -47.25 94.11 Favored 'Isoleucine or valine' 0 CA--C 1.556 1.18 0 C-N-CA 122.976 0.511 . . . . 63.33 111.465 176.041 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 2.5 p -68.07 -29.44 44.66 Favored 'Isoleucine or valine' 0 CA--C 1.556 1.179 0 C-N-CA 122.572 0.349 . . . . 74.11 111.6 179.656 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -70.75 -53.63 14.79 Favored 'General case' 0 C--N 1.365 1.258 0 C-N-CA 122.698 0.399 . . . . 70.1 111.164 177.558 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 12' ' ' ILE . . . . . 0.53 ' O ' ' HG ' ' A' ' 16' ' ' LEU . 21.4 pt -63.83 -42.14 94.87 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.101 0 C-N-CA 123.168 0.587 . . . . 65.32 111.794 -176.554 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 65.7 mt -66.08 -32.76 59.55 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.047 0 C-N-CA 123.697 0.799 . . . . 74.14 110.275 173.809 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -63.75 -32.78 85.32 Favored Glycine 0 C--N 1.351 1.412 0 CA-C-N 116.029 -0.532 . . . . 22.34 113.179 172.23 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 18.8 mm -72.55 -44.91 60.39 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.202 0 N-CA-C 109.216 -0.661 . . . . 73.34 109.216 175.116 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . 0.53 ' HG ' ' O ' ' A' ' 12' ' ' ILE . 26.3 mt -59.77 -36.09 75.95 Favored 'General case' 0 N--CA 1.484 1.25 0 C-N-CA 123.655 0.782 . . . . 61.43 111.257 -179.316 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -70.62 -51.96 24.59 Favored 'General case' 0 N--CA 1.476 0.872 0 C-N-CA 123.232 0.613 . . . . 60.24 110.808 174.48 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -61.84 -22.9 65.9 Favored 'General case' 0 N--CA 1.481 1.095 0 N-CA-C 113.618 0.97 . . . . 60.32 113.618 -176.635 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 19' ' ' ILE . . . . . 0.404 HD12 ' N ' ' A' ' 20' ' ' ALA . 2.8 pp -92.4 -38.87 10.76 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.292 0 N-CA-C 111.835 0.309 . . . . 74.01 111.835 173.907 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . 0.404 ' N ' HD12 ' A' ' 19' ' ' ILE . . . -67.86 -43.39 79.55 Favored 'General case' 0 N--CA 1.485 1.323 0 N-CA-C 112.726 0.639 . . . . 65.23 112.726 -173.613 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 27.9 mt -61.06 -52.83 69.1 Favored Pre-proline 0 CA--C 1.563 1.454 0 CA-C-O 118.09 -0.957 . . . . 64.45 113.194 -177.071 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 46.2 Cg_endo -67.39 -35.78 22.58 Favored 'Trans proline' 0 C--N 1.377 2.077 0 CA-C-N 121.521 1.579 . . . . 74.41 112.956 173.765 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 29.3 tt0 -69.84 -31.08 68.75 Favored 'General case' 0 N--CA 1.483 1.201 0 CA-C-O 121.13 0.49 . . . . 63.52 111.106 -177.067 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 24' ' ' PHE . . . . . . . . . . . . . 16.4 t80 -95.22 -30.61 13.91 Favored 'General case' 0 N--CA 1.491 1.58 0 CA-C-N 115.796 -0.638 . . . . 74.41 110.781 -176.668 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . 0.438 ' O ' HG23 ' A' ' 29' ' ' VAL . 41.6 t -57.02 -56.88 16.07 Favored 'General case' 0 N--CA 1.486 1.337 0 N-CA-C 109.87 -0.418 . . . . 70.22 109.87 165.446 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -67.26 -17.55 64.84 Favored 'General case' 0 N--CA 1.486 1.362 0 C-N-CA 123.965 0.906 . . . . 65.32 112.843 177.996 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 93.2 t80 -67.01 -46.71 73.69 Favored 'General case' 0 N--CA 1.485 1.306 0 C-N-CA 123.286 0.634 . . . . 73.22 110.273 171.422 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 39.9 mtt180 -70.91 -29.64 65.75 Favored 'General case' 0 N--CA 1.478 0.966 0 CA-C-N 115.716 -0.675 . . . . 71.34 110.591 177.225 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . 0.438 HG23 ' O ' ' A' ' 25' ' ' SER . 73.2 t -67.65 -54.08 26.09 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.409 0 CA-C-N 116.033 -0.53 . . . . 71.33 110.398 177.4 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 12.4 ptmm? -68.96 -21.45 64.18 Favored 'General case' 0 N--CA 1.479 0.999 0 CA-C-N 115.659 -0.701 . . . . 61.32 110.803 177.645 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -69.1 -39.27 79.08 Favored 'General case' 0 N--CA 1.482 1.171 0 O-C-N 121.931 -0.481 . . . . 75.52 110.114 173.551 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 92.9 t80 -66.42 -43.72 84.9 Favored 'General case' 0 N--CA 1.474 0.727 0 CA-C-N 115.539 -0.755 . . . . 65.43 111.769 -179.552 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 22.3 m120 -83.87 -45.83 12.81 Favored 'General case' 0 N--CA 1.476 0.851 0 C-N-CA 123.627 0.771 . . . . 62.23 112.701 -175.233 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 30.3 t -77.6 -47.01 20.43 Favored 'General case' 0 N--CA 1.494 1.739 0 N-CA-C 111.49 0.182 . . . . 65.32 111.49 -171.506 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -62.28 -35.51 79.23 Favored 'General case' 0 N--CA 1.481 1.077 0 C-N-CA 122.473 0.309 . . . . 72.35 111.203 174.915 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -63.01 -49.89 72.88 Favored 'General case' 0 N--CA 1.486 1.343 0 O-C-N 123.418 0.449 . . . . 75.21 111.619 175.348 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 71.2 m -57.1 -38.68 73.74 Favored 'General case' 0 N--CA 1.491 1.59 0 C-N-CA 122.871 0.468 . . . . 71.03 112.2 -178.688 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 33.5 t -85.96 -31.59 22.0 Favored 'General case' 0 N--CA 1.487 1.397 0 C-N-CA 123.625 0.77 . . . . 61.24 112.648 -177.619 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 38.8 t70 -70.07 -44.61 68.77 Favored 'General case' 0 N--CA 1.48 1.052 0 CA-C-O 120.846 0.355 . . . . 71.11 110.616 176.406 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 97.0 mt -71.99 -27.53 62.81 Favored 'General case' 0 N--CA 1.475 0.79 0 CA-C-N 115.702 -0.681 . . . . 71.13 110.242 -178.732 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 20.5 tpp180 -71.63 -43.13 66.68 Favored 'General case' 0 N--CA 1.475 0.787 0 C-N-CA 123.604 0.762 . . . . 70.43 110.483 173.319 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 58.2 t30 -61.66 -44.07 97.65 Favored 'General case' 0 N--CA 1.486 1.335 0 C-N-CA 124.076 0.95 . . . . 72.5 111.944 177.218 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 94.6 mt -75.15 -33.11 61.48 Favored 'General case' 0 N--CA 1.479 1.001 0 CA-C-N 115.923 -0.581 . . . . 75.21 111.142 -179.05 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . 0.413 ' O ' ' HG2' ' A' ' 48' ' ' GLU . 22.4 ttmm -71.44 -48.1 51.63 Favored 'General case' 0 N--CA 1.475 0.799 0 N-CA-C 109.747 -0.464 . . . . 71.11 109.747 179.789 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 3.4 t -61.76 -36.0 79.76 Favored 'General case' 0 N--CA 1.484 1.256 0 C-N-CA 123.025 0.53 . . . . 55.1 111.197 -176.354 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -63.71 -50.49 68.96 Favored 'General case' 0 N--CA 1.477 0.879 0 C-N-CA 123.586 0.754 . . . . 60.21 111.634 175.397 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 8.3 mp -66.91 -42.05 86.08 Favored 'General case' 0 N--CA 1.488 1.473 0 C-N-CA 123.503 0.721 . . . . 73.3 112.715 -179.024 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 48' ' ' GLU . . . . . 0.413 ' HG2' ' O ' ' A' ' 44' ' ' LYS . 36.9 mm-40 -67.85 -45.8 73.57 Favored 'General case' 0 N--CA 1.477 0.886 0 C-N-CA 123.363 0.665 . . . . 73.01 110.755 -178.596 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 62.3 m -66.07 -37.16 85.11 Favored 'General case' 0 N--CA 1.482 1.165 0 C-N-CA 122.626 0.37 . . . . 74.32 111.599 179.439 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -68.02 -49.63 60.31 Favored 'General case' 0 N--CA 1.489 1.512 0 C-N-CA 123.264 0.626 . . . . 73.21 112.135 179.113 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 51' ' ' PHE . . . . . . . . . . . . . 28.9 t80 . . . . . 0 N--CA 1.484 1.263 0 C-N-CA 123.491 0.717 . . . . 72.12 111.563 -176.948 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 2' ' ' THR . . . . . 0.632 HG22 ' H ' ' A' ' 4' ' ' ILE . 36.7 m . . . . . 0 N--CA 1.484 1.226 0 CA-C-O 120.543 0.211 . . . . 70.24 110.93 . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 2.5 pt? -61.22 -17.46 53.36 Favored 'General case' 0 N--CA 1.49 1.57 0 C-N-CA 124.123 0.969 . . . . 75.01 113.202 179.175 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 4' ' ' ILE . . . . . 0.632 ' H ' HG22 ' A' ' 2' ' ' THR . 50.6 mm -86.17 -45.05 16.88 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.735 0 C-N-CA 123.369 0.668 . . . . 60.11 110.322 179.461 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 20.1 mm-40 -64.16 -33.77 76.55 Favored 'General case' 0 N--CA 1.481 1.08 0 C-N-CA 123.304 0.642 . . . . 72.21 111.799 -179.812 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 6' ' ' LEU . . . . . 0.4 ' HA ' HG12 ' A' ' 9' ' ' VAL . 3.5 pp -70.07 -34.0 72.64 Favored 'General case' 0 N--CA 1.477 0.921 0 O-C-N 123.156 0.285 . . . . 53.52 111.332 174.245 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -67.7 -37.69 82.63 Favored 'General case' 0 CA--C 1.561 1.398 0 C-N-CA 123.814 0.846 . . . . 74.12 110.904 176.759 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 87.4 mt -70.39 -49.37 54.09 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.707 0 C-N-CA 123.292 0.637 . . . . 62.4 111.99 178.996 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . 0.4 HG12 ' HA ' ' A' ' 6' ' ' LEU . 9.7 p -64.52 -39.66 86.36 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.901 0 C-N-CA 122.684 0.394 . . . . 74.33 111.789 -179.527 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 2.0 p -67.28 -30.0 47.71 Favored 'Isoleucine or valine' 0 CA--C 1.56 1.351 0 C-N-CA 122.435 0.294 . . . . 72.23 111.3 175.697 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -69.15 -52.76 24.89 Favored 'General case' 0 N--CA 1.483 1.219 0 C-N-CA 122.652 0.381 . . . . 54.13 111.583 177.533 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 12' ' ' ILE . . . . . 0.524 ' O ' ' HG ' ' A' ' 16' ' ' LEU . 21.3 pt -62.54 -41.5 92.24 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.967 0 C-N-CA 122.723 0.409 . . . . 71.13 111.46 -179.117 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 56.0 mt -62.15 -36.21 73.09 Favored 'Isoleucine or valine' 0 C--N 1.362 1.139 0 C-N-CA 124.277 1.031 . . . . 75.22 111.097 174.382 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -58.13 -36.43 81.94 Favored Glycine 0 C--N 1.355 1.596 0 O-C-N 123.553 0.533 . . . . 74.41 113.198 174.856 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 1.7 mp -75.98 -42.81 39.12 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.877 0 C-N-CA 123.06 0.544 . . . . 72.41 109.995 175.768 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . 0.524 ' HG ' ' O ' ' A' ' 12' ' ' ILE . 37.9 mt -59.52 -36.59 76.4 Favored 'General case' 0 N--CA 1.489 1.488 0 C-N-CA 122.975 0.51 . . . . 71.53 112.006 -176.623 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -73.73 -52.43 13.23 Favored 'General case' 0 CA--C 1.546 0.826 0 C-N-CA 122.738 0.415 . . . . 62.02 110.228 175.143 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -53.87 -30.05 44.08 Favored 'General case' 0 N--CA 1.488 1.431 0 C-N-CA 124.226 1.01 . . . . 35.52 113.444 -178.168 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 19' ' ' ILE . . . . . 0.516 ' O ' ' HB3' ' A' ' 23' ' ' GLN . 2.8 pp -88.47 -35.94 8.55 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.297 0 N-CA-C 112.177 0.436 . . . . 73.04 112.177 175.501 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -71.74 -42.98 66.62 Favored 'General case' 0 N--CA 1.481 1.092 0 N-CA-C 112.872 0.693 . . . . 72.31 112.872 -170.985 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 1.9 mp -57.07 -54.13 57.83 Favored Pre-proline 0 CA--C 1.567 1.624 0 CA-C-O 118.723 -0.656 . . . . 64.53 111.591 -178.286 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 36.3 Cg_endo -64.72 -39.64 25.77 Favored 'Trans proline' 0 C--N 1.386 2.515 0 C-N-CA 121.493 1.462 . . . . 75.15 113.441 173.226 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 23' ' ' GLN . . . . . 0.516 ' HB3' ' O ' ' A' ' 19' ' ' ILE . 0.1 OUTLIER -64.94 -29.88 70.85 Favored 'General case' 0 N--CA 1.496 1.841 0 C-N-CA 122.77 0.428 . . . . 75.53 110.685 -175.669 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 24' ' ' PHE . . . . . . . . . . . . . 73.7 t80 -96.59 -37.94 10.17 Favored 'General case' 0 N--CA 1.485 1.276 0 CA-C-N 115.533 -0.758 . . . . 70.31 111.135 -173.61 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . 0.456 ' O ' HG23 ' A' ' 29' ' ' VAL . 46.2 t -61.09 -57.51 12.25 Favored 'General case' 0 N--CA 1.477 0.884 0 N-CA-C 109.167 -0.679 . . . . 60.43 109.167 174.524 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -63.34 -22.02 66.62 Favored 'General case' 0 N--CA 1.482 1.159 0 C-N-CA 123.632 0.773 . . . . 64.23 112.658 177.275 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 27' ' ' TYR . . . . . 0.442 ' HB2' ' O ' ' A' ' 23' ' ' GLN . 75.7 t80 -67.23 -48.73 66.93 Favored 'General case' 0 N--CA 1.489 1.497 0 CA-C-O 121.278 0.561 . . . . 74.35 110.502 173.488 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 74.4 mtp180 -73.28 -27.27 61.46 Favored 'General case' 0 N--CA 1.472 0.643 0 CA-C-N 115.612 -0.722 . . . . 74.2 111.617 178.26 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . 0.456 HG23 ' O ' ' A' ' 25' ' ' SER . 55.5 t -73.62 -42.65 55.29 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.4 0 O-C-N 123.347 0.404 . . . . 73.52 110.494 178.636 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . 0.438 ' HG2' ' O ' ' A' ' 27' ' ' TYR . 11.7 ptmm? -68.59 -30.32 69.05 Favored 'General case' 0 N--CA 1.476 0.869 0 CA-C-N 116.311 -0.404 . . . . 74.11 110.147 177.29 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -80.09 -34.83 37.66 Favored 'General case' 0 N--CA 1.482 1.138 0 C-N-CA 122.903 0.481 . . . . 74.1 110.837 -179.3 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 39.8 t80 -72.26 -21.56 61.35 Favored 'General case' 0 N--CA 1.485 1.291 0 C-N-CA 123.544 0.738 . . . . 74.25 110.922 -179.282 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 2.9 m-20 -94.49 -45.72 7.3 Favored 'General case' 0 N--CA 1.478 0.929 0 C-N-CA 123.872 0.869 . . . . 75.11 111.658 175.025 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 42.4 t -65.33 -55.33 18.82 Favored 'General case' 0 N--CA 1.495 1.817 0 C-N-CA 122.835 0.454 . . . . 61.14 111.75 -176.63 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -62.23 -39.29 92.31 Favored 'General case' 0 N--CA 1.474 0.747 0 CA-C-N 115.954 -0.566 . . . . 61.22 111.578 179.152 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -61.29 -60.57 3.54 Favored 'General case' 0 N--CA 1.485 1.318 0 C-N-CA 123.158 0.583 . . . . 51.34 111.569 178.695 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 37.7 t -53.26 -50.54 64.62 Favored 'General case' 0 N--CA 1.479 1.007 0 C-N-CA 123.937 0.895 . . . . 50.14 111.913 -179.713 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 30.5 t -72.01 -29.8 64.56 Favored 'General case' 0 N--CA 1.478 0.952 0 N-CA-C 112.621 0.6 . . . . 62.23 112.621 -175.967 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 37.0 t70 -63.93 -49.73 71.44 Favored 'General case' 0 N--CA 1.484 1.245 0 C-N-CA 122.64 0.376 . . . . 74.45 111.075 172.69 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 88.3 mt -67.78 -35.48 78.75 Favored 'General case' 0 N--CA 1.481 1.118 0 CA-C-N 115.622 -0.717 . . . . 74.43 110.782 -174.981 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 99.6 mtt180 -70.66 -42.24 71.03 Favored 'General case' 0 N--CA 1.48 1.064 0 CA-C-N 115.054 -0.976 . . . . 73.44 110.681 175.363 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 65.2 t30 -64.75 -36.13 83.31 Favored 'General case' 0 N--CA 1.489 1.516 0 C-N-CA 123.462 0.705 . . . . 43.35 111.671 179.774 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . 0.447 ' O ' HD13 ' A' ' 47' ' ' LEU . 93.6 mt -76.64 -34.77 58.28 Favored 'General case' 0 N--CA 1.478 0.97 0 C-N-CA 122.976 0.511 . . . . 71.51 110.974 179.632 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 79.4 tttt -70.98 -48.29 54.13 Favored 'General case' 0 N--CA 1.472 0.658 0 N-CA-C 109.822 -0.436 . . . . 64.41 109.822 -178.396 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 6.2 t -65.47 -31.76 73.01 Favored 'General case' 0 N--CA 1.478 0.973 0 C-N-CA 123.863 0.865 . . . . 75.41 111.674 -177.481 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -61.63 -46.48 89.62 Favored 'General case' 0 N--CA 1.481 1.121 0 C-N-CA 124.024 0.93 . . . . 64.44 111.243 172.149 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 47' ' ' LEU . . . . . 0.447 HD13 ' O ' ' A' ' 43' ' ' LEU . 8.4 mp -66.92 -39.15 87.3 Favored 'General case' 0 N--CA 1.479 1.002 0 CA-C-N 115.622 -0.717 . . . . 72.22 111.675 176.326 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 49.8 mt-10 -66.95 -38.2 85.7 Favored 'General case' 0 N--CA 1.484 1.247 0 C-N-CA 122.872 0.469 . . . . 61.14 111.147 179.647 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 34.2 t -69.04 -27.61 65.81 Favored 'General case' 0 N--CA 1.479 1.011 0 C-N-CA 123.509 0.723 . . . . 41.31 111.145 175.393 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -74.83 -53.58 8.86 Favored 'General case' 0 N--CA 1.477 0.881 0 C-N-CA 123.283 0.633 . . . . 62.51 110.341 178.057 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 51' ' ' PHE . . . . . . . . . . . . . 57.9 m-85 . . . . . 0 N--CA 1.487 1.377 0 C-N-CA 123.961 0.905 . . . . 63.5 112.466 -177.404 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' PHE . . . . . . . . . . . . . 46.8 p90 . . . . . 0 N--CA 1.484 1.228 0 N-CA-C 112.393 0.516 . . . . 73.4 112.393 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' THR . . . . . 0.57 HG23 ' H ' ' A' ' 5' ' ' GLU . 7.2 t -90.26 144.39 25.88 Favored 'General case' 0 N--CA 1.492 1.659 0 CA-C-N 118.526 0.603 . . . . 73.51 111.834 -176.164 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . 0.577 HD13 HD12 ' A' ' 6' ' ' LEU . 4.3 mm? -61.23 -22.72 65.06 Favored 'General case' 0 N--CA 1.482 1.139 0 CA-C-N 115.743 -0.662 . . . . 72.3 111.147 174.802 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 1.5 mp -62.14 -45.73 98.08 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.427 0 C-N-CA 123.596 0.758 . . . . 54.54 110.474 177.338 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . 0.57 ' H ' HG23 ' A' ' 2' ' ' THR . 14.4 mm-40 -56.23 -47.32 78.7 Favored 'General case' 0 N--CA 1.484 1.244 0 C-N-CA 123.021 0.528 . . . . 74.14 111.422 174.856 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . 0.577 HD12 HD13 ' A' ' 3' ' ' LEU . 85.5 mt -64.08 -41.66 97.24 Favored 'General case' 0 N--CA 1.478 0.953 0 C-N-CA 123.436 0.694 . . . . 75.43 111.956 -179.759 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 90.9 mt -61.75 -45.43 93.94 Favored 'General case' 0 N--CA 1.48 1.067 0 C-N-CA 123.174 0.589 . . . . 73.21 111.82 177.672 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 87.1 mt -63.77 -47.94 88.73 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.801 0 C-N-CA 123.324 0.65 . . . . 63.21 112.235 176.998 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 50.3 t -62.01 -44.57 99.13 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.834 0 C-N-CA 123.38 0.672 . . . . 71.25 111.379 -178.953 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 40.2 t -67.82 -31.64 53.07 Favored 'Isoleucine or valine' 0 CA--C 1.555 1.173 0 C-N-CA 123.041 0.536 . . . . 54.12 111.355 176.427 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -68.5 -58.91 3.6 Favored 'General case' 0 N--CA 1.481 1.086 0 C-N-CA 122.44 0.296 . . . . 62.53 111.274 177.855 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' ILE . . . . . 0.545 ' O ' ' HG ' ' A' ' 16' ' ' LEU . 20.9 pt -60.58 -49.21 85.32 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.955 0 C-N-CA 123.464 0.706 . . . . 43.33 111.83 -176.387 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 71.3 mt -68.47 -30.41 47.4 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.934 0 C-N-CA 123.613 0.765 . . . . 73.21 110.665 178.994 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -61.04 -36.39 92.24 Favored Glycine 0 C--N 1.351 1.369 0 CA-C-N 115.938 -0.574 . . . . 42.54 112.968 175.256 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 17.4 mt -75.79 -45.92 36.9 Favored 'Isoleucine or valine' 0 C--N 1.354 0.795 0 C-N-CA 123.289 0.636 . . . . 62.52 110.11 176.194 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.545 ' HG ' ' O ' ' A' ' 12' ' ' ILE . 36.5 mt -55.17 -43.25 74.13 Favored 'General case' 0 N--CA 1.485 1.294 0 O-C-N 124.055 0.847 . . . . 70.41 111.501 -178.81 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -75.1 -49.81 18.42 Favored 'General case' 0 N--CA 1.476 0.861 0 C-N-CA 123.071 0.548 . . . . 61.11 111.33 -177.857 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -55.28 -30.18 59.64 Favored 'General case' 0 N--CA 1.482 1.148 0 C-N-CA 123.665 0.786 . . . . 74.11 112.921 -178.037 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 2.8 pp -89.1 -37.52 10.11 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.974 0 N-CA-C 112.155 0.428 . . . . 71.23 112.155 173.624 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -65.96 -53.04 44.12 Favored 'General case' 0 N--CA 1.487 1.388 0 N-CA-C 113.052 0.76 . . . . 64.24 113.052 -171.093 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 2.4 mp -54.64 -56.3 28.65 Favored Pre-proline 0 CA--C 1.566 1.562 0 CA-C-O 118.629 -0.7 . . . . 72.3 112.494 -174.759 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 37.2 Cg_endo -65.31 -41.05 17.05 Favored 'Trans proline' 0 C--N 1.38 2.224 0 C-N-CA 121.576 1.517 . . . . 70.24 113.493 177.624 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 28.2 tt0 -63.87 -36.47 84.04 Favored 'General case' 0 N--CA 1.488 1.464 0 C-N-CA 123.369 0.668 . . . . 71.04 111.098 -176.13 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' PHE . . . . . . . . . . . . . 37.5 t80 -88.33 -36.24 16.74 Favored 'General case' 0 N--CA 1.485 1.31 0 CA-C-N 114.837 -1.074 . . . . 55.44 111.023 -174.84 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 31.3 t -60.3 -51.18 70.65 Favored 'General case' 0 N--CA 1.478 0.943 0 C-N-CA 122.991 0.517 . . . . 75.43 110.411 173.612 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -69.99 -21.29 63.24 Favored 'General case' 0 CA--C 1.551 0.998 0 CA-C-N 115.486 -0.779 . . . . 74.15 112.644 176.789 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 79.7 t80 -71.19 -48.47 51.41 Favored 'General case' 0 N--CA 1.488 1.427 0 C-N-CA 122.686 0.395 . . . . 54.41 110.995 175.361 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 73.5 mtp180 -67.62 -27.14 66.64 Favored 'General case' 0 N--CA 1.477 0.886 0 C-N-CA 123.015 0.526 . . . . 72.03 111.106 177.62 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 24.0 t -71.17 -49.03 51.37 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.892 0 CA-C-N 115.694 -0.685 . . . . 45.05 110.69 174.214 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 18.9 ptmt -70.73 -22.39 62.43 Favored 'General case' 0 N--CA 1.476 0.861 0 CA-C-O 119.427 -0.32 . . . . 71.11 111.024 -179.099 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -78.19 -36.57 47.21 Favored 'General case' 0 N--CA 1.48 1.052 0 CA-C-O 120.909 0.385 . . . . 72.41 110.132 176.501 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 88.6 t80 -63.76 -43.87 95.13 Favored 'General case' 0 C--O 1.218 -0.559 0 CA-C-N 115.059 -0.973 . . . . 75.4 109.935 174.652 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 82.5 m-20 -80.0 -31.82 39.72 Favored 'General case' 0 N--CA 1.484 1.247 0 C-N-CA 124.075 0.95 . . . . 70.41 112.608 -176.667 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 39.7 t -66.01 -51.56 57.19 Favored 'General case' 0 N--CA 1.492 1.662 0 C-N-CA 122.521 0.329 . . . . 64.55 110.235 173.907 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -65.91 -38.52 88.93 Favored 'General case' 0 CA--C 1.541 0.596 0 CA-C-N 115.596 -0.729 . . . . 53.15 111.706 177.505 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -61.95 -53.56 53.97 Favored 'General case' 0 N--CA 1.497 1.921 0 N-CA-C 112.3 0.481 . . . . 73.5 112.3 177.169 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 44.1 t -61.15 -49.48 77.07 Favored 'General case' 0 N--CA 1.483 1.186 0 C-N-CA 122.855 0.462 . . . . 52.53 111.282 179.466 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 64.4 m -66.4 -27.67 68.03 Favored 'General case' 0 N--CA 1.483 1.189 0 C-N-CA 123.312 0.645 . . . . 72.2 112.681 -178.621 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 32.1 t70 -63.17 -47.2 83.68 Favored 'General case' 0 N--CA 1.483 1.221 0 CA-C-O 121.336 0.589 . . . . 74.24 110.815 170.027 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 90.9 mt -74.28 -22.48 59.27 Favored 'General case' 0 N--CA 1.481 1.106 0 CA-C-N 115.274 -0.875 . . . . 74.23 112.188 -178.042 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 61.6 mtp180 -83.99 -60.8 1.99 Allowed 'General case' 0 N--CA 1.479 1.006 0 C-N-CA 123.457 0.703 . . . . 74.3 111.488 177.194 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 7.3 t30 -61.16 -38.46 86.54 Favored 'General case' 0 N--CA 1.483 1.223 0 C-N-CA 123.916 0.886 . . . . 61.11 112.988 -171.038 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 83.9 mt -78.22 -31.95 49.63 Favored 'General case' 0 N--CA 1.486 1.336 0 N-CA-C 111.654 0.242 . . . . 74.24 111.654 -178.99 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 40.6 ttmt -76.05 -44.96 36.68 Favored 'General case' 0 N--CA 1.474 0.76 0 C-N-CA 122.844 0.457 . . . . 45.43 110.519 -177.286 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 5.8 t -66.77 -32.84 74.4 Favored 'General case' 0 N--CA 1.478 0.951 0 CA-C-N 115.305 -0.861 . . . . 73.32 110.853 -179.736 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -67.2 -40.19 86.45 Favored 'General case' 0 N--CA 1.475 0.819 0 CA-C-N 114.98 -1.009 . . . . 74.03 111.557 172.964 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 8.0 tt -64.58 -47.01 80.27 Favored 'General case' 0 N--CA 1.482 1.14 0 C-N-CA 123.724 0.81 . . . . 70.2 110.465 176.218 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 40.3 mt-10 -65.55 -30.58 71.35 Favored 'General case' 0 N--CA 1.479 1.02 0 C-N-CA 123.54 0.736 . . . . 73.42 111.523 -179.444 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 23.5 t -81.01 -39.15 26.33 Favored 'General case' 0 N--CA 1.479 0.975 0 C-N-CA 123.012 0.525 . . . . 70.23 111.591 179.122 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -74.44 -36.72 63.39 Favored 'General case' 0 N--CA 1.486 1.344 0 C-N-CA 123.33 0.652 . . . . 71.02 111.724 -175.272 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 51' ' ' PHE . . . . . . . . . . . . . 88.4 m-85 -94.19 -10.48 32.96 Favored 'General case' 0 N--CA 1.479 1.015 0 C-N-CA 124.044 0.938 . . . . 72.43 110.671 177.983 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . 64.04 30.66 13.92 Favored 'General case' 0 C--N 1.362 1.145 0 C-N-CA 124.476 1.11 . . . . 74.25 111.911 178.025 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 38.2 t70 -45.3 -38.18 5.43 Favored 'General case' 0 N--CA 1.489 1.482 0 C-N-CA 126.932 2.093 . . . . 64.02 115.392 -168.31 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 5.3 m-20 -55.21 -19.8 8.98 Favored 'General case' 0 N--CA 1.495 1.78 0 C-N-CA 124.464 1.106 . . . . 64.42 113.797 -179.408 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 28.4 pt20 -54.9 -32.91 61.51 Favored 'General case' 0 N--CA 1.489 1.504 0 C-N-CA 124.99 1.316 . . . . 65.32 113.648 177.054 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 4.8 m -95.83 -0.67 50.86 Favored 'General case' 0 N--CA 1.488 1.436 0 C-N-CA 123.398 0.679 . . . . 72.51 111.871 -174.305 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 88.0 m-85 -116.12 149.71 43.91 Favored Pre-proline 0 N--CA 1.491 1.588 0 C-N-CA 123.193 0.597 . . . . 74.01 111.435 -178.134 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 87.4 Cg_endo -77.04 160.5 33.37 Favored 'Trans proline' 0 C--N 1.375 1.963 0 C-N-CA 122.822 2.348 . . . . 72.02 112.77 175.499 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 47.5 Cg_exo -57.85 126.36 21.49 Favored 'Trans proline' 0 C--N 1.38 2.197 0 C-N-CA 122.651 2.234 . . . . 54.11 112.798 178.173 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 11.6 pt-20 41.73 76.91 0.06 Allowed 'General case' 0 N--CA 1.492 1.631 0 C-N-CA 125.692 1.597 . . . . 70.22 113.035 -174.488 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 62.0 p . . . . . 0 N--CA 1.486 1.328 0 CA-C-N 115.416 -0.811 . . . . 72.53 111.828 -176.658 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 1' ' ' PHE . . . . . 0.426 ' HB3' HD11 ' A' ' 6' ' ' LEU . 90.2 m-85 . . . . . 0 N--CA 1.495 1.802 0 N-CA-C 110.304 -0.258 . . . . 60.5 110.304 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 2.7 t -117.41 137.64 52.35 Favored 'General case' 0 N--CA 1.48 1.068 0 C-N-CA 123.082 0.553 . . . . 74.02 110.207 175.666 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 83.1 mt -55.57 -25.24 37.05 Favored 'General case' 0 N--CA 1.482 1.173 0 C-N-CA 124.11 0.964 . . . . 73.34 112.168 -179.173 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 49.0 mm -64.72 -58.42 7.22 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.767 0 O-C-N 124.007 0.817 . . . . 62.35 110.798 178.733 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 18.3 mm-40 -67.95 -37.9 82.15 Favored 'General case' 0 N--CA 1.478 0.951 0 N-CA-C 111.912 0.338 . . . . 60.11 111.912 -176.359 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . 0.426 HD11 ' HB3' ' A' ' 1' ' ' PHE . 70.6 mt -62.42 -41.6 98.81 Favored 'General case' 0 N--CA 1.485 1.296 0 C-N-CA 123.152 0.581 . . . . 63.21 111.973 176.249 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 37.6 tp -66.35 -39.45 89.2 Favored 'General case' 0 CA--C 1.549 0.939 0 C-N-CA 123.252 0.621 . . . . 62.11 111.82 178.165 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 83.4 mt -67.85 -44.03 85.66 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.873 0 C-N-CA 122.843 0.457 . . . . 75.01 111.789 176.957 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 53.6 t -60.44 -47.84 90.9 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.974 0 C-N-CA 123.157 0.583 . . . . 55.41 111.76 177.028 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 4.0 p -66.9 -29.24 45.64 Favored 'Isoleucine or valine' 0 CA--C 1.561 1.383 0 N-CA-C 111.636 0.235 . . . . 63.11 111.636 178.021 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -71.93 -51.8 20.34 Favored 'General case' 0 N--CA 1.483 1.177 0 C-N-CA 123.074 0.55 . . . . 62.45 111.899 178.515 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' ILE . . . . . 0.555 ' HA ' HD12 ' A' ' 15' ' ' ILE . 27.3 pt -64.69 -46.26 92.81 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.921 0 C-N-CA 123.141 0.577 . . . . 71.43 111.273 -175.805 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 81.9 mt -64.67 -29.31 47.0 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.093 0 C-N-CA 123.72 0.808 . . . . 75.2 110.642 176.405 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -61.26 -39.68 97.54 Favored Glycine 0 C--N 1.354 1.553 0 CA-C-N 116.0 -0.546 . . . . 44.32 112.843 172.515 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . 0.555 HD12 ' HA ' ' A' ' 12' ' ' ILE . 16.3 mt -73.38 -44.94 53.8 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.914 0 C-N-CA 123.618 0.767 . . . . 72.24 110.807 176.644 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.52 ' HG ' ' O ' ' A' ' 12' ' ' ILE . 24.9 mt -59.06 -36.81 75.69 Favored 'General case' 0 N--CA 1.485 1.309 0 C-N-CA 123.4 0.68 . . . . 75.03 111.249 -177.315 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -70.53 -54.3 12.72 Favored 'General case' 0 CA--C 1.548 0.883 0 C-N-CA 123.131 0.572 . . . . 74.23 110.253 174.518 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -57.92 -21.35 43.26 Favored 'General case' 0 N--CA 1.48 1.035 0 N-CA-C 114.066 1.136 . . . . 51.34 114.066 -177.46 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 2.7 pp -97.54 -36.23 5.88 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.06 0 N-CA-C 112.283 0.475 . . . . 73.0 112.283 174.202 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -69.65 -45.87 67.44 Favored 'General case' 0 N--CA 1.49 1.538 0 N-CA-C 112.639 0.607 . . . . 74.01 112.639 -172.519 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 2.3 mp -57.93 -55.02 49.49 Favored Pre-proline 0 CA--C 1.571 1.759 0 CA-C-O 118.619 -0.705 . . . . 72.22 112.298 -179.177 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 55.6 Cg_endo -68.51 -34.98 18.68 Favored 'Trans proline' 0 C--N 1.383 2.382 0 C-N-CA 122.277 1.984 . . . . 74.1 114.025 177.538 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 26.5 tt0 -64.75 -36.93 85.89 Favored 'General case' 0 N--CA 1.49 1.568 0 CA-C-O 121.455 0.645 . . . . 71.15 110.274 -179.143 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 24' ' ' PHE . . . . . . . . . . . . . 58.4 t80 -86.55 -35.22 19.65 Favored 'General case' 0 N--CA 1.484 1.245 0 CA-C-N 114.636 -1.165 . . . . 75.13 110.763 -175.477 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . 0.446 ' O ' HG23 ' A' ' 29' ' ' VAL . 44.5 t -56.89 -55.28 36.52 Favored 'General case' 0 N--CA 1.478 0.93 0 C-N-CA 123.225 0.61 . . . . 74.42 110.319 169.985 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -61.65 -30.46 70.73 Favored 'General case' 0 N--CA 1.484 1.249 0 C-N-CA 124.26 1.024 . . . . 64.42 112.483 177.252 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 69.0 t80 -64.15 -51.69 62.66 Favored 'General case' 0 N--CA 1.478 0.926 0 C-N-CA 122.816 0.446 . . . . 71.43 110.154 175.342 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . 0.418 ' O ' ' HB2' ' A' ' 32' ' ' TYR . 80.7 mtp180 -67.49 -25.25 65.77 Favored 'General case' 0 N--CA 1.476 0.861 0 CA-C-N 115.429 -0.805 . . . . 74.53 111.796 179.709 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . 0.446 HG23 ' O ' ' A' ' 25' ' ' SER . 41.9 t -68.19 -54.49 21.71 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.393 0 O-C-N 123.43 0.456 . . . . 63.1 110.459 176.55 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.17 -24.38 64.06 Favored 'General case' 0 N--CA 1.478 0.926 0 CA-C-N 115.725 -0.671 . . . . 74.41 111.097 179.099 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -80.8 -31.39 35.68 Favored 'General case' 0 N--CA 1.484 1.24 0 C-N-CA 122.925 0.49 . . . . 70.24 110.783 -179.884 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 32' ' ' TYR . . . . . 0.418 ' HB2' ' O ' ' A' ' 28' ' ' ARG . 4.9 t80 -74.27 -19.19 60.58 Favored 'General case' 0 N--CA 1.484 1.268 0 C-N-CA 123.181 0.592 . . . . 71.44 110.372 177.897 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 17.9 m120 -91.94 -52.76 4.57 Favored 'General case' 0 N--CA 1.473 0.707 0 C-N-CA 123.721 0.808 . . . . 63.23 110.86 175.063 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 44.0 t -65.43 -59.37 4.08 Favored 'General case' 0 N--CA 1.484 1.259 0 C-N-CA 123.313 0.645 . . . . 65.34 111.683 -174.096 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -61.58 -40.54 95.14 Favored 'General case' 0 N--CA 1.479 0.977 0 N-CA-C 112.135 0.42 . . . . 74.42 112.135 -179.09 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -64.18 -46.42 84.06 Favored 'General case' 0 N--CA 1.485 1.294 0 C-N-CA 122.427 0.291 . . . . 62.24 111.015 -178.201 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 73.0 m -65.14 -44.01 90.01 Favored 'General case' 0 N--CA 1.476 0.839 0 CA-C-N 116.184 -0.462 . . . . 73.44 111.663 175.659 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 64.1 m -72.23 -35.36 68.84 Favored 'General case' 0 N--CA 1.484 1.256 0 N-CA-C 113.06 0.763 . . . . 72.24 113.06 -171.535 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 17.4 m-20 -64.1 -51.42 64.1 Favored 'General case' 0 N--CA 1.476 0.86 0 O-C-N 123.474 0.484 . . . . 63.45 110.339 170.53 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -64.24 -32.47 74.07 Favored 'General case' 0 N--CA 1.483 1.21 0 C-N-CA 123.021 0.529 . . . . 50.0 111.95 -176.115 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 88.6 mtm180 -79.78 -38.12 33.82 Favored 'General case' 0 N--CA 1.486 1.366 0 C-N-CA 122.787 0.435 . . . . 72.31 110.787 178.712 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 62.4 t30 -64.55 -35.91 82.51 Favored 'General case' 0 N--CA 1.49 1.536 0 C-N-CA 122.967 0.507 . . . . 72.52 111.192 175.425 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 96.2 mt -78.02 -35.99 49.22 Favored 'General case' 0 N--CA 1.48 1.043 0 C-N-CA 123.402 0.681 . . . . 74.45 110.985 179.058 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 6.2 tmmm? -72.02 -43.77 64.47 Favored 'General case' 0 N--CA 1.478 0.962 0 C-N-CA 122.74 0.416 . . . . 74.11 110.177 -177.955 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 2.0 t -67.22 -30.92 70.97 Favored 'General case' 0 N--CA 1.479 0.984 0 C-N-CA 123.781 0.832 . . . . 62.51 111.569 -179.892 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -63.59 -53.18 55.68 Favored 'General case' 0 N--CA 1.478 0.969 0 CA-C-N 115.37 -0.832 . . . . 61.41 111.038 173.817 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 10.8 mp -68.61 -27.02 65.66 Favored 'General case' 0 N--CA 1.487 1.418 0 C-N-CA 123.432 0.693 . . . . 74.23 112.111 177.297 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 9.5 tp10 -69.89 -51.44 33.13 Favored 'General case' 0 C--N 1.35 0.624 0 C-N-CA 124.348 1.059 . . . . 53.51 110.365 179.142 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 47.1 t -62.83 -36.58 83.67 Favored 'General case' 0 N--CA 1.481 1.092 0 C-N-CA 124.091 0.956 . . . . 65.35 111.756 177.207 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -61.97 -50.56 71.61 Favored 'General case' 0 N--CA 1.479 1.006 0 C-N-CA 123.638 0.775 . . . . 64.12 111.798 177.919 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 51' ' ' PHE . . . . . . . . . . . . . 32.5 t80 -75.32 -23.3 57.27 Favored 'General case' 0 CA--C 1.56 1.331 0 C-N-CA 122.819 0.447 . . . . 73.41 111.348 178.552 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -71.91 -24.67 61.68 Favored 'General case' 0 N--CA 1.487 1.405 0 C-N-CA 123.464 0.705 . . . . 64.1 112.095 175.148 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 23.6 t70 -63.48 -33.45 75.6 Favored 'General case' 0 N--CA 1.482 1.169 0 C-N-CA 123.349 0.66 . . . . 72.25 110.922 174.769 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 36.2 t70 -72.21 -25.23 61.57 Favored 'General case' 0 CA--C 1.557 1.242 0 C-N-CA 123.643 0.777 . . . . 74.3 111.908 176.526 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 12.0 pt20 -127.16 39.47 3.9 Favored 'General case' 0 N--CA 1.49 1.56 0 C-N-CA 123.465 0.706 . . . . 72.33 111.93 -173.708 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 82.7 p -55.66 -41.33 73.49 Favored 'General case' 0 N--CA 1.501 2.088 0 C-N-CA 123.018 0.527 . . . . 64.24 112.352 -179.063 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 45.9 t80 -145.22 96.09 4.98 Favored Pre-proline 0 N--CA 1.481 1.105 0 C-N-CA 123.31 0.644 . . . . 74.51 110.032 168.831 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 15.0 Cg_exo -71.55 168.79 22.62 Favored 'Trans proline' 0 CA--C 1.565 2.039 0 C-N-CA 123.182 2.588 . . . . 74.01 112.265 171.596 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 31.7 Cg_exo -60.06 97.33 0.11 Allowed 'Trans proline' 0 C--N 1.381 2.282 0 C-N-CA 122.403 2.069 . . . . 55.41 112.053 173.527 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 1.2 tm-20 -67.53 103.66 1.39 Allowed 'General case' 0 CA--C 1.551 1.013 0 C-N-CA 123.567 0.747 . . . . 51.24 111.198 -176.024 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 62.2 m . . . . . 0 N--CA 1.484 1.261 0 C-N-CA 124.261 1.025 . . . . 72.21 109.926 179.638 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 1' ' ' PHE . . . . . . . . . . . . . 97.5 m-85 . . . . . 0 N--CA 1.488 1.43 0 N-CA-C 110.549 -0.167 . . . . 60.54 110.549 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 2' ' ' THR . . . . . 0.544 HG23 ' H ' ' A' ' 5' ' ' GLU . 6.7 t -152.63 150.11 29.16 Favored 'General case' 0 N--CA 1.482 1.16 0 C-N-CA 123.66 0.784 . . . . 70.23 110.696 178.002 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . 0.468 ' HA ' HD12 ' A' ' 6' ' ' LEU . 9.2 mp -65.84 -17.43 64.64 Favored 'General case' 0 N--CA 1.478 0.958 0 CA-C-N 115.331 -0.849 . . . . 62.23 111.247 176.858 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 45.8 mm -67.86 -43.86 85.76 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.141 0 C-N-CA 123.136 0.574 . . . . 64.42 110.894 175.398 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . 0.544 ' H ' HG23 ' A' ' 2' ' ' THR . 25.6 mm-40 -58.86 -41.26 86.62 Favored 'General case' 0 N--CA 1.49 1.545 0 C-N-CA 123.089 0.555 . . . . 62.33 111.372 174.308 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . 0.468 HD12 ' HA ' ' A' ' 3' ' ' LEU . 71.5 mt -61.2 -47.48 85.95 Favored 'General case' 0 N--CA 1.482 1.134 0 C-N-CA 123.368 0.667 . . . . 72.52 111.223 175.13 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 60.4 tp -54.93 -42.94 72.88 Favored 'General case' 0 CA--C 1.554 1.104 0 C-N-CA 124.59 1.156 . . . . 74.24 112.238 176.305 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 94.8 mt -70.69 -40.54 77.07 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.091 0 C-N-CA 124.308 1.043 . . . . 73.31 111.993 178.88 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 46.1 t -62.52 -45.7 98.16 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.959 0 C-N-CA 123.325 0.65 . . . . 72.41 111.095 175.718 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 69.1 t -62.07 -36.79 76.16 Favored 'Isoleucine or valine' 0 CA--C 1.561 1.387 0 C-N-CA 123.281 0.633 . . . . 74.15 111.379 174.664 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -65.95 -51.6 57.12 Favored 'General case' 0 CA--C 1.553 1.081 0 C-N-CA 123.099 0.559 . . . . 73.33 112.276 178.688 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' ILE . . . . . 0.609 ' HA ' HD12 ' A' ' 15' ' ' ILE . 23.5 pt -68.41 -42.42 84.04 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.089 0 C-N-CA 123.159 0.584 . . . . 71.43 111.978 -175.199 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 79.3 mt -65.14 -32.68 59.34 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.028 0 C-N-CA 123.307 0.643 . . . . 75.03 110.51 174.807 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -60.82 -38.25 94.99 Favored Glycine 0 C--N 1.354 1.573 0 CA-C-N 115.831 -0.622 . . . . 71.44 112.833 174.992 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . 0.609 HD12 ' HA ' ' A' ' 12' ' ' ILE . 24.7 mt -69.87 -43.05 79.96 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.975 0 C-N-CA 123.877 0.871 . . . . 64.0 111.173 175.569 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.492 ' HG ' ' O ' ' A' ' 12' ' ' ILE . 20.7 mt -63.95 -35.73 81.65 Favored 'General case' 0 N--CA 1.486 1.37 0 C-N-CA 122.969 0.508 . . . . 74.25 111.366 -178.766 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -73.24 -44.58 59.22 Favored 'General case' 0 N--CA 1.479 1.014 0 C-N-CA 123.216 0.606 . . . . 75.21 110.673 175.564 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -60.38 -28.56 68.31 Favored 'General case' 0 N--CA 1.483 1.209 0 C-N-CA 124.166 0.986 . . . . 55.3 113.267 -179.843 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 2.8 pp -89.75 -38.38 11.03 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.327 0 CA-C-N 118.101 0.41 . . . . 63.45 111.607 173.656 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -67.8 -54.42 19.22 Favored 'General case' 0 N--CA 1.487 1.386 0 N-CA-C 112.724 0.639 . . . . 63.43 112.724 -172.779 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 21.7 mt -53.07 -54.19 47.06 Favored Pre-proline 0 CA--C 1.566 1.576 0 N-CA-C 113.902 1.075 . . . . 73.15 113.902 -176.587 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 38.2 Cg_endo -65.66 -38.83 22.97 Favored 'Trans proline' 0 C--N 1.381 2.24 0 CA-C-N 121.636 1.62 . . . . 73.12 113.166 175.118 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 20.1 tt0 -62.98 -38.16 90.03 Favored 'General case' 0 N--CA 1.489 1.525 0 C-N-CA 123.462 0.705 . . . . 75.31 110.95 -177.102 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 24' ' ' PHE . . . . . . . . . . . . . 32.8 m-85 -91.9 -36.99 13.15 Favored 'General case' 0 N--CA 1.486 1.348 0 CA-C-N 115.046 -0.979 . . . . 72.41 111.746 -174.663 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 47.3 t -63.59 -46.75 84.41 Favored 'General case' 0 N--CA 1.492 1.639 0 CA-C-N 117.774 0.261 . . . . 70.14 111.189 173.777 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -67.14 -26.44 66.67 Favored 'General case' 0 N--CA 1.483 1.207 0 C-N-CA 122.909 0.484 . . . . 62.33 111.834 174.796 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 68.8 t80 -66.42 -55.15 17.14 Favored 'General case' 0 N--CA 1.485 1.284 0 C-N-CA 122.995 0.518 . . . . 74.44 111.131 178.897 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 35.6 ptt180 -65.45 -28.93 69.57 Favored 'General case' 0 N--CA 1.475 0.817 0 C-N-CA 123.473 0.709 . . . . 74.33 111.488 -175.841 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 78.6 t -77.35 -48.32 24.79 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.843 0 CA-C-N 115.976 -0.556 . . . . 63.03 110.422 179.085 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 15.1 pttp -67.79 -27.52 66.81 Favored 'General case' 0 N--CA 1.476 0.848 0 CA-C-N 116.171 -0.468 . . . . 72.4 110.557 178.709 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -81.28 -30.01 34.13 Favored 'General case' 0 C--N 1.366 1.292 0 N-CA-C 110.086 -0.339 . . . . 74.44 110.086 -179.798 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 62.2 t80 -62.75 -54.29 41.41 Favored 'General case' 0 C--N 1.352 0.7 0 CA-C-N 115.957 -0.565 . . . . 73.24 109.724 174.72 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 52.1 m-80 -69.35 -37.7 77.78 Favored 'General case' 0 N--CA 1.479 0.993 0 C-N-CA 123.637 0.775 . . . . 75.31 113.064 179.512 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 33.7 t -63.42 -55.89 20.65 Favored 'General case' 0 N--CA 1.498 1.953 0 CA-C-O 120.964 0.411 . . . . 34.21 111.502 178.734 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -68.12 -38.01 81.78 Favored 'General case' 0 CA--C 1.542 0.637 0 CA-C-N 115.435 -0.802 . . . . 74.13 112.027 -179.205 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -66.35 -52.79 43.42 Favored 'General case' 0 N--CA 1.499 1.983 0 N-CA-C 112.242 0.46 . . . . 62.44 112.242 179.735 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 50.7 m -58.16 -43.45 87.4 Favored 'General case' 0 N--CA 1.488 1.431 0 C-N-CA 123.1 0.56 . . . . 75.54 111.465 179.689 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 41.7 t -74.37 -32.08 62.62 Favored 'General case' 0 N--CA 1.481 1.121 0 CA-C-N 116.022 -0.535 . . . . 73.23 112.038 -179.275 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 24.1 t70 -59.09 -54.92 41.59 Favored 'General case' 0 N--CA 1.48 1.062 0 C-N-CA 122.926 0.49 . . . . 63.41 111.21 175.44 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 4.0 pp -75.4 -26.46 58.43 Favored 'General case' 0 N--CA 1.49 1.567 0 CA-C-N 116.125 -0.488 . . . . 74.13 111.455 -172.119 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 59.1 ttp180 -75.76 -40.99 54.41 Favored 'General case' 0 CA--C 1.545 0.785 0 C-N-CA 123.554 0.742 . . . . 75.03 110.87 175.788 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 64.1 t30 -67.62 -36.93 81.73 Favored 'General case' 0 N--CA 1.487 1.409 0 C-N-CA 123.301 0.641 . . . . 60.15 111.11 178.945 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 81.0 mt -73.3 -27.97 61.84 Favored 'General case' 0 N--CA 1.482 1.168 0 C-N-CA 122.891 0.476 . . . . 75.2 111.33 178.443 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . 0.463 ' HE3' ' HA ' ' A' ' 44' ' ' LYS . 0.1 OUTLIER -79.34 -44.72 21.01 Favored 'General case' 0 N--CA 1.469 0.506 0 C-N-CA 122.723 0.409 . . . . 61.34 110.215 -179.887 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 4.9 t -69.53 -34.43 74.24 Favored 'General case' 0 N--CA 1.48 1.033 0 O-C-N 123.715 0.634 . . . . 72.41 111.17 -177.637 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -69.1 -41.79 76.98 Favored 'General case' 0 N--CA 1.477 0.887 0 C-N-CA 123.718 0.807 . . . . 62.44 111.304 174.06 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 42.9 tp -66.32 -43.98 84.67 Favored 'General case' 0 N--CA 1.477 0.899 0 C-N-CA 123.481 0.712 . . . . 74.2 112.165 -179.78 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 12.9 pt-20 -74.05 -34.05 63.93 Favored 'General case' 0 N--CA 1.484 1.254 0 C-N-CA 122.798 0.439 . . . . 73.34 111.624 -177.199 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 79.4 p -72.32 -33.95 67.74 Favored 'General case' 0 N--CA 1.489 1.484 0 C-N-CA 122.725 0.41 . . . . 55.12 110.896 175.561 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -70.38 -41.91 72.44 Favored 'General case' 0 N--CA 1.479 0.986 0 CA-C-N 115.646 -0.706 . . . . 72.32 111.074 177.696 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 51' ' ' PHE . . . . . . . . . . . . . 69.7 t80 -79.6 -15.85 56.9 Favored 'General case' 0 CA--C 1.553 1.059 0 C-N-CA 123.256 0.622 . . . . 74.44 110.67 179.998 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -67.54 -40.76 85.02 Favored 'General case' 0 N--CA 1.478 0.929 0 C-N-CA 123.25 0.62 . . . . 71.11 110.515 179.688 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 3.0 p30 -78.01 -26.8 48.73 Favored 'General case' 0 CA--C 1.555 1.155 0 CA-C-N 116.039 -0.528 . . . . 63.12 111.595 178.857 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -62.95 -53.83 47.94 Favored 'General case' 0 N--CA 1.488 1.447 0 C-N-CA 123.181 0.592 . . . . 73.12 111.451 171.265 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 10.5 pt20 -68.92 -33.96 74.6 Favored 'General case' 0 N--CA 1.481 1.124 0 C-N-CA 122.58 0.352 . . . . 72.35 111.948 -176.572 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 81.7 p -92.98 73.17 4.76 Favored 'General case' 0 N--CA 1.485 1.319 0 CA-C-O 122.153 0.978 . . . . 62.02 109.936 172.627 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 36.6 p90 -101.21 151.38 37.7 Favored Pre-proline 0 CA--C 1.557 1.215 0 CA-C-N 114.725 -1.125 . . . . 72.03 110.34 179.129 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 45.3 Cg_exo -57.58 134.17 61.47 Favored 'Trans proline' 0 C--N 1.379 2.148 0 C-N-CA 122.319 2.013 . . . . 71.32 112.062 175.157 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 50.0 Cg_exo -56.7 140.76 91.36 Favored 'Trans proline' 0 C--N 1.378 2.08 0 C-N-CA 123.128 2.552 . . . . 43.3 113.664 179.167 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 11.5 pt-20 -56.22 -43.4 78.54 Favored 'General case' 0 CA--C 1.561 1.38 0 C-N-CA 124.175 0.99 . . . . 62.22 112.776 -178.772 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 63.5 m . . . . . 0 N--CA 1.488 1.456 0 C-N-CA 124.78 1.232 . . . . 73.25 109.434 179.26 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 1' ' ' PHE . . . . . . . . . . . . . 86.3 m-85 . . . . . 0 N--CA 1.487 1.411 0 N-CA-C 110.295 -0.261 . . . . 61.45 110.295 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 55.1 m -78.45 123.01 26.57 Favored 'General case' 0 N--CA 1.476 0.845 0 N-CA-C 109.023 -0.732 . . . . 64.2 109.023 179.339 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . 0.506 HD13 HD12 ' A' ' 6' ' ' LEU . 3.3 mm? -62.27 -23.04 66.47 Favored 'General case' 0 N--CA 1.487 1.391 0 C-N-CA 123.192 0.597 . . . . 60.14 111.755 -177.594 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 47.8 mm -69.75 -49.37 58.42 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.118 0 C-N-CA 123.165 0.586 . . . . 72.32 110.475 171.397 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 40.8 mm-40 -59.35 -38.32 80.08 Favored 'General case' 0 N--CA 1.491 1.614 0 C-N-CA 123.337 0.655 . . . . 74.45 112.166 176.062 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . 0.506 HD12 HD13 ' A' ' 3' ' ' LEU . 78.6 mt -69.95 -39.75 75.84 Favored 'General case' 0 N--CA 1.48 1.033 0 C-N-CA 123.001 0.521 . . . . 72.45 111.31 176.883 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 2.1 tm? -60.01 -48.46 81.62 Favored 'General case' 0 CA--C 1.552 1.028 0 C-N-CA 123.632 0.773 . . . . 63.4 110.432 176.958 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 77.6 mt -68.84 -48.29 71.57 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.732 0 C-N-CA 123.997 0.919 . . . . 75.52 112.227 -177.568 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 7.1 p -60.57 -40.62 85.07 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.158 0 CA-C-N 118.22 0.463 . . . . 64.31 111.823 -178.29 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 54.0 t -67.16 -41.52 87.02 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.027 0 C-N-CA 123.328 0.651 . . . . 64.24 110.903 173.572 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -64.03 -52.43 59.5 Favored 'General case' 0 N--CA 1.484 1.242 0 C-N-CA 122.946 0.498 . . . . 63.35 111.987 -178.581 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' ILE . . . . . 0.51 ' O ' ' HG ' ' A' ' 16' ' ' LEU . 28.6 pt -64.09 -47.21 91.23 Favored 'Isoleucine or valine' 0 C--N 1.355 0.815 0 C-N-CA 123.362 0.665 . . . . 70.03 111.474 -175.817 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 79.0 mt -64.21 -31.04 51.8 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.054 0 C-N-CA 123.322 0.649 . . . . 63.04 110.443 177.929 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -65.26 -40.52 96.69 Favored Glycine 0 C--N 1.352 1.445 0 CA-C-N 115.714 -0.675 . . . . 74.14 112.9 174.084 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 22.4 mt -69.05 -44.77 80.91 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.052 0 C-N-CA 123.63 0.772 . . . . 61.03 110.833 175.382 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.51 ' HG ' ' O ' ' A' ' 12' ' ' ILE . 16.3 mt -60.99 -37.14 81.44 Favored 'General case' 0 N--CA 1.48 1.047 0 C-N-CA 123.345 0.658 . . . . 72.34 111.043 -178.314 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -74.24 -49.33 23.73 Favored 'General case' 0 CA--C 1.551 1.002 0 C-N-CA 122.959 0.504 . . . . 74.33 110.944 176.352 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -55.82 -29.94 60.6 Favored 'General case' 0 N--CA 1.491 1.594 0 C-N-CA 124.017 0.927 . . . . 74.31 113.248 -178.787 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 2.8 pp -86.97 -37.66 11.44 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.833 0 CA-C-O 119.601 -0.237 . . . . 74.5 111.472 172.432 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -61.95 -53.98 48.06 Favored 'General case' 0 N--CA 1.487 1.411 0 C-N-CA 124.009 0.924 . . . . 75.12 113.274 -172.098 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 3.0 mp -56.46 -54.62 51.35 Favored Pre-proline 0 CA--C 1.572 1.817 0 CA-C-O 118.444 -0.789 . . . . 54.13 112.614 -175.094 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 36.7 Cg_endo -64.85 -39.33 26.0 Favored 'Trans proline' 0 C--N 1.381 2.268 0 C-N-CA 122.166 1.911 . . . . 75.22 113.305 176.385 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 5.1 tt0 -60.05 -43.55 95.3 Favored 'General case' 0 N--CA 1.489 1.512 0 C-N-CA 123.944 0.898 . . . . 65.51 110.523 -179.075 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 24' ' ' PHE . . . . . . . . . . . . . 16.0 m-85 -87.67 -28.28 21.92 Favored 'General case' 0 N--CA 1.485 1.324 0 CA-C-N 114.819 -1.082 . . . . 74.32 111.319 -172.281 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 74.3 m -59.62 -59.41 5.48 Favored 'General case' 0 N--CA 1.481 1.122 0 N-CA-C 109.549 -0.537 . . . . 74.22 109.549 167.264 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -62.0 -26.95 68.52 Favored 'General case' 0 N--CA 1.485 1.289 0 C-N-CA 124.02 0.928 . . . . 51.31 112.715 -179.714 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 27' ' ' TYR . . . . . 0.428 ' O ' ' HG2' ' A' ' 30' ' ' LYS . 57.3 t80 -70.03 -52.92 20.2 Favored 'General case' 0 N--CA 1.484 1.252 0 C-N-CA 123.476 0.71 . . . . 65.41 110.885 176.21 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 82.4 mtp180 -71.84 -20.68 61.79 Favored 'General case' 0 N--CA 1.475 0.81 0 CA-C-N 115.812 -0.631 . . . . 73.1 111.524 179.505 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 38.9 t -76.82 -44.51 32.68 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.445 0 C-N-CA 122.744 0.418 . . . . 64.21 110.397 174.996 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . 0.428 ' HG2' ' O ' ' A' ' 27' ' ' TYR . 17.1 ptmt -71.15 -26.79 63.14 Favored 'General case' 0 N--CA 1.479 1.001 0 O-C-N 123.391 0.432 . . . . 73.51 110.34 178.57 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -81.81 -32.88 31.07 Favored 'General case' 0 C--N 1.362 1.111 0 C-N-CA 123.059 0.544 . . . . 54.25 110.453 178.176 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 41.5 t80 -65.39 -46.23 80.89 Favored 'General case' 0 C--O 1.21 -0.996 0 N-CA-C 108.888 -0.782 . . . . 75.42 108.888 174.772 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 8.2 t30 -66.64 -45.07 80.22 Favored 'General case' 0 CA--C 1.547 0.832 0 C-N-CA 125.034 1.334 . . . . 74.4 111.982 177.294 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 42.4 t -63.99 -56.7 13.17 Favored 'General case' 0 N--CA 1.491 1.618 0 C-N-CA 123.27 0.628 . . . . 55.11 111.877 -179.094 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -65.91 -36.42 83.34 Favored 'General case' 0 N--CA 1.475 0.779 0 C-N-CA 123.139 0.576 . . . . 51.24 111.992 -179.248 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -69.47 -40.75 76.91 Favored 'General case' 0 N--CA 1.496 1.83 0 CA-C-N 117.764 0.256 . . . . 71.11 111.639 177.954 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 47.2 t -62.59 -44.58 95.96 Favored 'General case' 0 N--CA 1.484 1.242 0 C-N-CA 123.155 0.582 . . . . 72.22 110.816 175.375 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 70.9 m -71.04 -26.4 63.07 Favored 'General case' 0 N--CA 1.483 1.207 0 C-N-CA 122.942 0.497 . . . . 72.2 111.853 178.303 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 28.2 t70 -66.31 -51.17 60.05 Favored 'General case' 0 CA--C 1.551 0.993 0 C-N-CA 123.252 0.621 . . . . 73.14 110.416 172.929 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 4.0 pp -78.25 -18.34 55.48 Favored 'General case' 0 N--CA 1.49 1.569 0 N-CA-C 112.082 0.401 . . . . 63.44 112.082 -174.853 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 41' ' ' ARG . . . . . 0.413 ' HA ' ' HD3' ' A' ' 41' ' ' ARG . 26.9 mmt180 -84.13 -59.49 2.39 Favored 'General case' 0 N--CA 1.48 1.06 0 CA-C-O 118.93 -0.557 . . . . 74.53 112.113 172.695 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 49.5 t-20 -60.56 -42.6 96.95 Favored 'General case' 0 N--CA 1.497 1.887 0 C-N-CA 123.034 0.534 . . . . 62.35 111.824 -174.432 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . 0.439 ' O ' HD23 ' A' ' 47' ' ' LEU . 96.7 mt -75.08 -28.25 60.24 Favored 'General case' 0 N--CA 1.486 1.335 0 C-N-CA 122.43 0.292 . . . . 73.51 111.471 -175.312 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 29.4 ttpp -79.42 -48.1 14.56 Favored 'General case' 0 N--CA 1.474 0.765 0 N-CA-C 109.664 -0.495 . . . . 74.34 109.664 178.613 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 3.9 t -70.22 -27.21 64.29 Favored 'General case' 0 N--CA 1.487 1.424 0 C-N-CA 124.174 0.99 . . . . 71.11 112.071 -174.455 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -60.92 -50.77 72.08 Favored 'General case' 0 N--CA 1.478 0.97 0 O-C-N 123.74 0.65 . . . . 72.24 110.914 173.146 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 47' ' ' LEU . . . . . 0.439 HD23 ' O ' ' A' ' 43' ' ' LEU . 4.2 mm? -65.68 -36.16 82.84 Favored 'General case' 0 N--CA 1.487 1.41 0 C-N-CA 123.609 0.763 . . . . 73.51 111.569 175.98 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 48.7 mt-10 -68.04 -33.75 75.16 Favored 'General case' 0 N--CA 1.483 1.211 0 C-N-CA 122.968 0.507 . . . . 74.11 111.499 176.579 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 44.1 t -83.08 -23.16 33.22 Favored 'General case' 0 N--CA 1.485 1.302 0 C-N-CA 123.313 0.645 . . . . 43.33 111.84 177.736 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -79.0 -30.13 44.09 Favored 'General case' 0 N--CA 1.486 1.331 0 C-N-CA 123.6 0.76 . . . . 51.51 112.551 -175.268 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 51' ' ' PHE . . . . . . . . . . . . . 78.1 t80 -115.83 -22.36 9.13 Favored 'General case' 0 N--CA 1.477 0.898 0 C-N-CA 123.434 0.694 . . . . 64.42 110.135 -177.966 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . 70.81 89.95 0.1 Allowed 'General case' 0 CA--C 1.55 0.965 0 C-N-CA 125.008 1.323 . . . . 72.13 109.575 -165.058 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 18.7 t70 -40.14 -52.52 2.56 Favored 'General case' 0 N--CA 1.499 1.991 0 C-N-CA 125.497 1.519 . . . . 74.24 113.569 -174.653 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 15.0 t70 -114.28 126.42 55.01 Favored 'General case' 0 N--CA 1.48 1.026 0 N-CA-C 108.918 -0.771 . . . . 65.34 108.918 171.512 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 77.1 mm-40 -81.89 -14.52 56.07 Favored 'General case' 0 N--CA 1.486 1.353 0 N-CA-C 112.849 0.685 . . . . 64.22 112.849 -174.639 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 40.9 p -119.0 5.44 11.35 Favored 'General case' 0 N--CA 1.493 1.703 0 N-CA-C 113.3 0.852 . . . . 72.43 113.3 -171.687 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 71.5 t80 -53.85 110.16 1.92 Allowed Pre-proline 0 N--CA 1.489 1.494 0 C-N-CA 124.112 0.965 . . . . 62.04 112.925 -173.638 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 37.7 Cg_endo -87.89 167.84 6.93 Favored 'Trans proline' 0 CA--C 1.563 1.941 0 C-N-CA 122.713 2.275 . . . . 72.25 112.796 176.373 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 24.5 Cg_exo -66.7 153.06 79.27 Favored 'Trans proline' 0 C--N 1.373 1.841 0 C-N-CA 122.491 2.128 . . . . 74.44 111.883 163.876 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 2.6 mp0 -68.91 111.38 4.91 Favored 'General case' 0 N--CA 1.481 1.116 0 C-N-CA 123.074 0.55 . . . . 74.34 110.087 178.791 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 38.3 t . . . . . 0 CA--C 1.563 1.448 0 C-N-CA 123.571 0.748 . . . . 64.44 111.822 -178.726 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 1' ' ' PHE . . . . . . . . . . . . . 98.9 m-85 . . . . . 0 N--CA 1.487 1.393 0 CA-C-O 120.877 0.37 . . . . 74.01 110.697 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 31.4 p -75.43 156.14 35.62 Favored 'General case' 0 N--CA 1.483 1.201 0 C-N-CA 123.22 0.608 . . . . 72.01 111.822 -179.586 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 3.3 mm? -64.63 -19.29 65.6 Favored 'General case' 0 N--CA 1.484 1.255 0 CA-C-N 115.574 -0.739 . . . . 62.4 111.05 171.931 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 49.6 mm -73.64 -48.57 39.93 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.026 0 C-N-CA 123.163 0.585 . . . . 54.03 110.668 178.878 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 47.1 mt-10 -56.64 -44.35 81.18 Favored 'General case' 0 N--CA 1.489 1.49 0 C-N-CA 123.396 0.679 . . . . 74.31 111.267 175.971 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 82.3 mt -59.18 -47.0 86.94 Favored 'General case' 0 N--CA 1.481 1.106 0 C-N-CA 123.439 0.696 . . . . 72.4 111.579 174.213 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 37.1 tp -56.7 -40.37 75.49 Favored 'General case' 0 CA--C 1.549 0.926 0 C-N-CA 123.454 0.701 . . . . 73.14 112.138 178.706 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 82.4 mt -66.52 -50.43 66.9 Favored 'Isoleucine or valine' 0 C--N 1.355 0.825 0 C-N-CA 123.972 0.909 . . . . 72.52 111.275 178.458 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 86.8 t -58.25 -44.11 87.31 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.974 0 C-N-CA 123.583 0.753 . . . . 75.03 111.343 179.18 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 70.0 t -67.07 -36.15 76.28 Favored 'Isoleucine or valine' 0 CA--C 1.554 1.121 0 C-N-CA 122.896 0.478 . . . . 75.24 111.695 176.429 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -67.18 -53.55 29.35 Favored 'General case' 0 N--CA 1.483 1.188 0 C-N-CA 122.607 0.363 . . . . 75.52 111.325 179.991 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' ILE . . . . . 0.628 HG13 HD12 ' A' ' 13' ' ' ILE . 33.4 pt -64.1 -48.4 86.0 Favored 'Isoleucine or valine' 0 CA--C 1.554 1.107 0 C-N-CA 123.439 0.696 . . . . 61.25 111.651 -175.829 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' ILE . . . . . 0.628 HD12 HG13 ' A' ' 12' ' ' ILE . 1.8 mp -64.84 -32.97 60.41 Favored 'Isoleucine or valine' 0 C--N 1.372 1.566 0 C-N-CA 123.066 0.546 . . . . 75.11 109.986 175.479 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -59.53 -37.63 92.44 Favored Glycine 0 C--N 1.352 1.424 0 O-C-N 123.578 0.549 . . . . 63.43 113.328 177.641 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 18.5 mt -72.12 -44.65 64.93 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.989 0 C-N-CA 123.372 0.669 . . . . 65.31 110.784 176.043 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.521 ' HG ' ' O ' ' A' ' 12' ' ' ILE . 22.7 mt -59.63 -37.89 79.87 Favored 'General case' 0 N--CA 1.488 1.442 0 C-N-CA 123.428 0.691 . . . . 72.33 111.136 179.41 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -74.1 -48.7 27.9 Favored 'General case' 0 N--CA 1.474 0.754 0 C-N-CA 123.603 0.761 . . . . 52.52 110.918 178.498 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -56.41 -27.76 57.45 Favored 'General case' 0 N--CA 1.486 1.33 0 C-N-CA 123.91 0.884 . . . . 71.2 112.803 -178.176 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 2.8 pp -91.39 -37.92 9.82 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.175 0 N-CA-C 112.035 0.383 . . . . 64.23 112.035 172.89 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -66.93 -50.1 63.45 Favored 'General case' 0 N--CA 1.489 1.498 0 N-CA-C 113.141 0.793 . . . . 75.31 113.141 -171.089 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 2.5 mp -59.35 -54.24 58.11 Favored Pre-proline 0 CA--C 1.567 1.623 0 CA-C-O 118.534 -0.746 . . . . 74.24 112.509 -175.392 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 30.2 Cg_endo -63.44 -39.74 35.05 Favored 'Trans proline' 0 C--N 1.384 2.43 0 C-N-CA 121.921 1.747 . . . . 64.44 113.43 176.514 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 8.9 tt0 -64.88 -37.29 87.13 Favored 'General case' 0 N--CA 1.483 1.199 0 CA-C-N 115.366 -0.834 . . . . 75.3 110.566 -177.04 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 24' ' ' PHE . . . . . . . . . . . . . 71.6 t80 -83.05 -36.86 24.6 Favored 'General case' 0 N--CA 1.484 1.234 0 CA-C-N 114.701 -1.136 . . . . 73.34 110.898 -176.243 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 40.6 t -57.39 -44.69 84.71 Favored 'General case' 0 N--CA 1.48 1.053 0 C-N-CA 123.139 0.575 . . . . 53.01 110.941 172.108 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -72.57 -32.8 66.3 Favored 'General case' 0 N--CA 1.477 0.907 0 CA-C-N 115.878 -0.601 . . . . 64.34 111.873 176.077 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 76.5 t80 -68.48 -47.44 67.06 Favored 'General case' 0 N--CA 1.493 1.684 0 C-N-CA 124.135 0.974 . . . . 75.54 112.223 -176.437 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 10.4 ptm180 -75.2 -24.72 57.82 Favored 'General case' 0 N--CA 1.475 0.802 0 CA-C-N 115.303 -0.862 . . . . 64.3 110.914 -175.274 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 86.2 t -84.01 -34.14 9.84 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.555 0 CA-C-O 121.143 0.497 . . . . 51.31 109.966 175.851 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 30.0 tttt -61.77 -35.28 77.67 Favored 'General case' 0 CA--C 1.546 0.823 0 C-N-CA 123.703 0.801 . . . . 74.12 110.172 167.301 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -68.72 -39.45 80.4 Favored 'General case' 0 N--CA 1.48 1.07 0 C-N-CA 123.239 0.616 . . . . 31.32 110.724 178.111 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 76.0 t80 -59.16 -59.7 5.04 Favored 'General case' 0 C--O 1.212 -0.871 0 CA-C-N 115.714 -0.675 . . . . 75.4 110.084 173.908 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 3.9 m-20 -56.8 -44.15 81.66 Favored 'General case' 0 N--CA 1.486 1.325 0 C-N-CA 124.06 0.944 . . . . 73.44 113.128 -179.512 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 46.9 t -68.04 -57.16 6.59 Favored 'General case' 0 N--CA 1.487 1.401 0 C-N-CA 123.289 0.635 . . . . 64.4 110.842 -177.151 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -65.9 -36.14 82.57 Favored 'General case' 0 N--CA 1.48 1.037 0 N-CA-C 112.3 0.482 . . . . 72.23 112.3 -178.758 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -69.08 -47.83 64.26 Favored 'General case' 0 N--CA 1.495 1.803 0 N-CA-C 111.921 0.341 . . . . 51.32 111.921 179.175 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 67.3 m -69.23 -33.26 73.0 Favored 'General case' 0 N--CA 1.486 1.372 0 C-N-CA 122.62 0.368 . . . . 63.13 111.762 179.179 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 32.2 t -78.96 -26.14 43.51 Favored 'General case' 0 N--CA 1.486 1.342 0 C-N-CA 123.071 0.549 . . . . 42.52 111.339 178.284 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 27.1 t70 -67.63 -48.27 67.21 Favored 'General case' 0 N--CA 1.476 0.865 0 C-N-CA 123.146 0.578 . . . . 74.01 110.123 169.165 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 92.2 mt -67.13 -30.97 71.11 Favored 'General case' 0 N--CA 1.483 1.193 0 C-N-CA 123.144 0.578 . . . . 64.33 110.974 -179.497 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 50.1 ttm-85 -71.78 -45.79 60.45 Favored 'General case' 0 CA--C 1.541 0.626 0 C-N-CA 123.269 0.628 . . . . 74.41 110.266 175.178 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 63.3 t30 -64.28 -39.76 94.58 Favored 'General case' 0 N--CA 1.482 1.139 0 C-N-CA 123.605 0.762 . . . . 75.44 111.863 -179.047 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 93.9 mt -75.91 -30.93 58.93 Favored 'General case' 0 N--CA 1.479 1.009 0 C-N-CA 123.247 0.619 . . . . 74.31 111.292 179.889 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 23.8 ttmm -73.55 -47.52 40.13 Favored 'General case' 0 N--CA 1.477 0.918 0 C-N-CA 123.039 0.536 . . . . 75.02 110.21 -178.483 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 3.6 t -68.69 -32.83 72.92 Favored 'General case' 0 N--CA 1.475 0.811 0 CA-C-N 114.592 -1.185 . . . . 75.41 111.362 -178.436 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -70.68 -43.6 68.74 Favored 'General case' 0 N--CA 1.474 0.727 0 CA-C-N 115.356 -0.838 . . . . 74.11 111.236 173.791 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 47' ' ' LEU . . . . . 0.483 HD23 HG23 ' A' ' 56' ' ' THR . 14.4 tp -70.52 -37.23 74.1 Favored 'General case' 0 N--CA 1.487 1.377 0 C-N-CA 123.108 0.563 . . . . 54.04 111.611 -175.77 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 12.2 pt-20 -74.16 -30.85 62.46 Favored 'General case' 0 N--CA 1.482 1.137 0 CA-C-N 116.187 -0.461 . . . . 75.2 111.071 178.217 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 24.9 t -82.28 -14.9 54.7 Favored 'General case' 0 N--CA 1.487 1.414 0 C-N-CA 123.027 0.531 . . . . 51.21 112.103 174.296 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -83.2 -49.37 9.52 Favored 'General case' 0 N--CA 1.485 1.305 0 C-N-CA 123.568 0.747 . . . . 74.25 111.159 -179.12 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 51' ' ' PHE . . . . . . . . . . . . . 25.6 m-85 -87.59 -42.01 13.03 Favored 'General case' 0 N--CA 1.47 0.539 0 CA-C-N 115.845 -0.616 . . . . 63.22 110.498 179.713 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . 60.11 20.23 9.47 Favored 'General case' 0 N--CA 1.49 1.568 0 C-N-CA 124.425 1.09 . . . . 73.33 112.501 -177.321 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 31.5 t70 -130.42 14.71 5.54 Favored 'General case' 0 N--CA 1.491 1.604 0 C-N-CA 123.829 0.852 . . . . 63.33 111.022 -174.004 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 26.7 m-20 61.75 24.64 14.71 Favored 'General case' 0 N--CA 1.493 1.708 0 C-N-CA 124.596 1.158 . . . . 71.5 113.604 179.652 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 20.8 mt-30 -74.9 -6.1 47.3 Favored 'General case' 0 N--CA 1.485 1.29 0 C-N-CA 123.615 0.766 . . . . 75.31 111.505 174.972 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 56' ' ' THR . . . . . 0.483 HG23 HD23 ' A' ' 47' ' ' LEU . 80.6 m -55.62 -38.43 69.47 Favored 'General case' 0 N--CA 1.484 1.269 0 C-N-CA 124.599 1.16 . . . . 64.22 111.623 171.209 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 92.9 m-85 -112.26 101.49 52.21 Favored Pre-proline 0 CA--C 1.556 1.206 0 C-N-CA 123.366 0.666 . . . . 73.03 110.188 178.003 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 16.4 Cg_exo -71.48 157.34 56.57 Favored 'Trans proline' 0 CA--C 1.564 2.02 0 C-N-CA 122.754 2.303 . . . . 74.22 112.644 173.692 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 42.1 Cg_exo -58.68 90.54 0.06 OUTLIER 'Trans proline' 0 C--N 1.387 2.563 0 C-N-CA 122.926 2.417 . . . . 72.32 112.295 172.732 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 39.0 tt0 -82.33 -29.98 30.72 Favored 'General case' 0 N--CA 1.479 0.983 0 C-N-CA 123.933 0.893 . . . . 73.52 112.326 -174.441 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 35.2 t . . . . . 0 N--CA 1.493 1.682 0 C-N-CA 123.104 0.562 . . . . 71.32 112.031 -176.283 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 1' ' ' PHE . . . . . . . . . . . . . 87.8 m-85 . . . . . 0 N--CA 1.485 1.301 0 N-CA-C 111.46 0.17 . . . . 74.14 111.46 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 2' ' ' THR . . . . . 0.518 HG23 ' H ' ' A' ' 5' ' ' GLU . 6.7 t -128.93 150.51 50.34 Favored 'General case' 0 N--CA 1.487 1.417 0 C-N-CA 122.72 0.408 . . . . 73.21 111.745 -175.458 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . 0.532 HD13 HD12 ' A' ' 6' ' ' LEU . 3.4 mm? -63.22 -24.2 67.77 Favored 'General case' 0 N--CA 1.483 1.212 0 CA-C-N 115.538 -0.756 . . . . 61.1 110.63 174.317 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 41.3 mm -59.24 -49.69 82.54 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.297 0 C-N-CA 123.725 0.81 . . . . 54.22 111.22 179.301 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . 0.518 ' H ' HG23 ' A' ' 2' ' ' THR . 43.8 mm-40 -65.5 -35.55 81.2 Favored 'General case' 0 N--CA 1.479 1.02 0 CA-C-N 116.079 -0.509 . . . . 71.41 111.854 177.639 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . 0.532 HD12 HD13 ' A' ' 3' ' ' LEU . 82.4 mt -64.31 -38.63 91.72 Favored 'General case' 0 N--CA 1.483 1.206 0 C-N-CA 122.617 0.367 . . . . 63.04 111.571 176.258 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . 0.434 ' HG ' ' O ' ' A' ' 3' ' ' LEU . 91.8 mt -60.77 -44.24 97.02 Favored 'General case' 0 N--CA 1.485 1.28 0 C-N-CA 123.327 0.651 . . . . 74.05 111.213 174.321 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 96.7 mt -68.66 -53.22 28.67 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.78 0 C-N-CA 124.087 0.955 . . . . 63.23 112.565 -179.163 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 71.0 t -57.63 -43.45 83.5 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.027 0 C-N-CA 123.705 0.802 . . . . 74.44 112.005 -177.209 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 72.9 t -68.42 -33.77 62.06 Favored 'Isoleucine or valine' 0 CA--C 1.559 1.32 0 C-N-CA 122.627 0.371 . . . . 74.43 111.952 176.919 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -73.46 -49.72 25.38 Favored 'General case' 0 N--CA 1.485 1.283 0 CA-C-N 118.091 0.405 . . . . 74.11 111.841 -179.52 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' ILE . . . . . 0.432 ' O ' ' HG ' ' A' ' 16' ' ' LEU . 25.8 pt -64.93 -43.11 96.28 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.151 0 C-N-CA 123.744 0.818 . . . . 74.21 112.064 -175.488 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 78.8 mt -73.38 -30.1 29.47 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.882 0 C-N-CA 123.881 0.873 . . . . 54.23 109.893 176.305 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -62.01 -36.24 92.59 Favored Glycine 0 C--N 1.355 1.624 0 CA-C-N 115.604 -0.725 . . . . 71.41 113.046 174.858 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . 0.425 HD12 ' HA ' ' A' ' 12' ' ' ILE . 21.5 mt -69.51 -47.21 73.37 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.892 0 C-N-CA 123.407 0.683 . . . . 64.31 110.549 173.544 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.432 ' HG ' ' O ' ' A' ' 12' ' ' ILE . 14.6 mt -59.94 -35.73 75.54 Favored 'General case' 0 N--CA 1.484 1.241 0 O-C-N 123.562 0.539 . . . . 72.32 112.172 -176.073 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -72.2 -52.16 17.79 Favored 'General case' 0 N--CA 1.478 0.939 0 CA-C-O 121.289 0.566 . . . . 63.24 110.662 174.87 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -64.51 -19.55 65.66 Favored 'General case' 0 N--CA 1.479 1.005 0 N-CA-C 114.175 1.176 . . . . 72.32 114.175 -176.837 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 2.7 pp -94.57 -43.33 13.09 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.178 0 CA-C-N 118.458 0.572 . . . . 65.21 111.441 173.441 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -72.39 -46.9 53.17 Favored 'General case' 0 N--CA 1.491 1.577 0 N-CA-C 112.542 0.571 . . . . 44.51 112.542 -170.483 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 23.4 mt -59.35 -54.41 56.43 Favored Pre-proline 0 CA--C 1.561 1.379 0 CA-C-O 118.091 -0.957 . . . . 73.43 113.063 -177.988 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 39.2 Cg_endo -65.43 -37.87 28.39 Favored 'Trans proline' 0 C--N 1.38 2.221 0 C-N-CA 121.821 1.681 . . . . 74.34 112.773 176.554 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 27.4 tt0 -66.07 -35.63 81.03 Favored 'General case' 0 N--CA 1.485 1.284 0 C-N-CA 123.349 0.66 . . . . 74.31 110.291 -178.124 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 24' ' ' PHE . . . . . . . . . . . . . 66.8 t80 -87.37 -38.03 16.55 Favored 'General case' 0 N--CA 1.489 1.49 0 CA-C-N 115.563 -0.744 . . . . 74.31 111.082 -176.959 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . 0.404 ' O ' HG23 ' A' ' 29' ' ' VAL . 74.7 m -56.15 -49.21 74.61 Favored 'General case' 0 N--CA 1.488 1.453 0 C-N-CA 122.358 0.263 . . . . 74.21 110.721 171.008 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -67.3 -30.76 70.7 Favored 'General case' 0 N--CA 1.483 1.216 0 C-N-CA 123.264 0.626 . . . . 54.42 112.19 175.932 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 61.2 t80 -68.38 -53.36 24.41 Favored 'General case' 0 N--CA 1.479 1.007 0 C-N-CA 123.16 0.584 . . . . 71.4 110.906 -179.044 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 1.8 ptm180 -69.59 -18.24 63.6 Favored 'General case' 0 N--CA 1.475 0.815 0 C-N-CA 123.317 0.647 . . . . 73.42 111.443 -175.415 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . 0.404 HG23 ' O ' ' A' ' 25' ' ' SER . 52.9 t -76.5 -51.43 19.51 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.183 0 CA-C-O 120.906 0.384 . . . . 75.03 110.45 171.436 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 21.2 ptmt -73.41 -18.7 61.12 Favored 'General case' 0 N--CA 1.482 1.154 0 CA-C-N 115.819 -0.628 . . . . 64.44 111.882 -178.572 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -87.15 -33.2 19.49 Favored 'General case' 0 N--CA 1.486 1.375 0 C-N-CA 123.459 0.704 . . . . 72.44 109.822 179.09 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 69.8 t80 -69.77 -22.32 63.36 Favored 'General case' 0 N--CA 1.483 1.211 0 CA-C-N 115.566 -0.743 . . . . 71.12 109.967 171.58 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 7.6 t30 -84.33 -51.23 7.14 Favored 'General case' 0 N--CA 1.475 0.785 0 C-N-CA 124.221 1.008 . . . . 61.42 111.218 173.106 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 46.5 t -67.67 -54.95 15.4 Favored 'General case' 0 N--CA 1.492 1.631 0 C-N-CA 123.247 0.619 . . . . 64.4 112.181 -172.427 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -61.41 -39.25 90.06 Favored 'General case' 0 N--CA 1.474 0.762 0 CA-C-N 115.981 -0.554 . . . . 72.12 111.296 178.572 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -70.36 -43.3 70.46 Favored 'General case' 0 N--CA 1.483 1.176 0 O-C-N 123.359 0.412 . . . . 75.44 111.808 -178.424 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 40.2 t -59.11 -43.91 91.94 Favored 'General case' 0 N--CA 1.491 1.6 0 C-N-CA 123.53 0.732 . . . . 74.35 111.514 178.249 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 44.6 t -79.08 -27.54 43.03 Favored 'General case' 0 N--CA 1.475 0.823 0 CA-C-N 115.411 -0.813 . . . . 72.25 112.059 -179.211 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 26.6 t70 -66.6 -47.17 73.55 Favored 'General case' 0 N--CA 1.481 1.083 0 C-N-CA 122.82 0.448 . . . . 75.45 110.809 172.414 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 97.2 mt -71.82 -31.73 66.85 Favored 'General case' 0 N--CA 1.481 1.091 0 C-N-CA 123.423 0.689 . . . . 71.21 110.829 -177.288 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 50.4 ttp180 -74.08 -31.99 63.07 Favored 'General case' 0 CA--C 1.548 0.882 0 CA-C-N 115.842 -0.617 . . . . 73.42 110.3 173.347 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 42' ' ' ASN . . . . . 0.468 ' HA ' HG22 ' A' ' 45' ' ' THR . 18.0 t-20 -68.63 -31.38 70.48 Favored 'General case' 0 N--CA 1.485 1.285 0 C-N-CA 122.802 0.441 . . . . 70.33 111.14 173.916 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 96.3 mt -66.67 -37.33 84.54 Favored 'General case' 0 N--CA 1.486 1.358 0 C-N-CA 123.022 0.529 . . . . 75.25 110.391 172.719 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 17.8 tppt? -72.61 -47.66 46.06 Favored 'General case' 0 N--CA 1.473 0.677 0 C-N-CA 123.682 0.793 . . . . 61.01 110.258 -176.761 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 45' ' ' THR . . . . . 0.468 HG22 ' HA ' ' A' ' 42' ' ' ASN . 2.9 t -68.3 -31.16 70.39 Favored 'General case' 0 N--CA 1.485 1.285 0 C-N-CA 123.872 0.869 . . . . 63.3 111.489 -177.52 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -65.51 -52.43 52.76 Favored 'General case' 0 N--CA 1.473 0.687 0 CA-C-N 115.18 -0.918 . . . . 74.31 110.569 173.929 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 91.7 mt -66.36 -27.75 68.12 Favored 'General case' 0 N--CA 1.485 1.301 0 C-N-CA 123.643 0.777 . . . . 70.2 112.494 176.535 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 13.1 tp10 -71.78 -53.36 13.63 Favored 'General case' 0 C--N 1.349 0.571 0 C-N-CA 124.304 1.042 . . . . 72.32 111.108 -179.577 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 46.8 t -67.46 -34.76 77.83 Favored 'General case' 0 N--CA 1.48 1.075 0 CA-C-N 115.542 -0.754 . . . . 74.15 111.569 178.897 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -65.94 -52.14 52.39 Favored 'General case' 0 N--CA 1.482 1.126 0 C-N-CA 123.347 0.659 . . . . 63.2 111.555 177.263 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 51' ' ' PHE . . . . . . . . . . . . . 73.9 t80 -72.1 -22.12 61.39 Favored 'General case' 0 N--CA 1.492 1.635 0 C-N-CA 123.334 0.654 . . . . 72.21 111.231 -178.923 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -65.58 -43.34 90.07 Favored 'General case' 0 N--CA 1.487 1.387 0 C-N-CA 122.928 0.491 . . . . 70.33 110.709 170.654 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 34.6 t70 -73.85 -27.31 61.02 Favored 'General case' 0 CA--C 1.564 1.503 0 C-N-CA 123.799 0.84 . . . . 75.34 110.701 171.984 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 35.9 t70 67.51 123.38 0.02 OUTLIER 'General case' 0 N--CA 1.484 1.245 0 C-N-CA 126.81 2.044 . . . . 72.2 114.817 177.689 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -132.46 17.14 4.41 Favored 'General case' 0 N--CA 1.483 1.205 0 C-N-CA 124.409 1.084 . . . . 74.54 109.599 170.047 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 85.7 m -96.36 -54.06 3.4 Favored 'General case' 0 N--CA 1.489 1.479 0 C-N-CA 123.907 0.883 . . . . 54.4 110.563 -179.708 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 48.3 m-85 -85.93 149.46 50.67 Favored Pre-proline 0 N--CA 1.489 1.519 0 C-N-CA 123.412 0.685 . . . . 73.34 110.11 179.994 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 58' ' ' PRO . . . . . 0.445 ' HA ' ' HD3' ' A' ' 59' ' ' PRO . 82.3 Cg_exo -50.75 132.94 38.12 Favored 'Trans proline' 0 C--N 1.382 2.315 0 C-N-CA 122.937 2.425 . . . . 70.2 113.145 173.548 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 59' ' ' PRO . . . . . 0.445 ' HD3' ' HA ' ' A' ' 58' ' ' PRO . 26.9 Cg_exo -61.71 106.59 0.44 Allowed 'Trans proline' 0 C--N 1.381 2.248 0 C-N-CA 122.799 2.333 . . . . 73.44 112.801 -173.987 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 45.2 tt0 -60.14 -37.32 79.73 Favored 'General case' 0 CA--C 1.555 1.171 0 C-N-CA 123.059 0.544 . . . . 74.42 111.623 -179.401 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 73.1 p . . . . . 0 N--CA 1.487 1.41 0 C-N-CA 123.204 0.602 . . . . 64.13 110.544 173.636 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 1' ' ' PHE . . . . . . . . . . . . . 43.6 p90 . . . . . 0 N--CA 1.491 1.619 0 CA-C-O 120.719 0.295 . . . . 75.25 111.719 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 2' ' ' THR . . . . . 0.663 ' HB ' ' HG2' ' A' ' 5' ' ' GLU . 25.8 m -90.28 136.94 32.74 Favored 'General case' 0 N--CA 1.479 0.979 0 C-N-CA 123.666 0.786 . . . . 60.32 109.908 174.374 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 7.7 tt -57.15 -33.31 67.27 Favored 'General case' 0 N--CA 1.488 1.473 0 C-N-CA 123.53 0.732 . . . . 64.23 110.745 176.594 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . 0.57 ' H ' HG22 ' A' ' 2' ' ' THR . 48.7 mm -65.95 -37.34 79.61 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.251 0 C-N-CA 123.093 0.557 . . . . 73.33 111.461 -178.223 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . 0.663 ' HG2' ' HB ' ' A' ' 2' ' ' THR . 11.2 mm-40 -56.68 -45.55 81.67 Favored 'General case' 0 N--CA 1.491 1.577 0 C-N-CA 123.296 0.639 . . . . 70.51 110.726 173.586 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 53.8 mt -65.43 -42.6 92.27 Favored 'General case' 0 N--CA 1.479 1.004 0 C-N-CA 123.625 0.77 . . . . 64.03 111.385 177.887 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -56.73 -48.91 76.7 Favored 'General case' 0 CA--C 1.552 1.041 0 C-N-CA 124.364 1.066 . . . . 73.31 110.294 178.089 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 95.2 mt -65.88 -43.77 92.92 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.791 0 C-N-CA 124.254 1.022 . . . . 63.32 112.143 -179.249 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 49.6 t -62.91 -45.45 98.84 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.061 0 C-N-CA 122.868 0.467 . . . . 73.04 111.396 178.383 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 71.6 t -66.58 -32.8 59.66 Favored 'Isoleucine or valine' 0 CA--C 1.562 1.431 0 C-N-CA 122.7 0.4 . . . . 73.1 111.016 175.36 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -67.23 -55.63 13.22 Favored 'General case' 0 CA--C 1.552 1.031 0 C-N-CA 123.065 0.546 . . . . 53.34 111.584 179.219 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' ILE . . . . . 0.477 ' O ' ' HG ' ' A' ' 16' ' ' LEU . 23.7 pt -61.28 -46.03 97.43 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.125 0 C-N-CA 123.461 0.705 . . . . 72.44 111.45 -176.869 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 77.1 mt -65.76 -32.16 56.95 Favored 'Isoleucine or valine' 0 CA--C 1.551 1.002 0 C-N-CA 124.138 0.975 . . . . 64.53 110.598 176.853 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -60.35 -39.69 96.49 Favored Glycine 0 C--N 1.349 1.293 0 CA-C-N 115.685 -0.689 . . . . 72.32 112.882 172.911 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 1.8 mp -72.99 -40.32 58.98 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.06 0 N-CA-C 109.757 -0.46 . . . . 73.54 109.757 176.869 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.477 ' HG ' ' O ' ' A' ' 12' ' ' ILE . 28.2 mt -58.83 -40.28 83.72 Favored 'General case' 0 N--CA 1.491 1.59 0 C-N-CA 123.113 0.565 . . . . 55.44 111.681 179.973 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -74.32 -45.77 45.19 Favored 'General case' 0 N--CA 1.479 1.009 0 C-N-CA 123.287 0.635 . . . . 72.23 110.864 176.833 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -59.18 -32.39 69.87 Favored 'General case' 0 N--CA 1.482 1.171 0 C-N-CA 123.99 0.916 . . . . 72.25 113.275 -178.871 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 2.8 pp -86.01 -37.71 12.02 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.153 0 C-N-CA 122.327 0.251 . . . . 75.4 111.324 175.628 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -63.44 -55.18 26.31 Favored 'General case' 0 N--CA 1.486 1.342 0 C-N-CA 123.792 0.837 . . . . 72.14 112.954 -174.799 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 21.5 mt -54.09 -54.51 46.6 Favored Pre-proline 0 CA--C 1.563 1.444 0 N-CA-C 113.66 0.985 . . . . 64.34 113.66 -174.956 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 37.7 Cg_endo -66.08 -40.42 15.87 Favored 'Trans proline' 0 C--N 1.378 2.103 0 CA-C-N 121.619 1.614 . . . . 72.5 112.894 176.107 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 23' ' ' GLN . . . . . 0.414 ' O ' ' HB2' ' A' ' 27' ' ' TYR . 5.7 tt0 -59.58 -41.75 90.94 Favored 'General case' 0 N--CA 1.485 1.314 0 C-N-CA 123.565 0.746 . . . . 65.33 110.829 -177.566 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 24' ' ' PHE . . . . . . . . . . . . . 19.1 m-85 -92.59 -33.9 14.24 Favored 'General case' 0 N--CA 1.484 1.234 0 CA-C-N 114.65 -1.159 . . . . 61.11 112.005 -172.068 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . 0.429 ' O ' HG23 ' A' ' 29' ' ' VAL . 43.3 t -61.82 -53.34 57.26 Favored 'General case' 0 N--CA 1.49 1.545 0 N-CA-C 110.284 -0.265 . . . . 62.42 110.284 170.764 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -63.58 -27.38 69.21 Favored 'General case' 0 N--CA 1.48 1.037 0 C-N-CA 123.384 0.673 . . . . 73.44 112.333 176.308 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 27' ' ' TYR . . . . . 0.414 ' HB2' ' O ' ' A' ' 23' ' ' GLN . 66.6 t80 -66.22 -48.48 70.44 Favored 'General case' 0 N--CA 1.482 1.171 0 C-N-CA 122.975 0.51 . . . . 61.21 111.386 176.904 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 13.7 mmt180 -67.65 -29.72 69.1 Favored 'General case' 0 N--CA 1.476 0.853 0 O-C-N 124.067 0.854 . . . . 73.33 111.548 -179.212 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . 0.429 HG23 ' O ' ' A' ' 25' ' ' SER . 87.8 t -72.7 -48.69 44.95 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.382 0 N-CA-C 109.359 -0.608 . . . . 60.35 109.359 176.486 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 8.1 tttp -55.14 -40.41 70.53 Favored 'General case' 0 CA--C 1.549 0.931 0 C-N-CA 124.722 1.209 . . . . 74.51 111.213 172.986 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -73.83 -45.22 52.59 Favored 'General case' 0 N--CA 1.476 0.845 0 C-N-CA 122.918 0.487 . . . . 72.04 110.78 -174.045 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 53.7 t80 -64.18 -37.44 87.48 Favored 'General case' 0 CA--C 1.544 0.737 0 O-C-N 123.829 0.706 . . . . 72.11 110.676 179.636 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 93.1 m-20 -72.99 -41.68 64.06 Favored 'General case' 0 N--CA 1.485 1.287 0 C-N-CA 123.774 0.83 . . . . 71.32 112.192 178.905 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 64.7 m -68.85 -49.81 55.18 Favored 'General case' 0 N--CA 1.496 1.843 0 C-N-CA 123.184 0.594 . . . . 75.12 110.935 -179.28 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -62.61 -40.11 95.92 Favored 'General case' 0 N--CA 1.476 0.842 0 CA-C-N 115.564 -0.744 . . . . 52.33 111.333 176.345 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -61.89 -46.33 89.87 Favored 'General case' 0 N--CA 1.496 1.832 0 O-C-N 123.465 0.478 . . . . 71.52 112.219 174.793 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 67.8 m -60.34 -43.44 96.45 Favored 'General case' 0 N--CA 1.494 1.727 0 C-N-CA 123.563 0.745 . . . . 73.24 111.329 179.206 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 37.6 m -73.36 -33.72 65.23 Favored 'General case' 0 N--CA 1.476 0.834 0 CA-C-N 115.362 -0.835 . . . . 73.43 111.607 179.248 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 29.5 t70 -60.49 -52.93 63.09 Favored 'General case' 0 N--CA 1.48 1.029 0 C-N-CA 123.52 0.728 . . . . 72.02 111.338 175.872 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 4.2 pp -71.22 -31.51 67.67 Favored 'General case' 0 N--CA 1.486 1.347 0 CA-C-N 116.194 -0.457 . . . . 65.44 111.143 -172.063 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 36.2 ttm180 -80.67 -40.74 24.94 Favored 'General case' 0 CA--C 1.548 0.891 0 C-N-CA 123.131 0.572 . . . . 64.42 110.92 -179.275 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 42' ' ' ASN . . . . . 0.476 ' HA ' HG22 ' A' ' 45' ' ' THR . 19.9 t-20 -68.04 -38.07 82.09 Favored 'General case' 0 N--CA 1.489 1.501 0 N-CA-C 112.183 0.438 . . . . 71.01 112.183 -178.738 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 86.9 mt -69.99 -29.07 66.07 Favored 'General case' 0 N--CA 1.484 1.23 0 C-N-CA 122.48 0.312 . . . . 54.22 111.369 179.005 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . 0.429 ' O ' ' HG2' ' A' ' 48' ' ' GLU . 86.4 tttt -78.15 -45.08 24.2 Favored 'General case' 0 CA--C 1.542 0.655 0 CA-C-N 115.906 -0.588 . . . . 72.32 110.423 176.394 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 45' ' ' THR . . . . . 0.476 HG22 ' HA ' ' A' ' 42' ' ' ASN . 1.5 t -68.23 -30.11 69.1 Favored 'General case' 0 N--CA 1.487 1.399 0 C-N-CA 123.374 0.669 . . . . 42.13 110.832 -176.65 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -58.27 -43.91 88.15 Favored 'General case' 0 N--CA 1.474 0.762 0 CA-C-N 115.02 -0.991 . . . . 63.14 110.582 169.5 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -68.09 -39.67 82.81 Favored 'General case' 0 CA--C 1.567 1.606 0 C-N-CA 123.608 0.763 . . . . 71.41 110.832 175.016 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . 0.429 ' HG2' ' O ' ' A' ' 44' ' ' LYS . 25.0 mm-40 -65.49 -33.74 76.64 Favored 'General case' 0 N--CA 1.487 1.404 0 C-N-CA 123.498 0.719 . . . . 74.51 111.662 -178.309 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 43.3 t -84.15 -55.81 4.0 Favored 'General case' 0 N--CA 1.478 0.94 0 C-N-CA 122.803 0.441 . . . . 71.43 111.952 176.408 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -60.5 -53.21 60.26 Favored 'General case' 0 N--CA 1.479 1.017 0 C-N-CA 123.414 0.686 . . . . 24.22 112.408 -175.457 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 51' ' ' PHE . . . . . . . . . . . . . 80.1 t80 -94.31 -40.19 10.1 Favored 'General case' 0 N--CA 1.481 1.09 0 CA-C-O 120.665 0.269 . . . . 72.23 111.607 -173.72 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -98.51 1.78 46.96 Favored 'General case' 0 N--CA 1.489 1.478 0 N-CA-C 114.038 1.125 . . . . 52.42 114.038 -168.868 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 30.5 t70 -125.8 -46.36 1.71 Allowed 'General case' 0 N--CA 1.485 1.294 0 CA-C-N 117.968 0.349 . . . . 73.34 110.776 177.088 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 24.2 t70 -165.64 110.65 0.87 Allowed 'General case' 0 N--CA 1.492 1.628 0 C-N-CA 122.924 0.49 . . . . 73.25 111.87 179.686 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 9.5 tp-100 -112.37 13.45 20.29 Favored 'General case' 0 N--CA 1.493 1.678 0 C-N-CA 123.705 0.802 . . . . 62.51 111.318 176.586 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 62.7 p -63.24 -51.61 65.53 Favored 'General case' 0 N--CA 1.496 1.853 0 O-C-N 121.711 -0.618 . . . . 73.44 110.902 179.179 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 76.8 m-85 -92.97 137.06 23.99 Favored Pre-proline 0 CA--C 1.548 0.878 0 CA-C-N 115.714 -0.675 . . . . 74.04 109.504 171.157 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 58' ' ' PRO . . . . . 0.408 ' HA ' ' HD3' ' A' ' 59' ' ' PRO . 69.8 Cg_endo -71.41 136.69 29.27 Favored 'Trans proline' 0 CA--C 1.564 2.022 0 C-N-CA 122.291 1.994 . . . . 73.14 112.169 -178.876 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 59' ' ' PRO . . . . . 0.408 ' HD3' ' HA ' ' A' ' 58' ' ' PRO . 5.4 Cg_exo -74.58 -154.83 0.04 OUTLIER 'Trans proline' 0 C--N 1.375 1.942 0 C-N-CA 123.403 2.736 . . . . 74.43 112.712 179.29 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 3.3 mp0 -70.16 -10.62 59.38 Favored 'General case' 0 CA--C 1.564 1.497 0 C-N-CA 123.19 0.596 . . . . 64.1 111.484 174.106 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 36.0 m . . . . . 0 CA--C 1.569 1.681 0 C-N-CA 125.637 1.575 . . . . 64.32 113.441 -179.062 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 1' ' ' PHE . . . . . . . . . . . . . 16.7 p90 . . . . . 0 N--CA 1.493 1.713 0 N-CA-C 112.918 0.711 . . . . 73.41 112.918 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 2' ' ' THR . . . . . 0.714 HG22 ' H ' ' A' ' 4' ' ' ILE . 19.7 m -86.3 134.02 33.77 Favored 'General case' 0 N--CA 1.484 1.275 0 C-N-CA 122.933 0.493 . . . . 54.53 111.455 -176.775 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . 0.411 ' O ' ' HG ' ' A' ' 7' ' ' LEU . 2.5 pt? -57.41 -27.87 62.76 Favored 'General case' 0 N--CA 1.484 1.225 0 C-N-CA 123.603 0.761 . . . . 70.4 112.449 175.218 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . 0.714 ' H ' HG22 ' A' ' 2' ' ' THR . 51.8 mm -84.42 -44.94 17.97 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.109 0 C-N-CA 123.37 0.668 . . . . 75.43 110.996 -176.708 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . 0.456 ' O ' HG23 ' A' ' 9' ' ' VAL . 22.4 mm-40 -58.69 -39.66 81.38 Favored 'General case' 0 N--CA 1.481 1.093 0 O-C-N 123.432 0.457 . . . . 72.2 111.357 176.126 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 2.4 pp -69.34 -31.61 70.16 Favored 'General case' 0 N--CA 1.484 1.226 0 C-N-CA 122.351 0.26 . . . . 65.31 111.33 178.923 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . 0.411 ' HG ' ' O ' ' A' ' 3' ' ' LEU . 90.5 mt -64.15 -37.34 87.12 Favored 'General case' 0 N--CA 1.484 1.241 0 C-N-CA 122.464 0.305 . . . . 64.21 111.579 172.035 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 84.0 mt -68.7 -43.48 83.04 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.078 0 C-N-CA 123.252 0.621 . . . . 73.45 111.645 175.446 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . 0.456 HG23 ' O ' ' A' ' 5' ' ' GLU . 95.9 t -59.53 -48.34 87.64 Favored 'Isoleucine or valine' 0 CA--C 1.556 1.196 0 C-N-CA 123.657 0.783 . . . . 74.02 111.928 175.323 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . 0.405 HG12 ' HA ' ' A' ' 7' ' ' LEU . 5.5 p -69.77 -25.13 27.71 Favored 'Isoleucine or valine' 0 CA--C 1.557 1.215 0 C-N-CA 122.77 0.428 . . . . 75.03 111.374 179.281 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -68.66 -55.61 10.88 Favored 'General case' 0 C--N 1.36 1.038 0 C-N-CA 122.766 0.426 . . . . 63.2 111.366 175.196 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' ILE . . . . . 0.557 ' HA ' HD12 ' A' ' 15' ' ' ILE . 23.1 pt -65.15 -45.46 93.97 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.966 0 C-N-CA 123.3 0.64 . . . . 72.22 111.819 -177.703 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 72.5 mt -68.15 -28.84 42.43 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.918 0 C-N-CA 123.562 0.745 . . . . 51.04 110.479 174.712 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -61.71 -38.75 96.42 Favored Glycine 0 C--N 1.346 1.109 0 CA-C-N 116.046 -0.525 . . . . 62.55 112.822 173.057 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . 0.557 HD12 ' HA ' ' A' ' 12' ' ' ILE . 14.4 mt -70.71 -44.32 76.55 Favored 'Isoleucine or valine' 0 C--N 1.352 0.682 0 C-N-CA 123.064 0.545 . . . . 62.5 109.929 175.387 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.485 ' HG ' ' O ' ' A' ' 12' ' ' ILE . 22.0 mt -58.57 -40.42 83.05 Favored 'General case' 0 N--CA 1.482 1.165 0 O-C-N 123.791 0.682 . . . . 65.32 111.501 179.669 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -72.01 -51.92 19.5 Favored 'General case' 0 N--CA 1.476 0.843 0 C-N-CA 123.053 0.541 . . . . 71.21 110.754 179.171 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -55.09 -30.79 60.43 Favored 'General case' 0 N--CA 1.482 1.152 0 C-N-CA 123.981 0.913 . . . . 72.23 112.879 -179.132 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 2.7 pp -88.26 -34.51 7.19 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.256 0 N-CA-C 112.551 0.575 . . . . 71.13 112.551 174.529 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -65.79 -52.32 51.78 Favored 'General case' 0 N--CA 1.484 1.251 0 C-N-CA 123.074 0.55 . . . . 41.44 112.264 -173.268 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 2.1 mp -54.61 -54.12 52.52 Favored Pre-proline 0 CA--C 1.574 1.894 0 N-CA-C 112.851 0.686 . . . . 63.12 112.851 -174.733 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 36.7 Cg_endo -65.13 -42.25 14.35 Favored 'Trans proline' 0 C--N 1.38 2.221 0 CA-C-N 121.065 1.416 . . . . 74.24 113.115 175.113 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 28.8 tt0 -62.76 -34.41 77.16 Favored 'General case' 0 N--CA 1.486 1.357 0 C-N-CA 123.358 0.663 . . . . 74.14 111.001 -177.859 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 24' ' ' PHE . . . . . . . . . . . . . 84.3 t80 -84.42 -42.06 16.04 Favored 'General case' 0 N--CA 1.484 1.229 0 C-N-CA 123.912 0.885 . . . . 51.15 110.49 -174.137 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 26.4 t -67.16 -28.34 68.04 Favored 'General case' 0 N--CA 1.479 1.004 0 CA-C-N 116.402 -0.363 . . . . 71.35 110.582 175.253 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -79.94 -29.81 39.79 Favored 'General case' 0 C--O 1.214 -0.808 0 C-N-CA 123.109 0.564 . . . . 55.54 111.717 172.737 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 78.7 t80 -71.97 -45.8 59.72 Favored 'General case' 0 N--CA 1.487 1.408 0 C-N-CA 123.89 0.876 . . . . 72.34 111.722 -175.539 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 39.3 ptt180 -68.23 -29.32 68.12 Favored 'General case' 0 N--CA 1.477 0.92 0 CA-C-N 115.181 -0.918 . . . . 52.22 111.309 179.74 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 79.3 t -83.3 -34.89 11.38 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.375 0 CA-C-N 115.699 -0.682 . . . . 73.11 110.136 178.896 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 10.8 tttp -61.25 -42.87 99.37 Favored 'General case' 0 C--O 1.214 -0.769 0 C-N-CA 124.061 0.944 . . . . 51.23 109.783 168.69 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -71.04 -42.46 69.46 Favored 'General case' 0 N--CA 1.476 0.842 0 N-CA-C 109.935 -0.395 . . . . 74.35 109.935 -176.686 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 74.9 t80 -62.53 -62.48 1.71 Allowed 'General case' 0 C--O 1.215 -0.715 0 CA-C-N 115.57 -0.741 . . . . 72.43 110.977 178.828 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 85.4 m-20 -66.95 -44.46 80.51 Favored 'General case' 0 N--CA 1.485 1.275 0 N-CA-C 113.664 0.987 . . . . 73.24 113.664 -174.535 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 47.0 t -68.01 -52.85 30.9 Favored 'General case' 0 N--CA 1.497 1.918 0 CA-C-N 117.636 0.198 . . . . 75.33 111.09 -176.321 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -62.8 -41.36 99.25 Favored 'General case' 0 C--O 1.212 -0.882 0 O-C-N 123.446 0.466 . . . . 41.0 111.27 177.765 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -59.82 -50.44 73.78 Favored 'General case' 0 N--CA 1.498 1.937 0 N-CA-C 112.24 0.459 . . . . 52.14 112.24 178.379 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 66.8 m -63.81 -37.55 87.8 Favored 'General case' 0 N--CA 1.486 1.356 0 C-N-CA 123.331 0.652 . . . . 73.12 111.891 -179.277 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 79.9 p -80.97 -25.52 37.26 Favored 'General case' 0 N--CA 1.482 1.135 0 C-N-CA 122.844 0.458 . . . . 72.14 111.997 -178.626 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 39' ' ' ASP . . . . . 0.438 ' O ' ' HG ' ' A' ' 43' ' ' LEU . 94.6 m-20 -65.69 -52.65 49.75 Favored 'General case' 0 C--O 1.211 -0.958 0 N-CA-C 109.336 -0.616 . . . . 72.34 109.336 167.254 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 98.5 mt -64.37 -29.83 70.89 Favored 'General case' 0 N--CA 1.481 1.11 0 C-N-CA 123.483 0.713 . . . . 75.32 111.63 -176.516 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 47.4 ttp180 -75.29 -43.21 52.34 Favored 'General case' 0 CA--C 1.546 0.809 0 C-N-CA 123.536 0.734 . . . . 73.4 110.663 175.213 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 62.4 t30 -69.68 -34.49 74.03 Favored 'General case' 0 N--CA 1.488 1.471 0 C-N-CA 123.467 0.707 . . . . 54.53 112.221 -179.78 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . 0.438 ' HG ' ' O ' ' A' ' 39' ' ' ASP . 89.8 mt -77.21 -32.01 55.61 Favored 'General case' 0 N--CA 1.478 0.949 0 C-N-CA 123.007 0.523 . . . . 75.22 110.12 179.37 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . 0.415 ' O ' ' HG2' ' A' ' 48' ' ' GLU . 38.8 ttpt -77.55 -36.87 51.82 Favored 'General case' 0 N--CA 1.477 0.885 0 C-N-CA 122.913 0.485 . . . . 53.2 110.602 179.091 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 1.7 t -70.57 -30.93 67.77 Favored 'General case' 0 N--CA 1.485 1.298 0 CA-C-O 121.369 0.604 . . . . 74.31 110.753 179.438 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -66.42 -43.86 84.55 Favored 'General case' 0 N--CA 1.479 1.003 0 CA-C-N 114.86 -1.064 . . . . 64.54 111.101 168.915 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 36.5 tp -63.71 -34.52 78.07 Favored 'General case' 0 CA--C 1.554 1.13 0 C-N-CA 123.648 0.779 . . . . 72.13 111.308 177.132 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . 0.415 ' HG2' ' O ' ' A' ' 44' ' ' LYS . 80.9 mm-40 -67.32 -47.84 69.34 Favored 'General case' 0 N--CA 1.474 0.762 0 C-N-CA 123.582 0.753 . . . . 71.05 110.115 173.356 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 40.5 t -57.63 -44.13 85.33 Favored 'General case' 0 N--CA 1.483 1.215 0 C-N-CA 123.681 0.792 . . . . 60.45 112.852 -176.435 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -72.41 -52.28 16.66 Favored 'General case' 0 N--CA 1.481 1.091 0 C-N-CA 123.407 0.683 . . . . 50.03 112.66 178.863 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 51' ' ' PHE . . . . . . . . . . . . . 41.5 t80 -71.91 -33.63 68.44 Favored 'General case' 0 N--CA 1.486 1.357 0 CA-C-N 115.635 -0.712 . . . . 70.13 111.45 -170.344 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -79.92 -30.13 39.95 Favored 'General case' 0 N--CA 1.482 1.134 0 C-N-CA 123.293 0.637 . . . . 63.33 111.936 178.939 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 19.6 t70 -55.1 -46.23 75.51 Favored 'General case' 0 N--CA 1.488 1.47 0 C-N-CA 123.339 0.655 . . . . 75.1 111.658 177.647 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 23.9 t70 -66.21 -51.05 61.45 Favored 'General case' 0 CA--C 1.554 1.126 0 CA-C-O 121.033 0.444 . . . . 54.32 110.87 178.482 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 29.8 pt20 -89.59 20.22 4.12 Favored 'General case' 0 N--CA 1.488 1.45 0 N-CA-C 113.085 0.772 . . . . 72.1 113.085 -174.571 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 95.1 m -48.1 -42.37 28.81 Favored 'General case' 0 N--CA 1.497 1.916 0 C-N-CA 123.943 0.897 . . . . 75.54 111.721 177.433 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 36.6 p90 -116.32 129.46 25.22 Favored Pre-proline 0 CA--C 1.558 1.264 0 C-N-CA 123.932 0.893 . . . . 73.32 110.036 173.504 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 69.3 Cg_exo -58.02 153.65 43.76 Favored 'Trans proline' 0 CA--C 1.564 2.017 0 C-N-CA 122.796 2.33 . . . . 43.21 112.983 167.043 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 50.8 Cg_exo -57.19 85.94 0.04 OUTLIER 'Trans proline' 0 C--N 1.382 2.324 0 C-N-CA 123.177 2.585 . . . . 74.53 113.938 175.881 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 25.0 tt0 44.68 69.19 0.45 Allowed 'General case' 0 CA--C 1.559 1.291 0 C-N-CA 126.082 1.753 . . . . 75.12 113.197 -178.692 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 66.6 m . . . . . 0 N--CA 1.489 1.492 0 C-N-CA 124.009 0.924 . . . . 63.01 110.048 -178.172 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 1' ' ' PHE . . . . . . . . . . . . . 59.0 m-85 . . . . . 0 N--CA 1.487 1.407 0 N-CA-C 109.929 -0.397 . . . . 74.22 109.929 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 4.7 t -74.17 154.67 38.98 Favored 'General case' 0 N--CA 1.481 1.078 0 CA-C-N 117.702 0.228 . . . . 70.52 110.605 170.082 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 9.3 mp -59.95 -18.97 49.4 Favored 'General case' 0 N--CA 1.481 1.1 0 C-N-CA 123.272 0.629 . . . . 70.15 111.01 176.244 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 50.3 mm -64.07 -49.79 79.91 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.102 0 C-N-CA 123.505 0.722 . . . . 73.54 110.822 174.962 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 40.8 mm-40 -57.95 -47.71 82.1 Favored 'General case' 0 N--CA 1.49 1.544 0 C-N-CA 123.376 0.67 . . . . 45.51 111.512 -179.753 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 46.9 mt -68.88 -32.7 72.55 Favored 'General case' 0 CA--C 1.547 0.853 0 CA-C-N 115.576 -0.738 . . . . 71.12 111.382 -178.108 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 42.3 tp -66.77 -37.15 84.02 Favored 'General case' 0 CA--C 1.549 0.906 0 C-N-CA 123.976 0.911 . . . . 73.2 111.659 173.855 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 96.2 mt -68.95 -50.11 56.97 Favored 'Isoleucine or valine' 0 C--N 1.35 0.606 0 C-N-CA 123.636 0.775 . . . . 71.44 111.245 176.946 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 88.3 t -60.07 -43.03 91.85 Favored 'Isoleucine or valine' 0 CA--C 1.554 1.107 0 C-N-CA 123.119 0.568 . . . . 70.05 111.482 179.345 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 2.7 p -69.24 -31.45 49.87 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.093 0 O-C-N 122.328 -0.233 . . . . 73.32 111.595 177.482 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -68.24 -57.52 5.85 Favored 'General case' 0 C--N 1.363 1.162 0 C-N-CA 123.141 0.576 . . . . 53.32 111.193 179.308 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' ILE . . . . . 0.507 ' O ' ' HG ' ' A' ' 16' ' ' LEU . 21.9 pt -60.33 -46.99 94.18 Favored 'Isoleucine or valine' 0 CA--C 1.554 1.101 0 C-N-CA 123.776 0.83 . . . . 73.12 112.055 -177.943 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 1.7 mp -62.03 -35.48 68.72 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.558 0 C-N-CA 123.721 0.808 . . . . 52.25 110.345 174.887 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -62.07 -39.64 97.88 Favored Glycine 0 C--N 1.352 1.418 0 CA-C-N 115.554 -0.748 . . . . 71.31 113.067 176.241 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . 0.486 HD12 ' HA ' ' A' ' 12' ' ' ILE . 21.7 mt -69.59 -40.49 79.59 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.917 0 C-N-CA 123.507 0.723 . . . . 62.34 111.088 176.686 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.507 ' HG ' ' O ' ' A' ' 12' ' ' ILE . 21.8 mt -57.75 -40.06 78.84 Favored 'General case' 0 N--CA 1.489 1.491 0 C-N-CA 123.207 0.603 . . . . 74.14 111.192 178.647 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -76.84 -49.18 16.38 Favored 'General case' 0 N--CA 1.48 1.026 0 C-N-CA 123.391 0.676 . . . . 65.01 111.478 179.067 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -59.43 -26.18 64.96 Favored 'General case' 0 N--CA 1.483 1.2 0 C-N-CA 124.182 0.993 . . . . 71.14 113.263 -176.485 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 19' ' ' ILE . . . . . 0.417 HD12 ' N ' ' A' ' 20' ' ' ALA . 2.8 pp -87.22 -38.51 12.2 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.382 0 CA-C-N 117.915 0.325 . . . . 74.11 111.741 170.556 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . 0.417 ' N ' HD12 ' A' ' 19' ' ' ILE . . . -65.19 -56.85 10.47 Favored 'General case' 0 N--CA 1.478 0.934 0 C-N-CA 123.568 0.747 . . . . 72.2 112.807 -170.276 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 2.6 mp -58.9 -50.99 85.0 Favored Pre-proline 0 CA--C 1.571 1.777 0 N-CA-C 113.228 0.825 . . . . 71.15 113.228 -173.503 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 37.7 Cg_endo -65.99 -36.51 30.04 Favored 'Trans proline' 0 C--N 1.382 2.338 0 C-N-CA 121.72 1.613 . . . . 63.05 113.354 176.395 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 22.0 tt0 -65.31 -36.88 85.42 Favored 'General case' 0 N--CA 1.489 1.504 0 CA-C-O 121.489 0.661 . . . . 62.22 109.788 178.851 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 24' ' ' PHE . . . . . . . . . . . . . 64.3 t80 -76.04 -39.92 54.56 Favored 'General case' 0 N--CA 1.484 1.261 0 CA-C-N 113.994 -1.457 . . . . 72.24 110.689 -177.951 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 44.4 t -58.3 -52.25 66.38 Favored 'General case' 0 N--CA 1.478 0.947 0 C-N-CA 123.769 0.828 . . . . 75.05 110.582 173.9 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -64.11 -28.56 69.85 Favored 'General case' 0 N--CA 1.484 1.232 0 C-N-CA 123.683 0.793 . . . . 72.23 112.269 176.636 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 47.8 t80 -75.69 -46.01 33.67 Favored 'General case' 0 N--CA 1.484 1.271 0 C-N-CA 123.085 0.554 . . . . 74.13 111.442 -176.503 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 14.3 ptm180 -73.78 -23.69 59.74 Favored 'General case' 0 N--CA 1.474 0.749 0 CA-C-N 115.42 -0.809 . . . . 62.3 111.082 -179.499 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 28.3 t -69.32 -58.79 4.64 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.781 0 N-CA-C 109.389 -0.597 . . . . 52.2 109.389 171.328 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . 0.434 ' O ' ' HB3' ' A' ' 34' ' ' SER . 21.1 ptmt -65.98 -17.24 64.55 Favored 'General case' 0 N--CA 1.486 1.366 0 N-CA-C 112.253 0.464 . . . . 63.52 112.253 -179.223 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -72.95 -46.17 53.96 Favored 'General case' 0 N--CA 1.479 0.99 0 CA-C-O 121.334 0.588 . . . . 73.22 109.696 172.633 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 12.5 t80 -89.36 -9.99 48.31 Favored 'General case' 0 N--CA 1.488 1.447 0 CA-C-N 115.244 -0.889 . . . . 75.02 112.195 -173.59 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 29.6 m-80 -101.5 -58.8 1.81 Allowed 'General case' 0 N--CA 1.47 0.574 0 CA-C-N 115.552 -0.749 . . . . 71.35 110.479 172.93 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . 0.434 ' HB3' ' O ' ' A' ' 30' ' ' LYS . 47.2 t -83.54 -52.03 6.82 Favored 'General case' 0 N--CA 1.496 1.849 0 CA-C-N 116.745 -0.207 . . . . 71.24 111.552 -168.405 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -69.15 -32.28 71.53 Favored 'General case' 0 N--CA 1.486 1.348 0 C-N-CA 122.165 0.186 . . . . 60.31 111.148 179.546 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -72.12 -38.52 69.26 Favored 'General case' 0 N--CA 1.478 0.97 0 C-N-CA 122.745 0.418 . . . . 62.2 111.25 176.028 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 36.4 t -66.11 -32.39 73.82 Favored 'General case' 0 N--CA 1.494 1.773 0 C-N-CA 122.526 0.331 . . . . 53.24 111.443 174.355 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . 0.504 ' HA ' ' HB3' ' A' ' 41' ' ' ARG . 52.7 m -80.37 -23.52 40.44 Favored 'General case' 0 N--CA 1.48 1.062 0 C-N-CA 123.489 0.716 . . . . 74.2 111.323 177.798 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 39' ' ' ASP . . . . . 0.441 ' O ' ' HG ' ' A' ' 43' ' ' LEU . 24.0 t70 -68.79 -46.94 67.39 Favored 'General case' 0 CA--C 1.553 1.072 0 C-N-CA 122.985 0.514 . . . . 74.45 110.597 168.718 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 11.1 mp -69.68 -27.76 65.29 Favored 'General case' 0 N--CA 1.482 1.152 0 C-N-CA 123.378 0.671 . . . . 71.43 111.481 176.634 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 41' ' ' ARG . . . . . 0.504 ' HB3' ' HA ' ' A' ' 38' ' ' SER . 51.5 ttt180 -69.78 -41.02 75.68 Favored 'General case' 0 N--CA 1.478 0.975 0 C-N-CA 123.701 0.8 . . . . 75.35 110.033 171.738 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 52.9 t30 -60.15 -36.04 76.67 Favored 'General case' 0 CA--C 1.554 1.108 0 C-N-CA 123.793 0.837 . . . . 65.24 111.2 175.33 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . 0.441 ' HG ' ' O ' ' A' ' 39' ' ' ASP . 77.4 mt -79.76 -35.76 38.25 Favored 'General case' 0 N--CA 1.478 0.974 0 C-N-CA 123.272 0.629 . . . . 64.21 111.38 178.171 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 22.5 tptm -70.24 -45.31 66.73 Favored 'General case' 0 N--CA 1.481 1.087 0 N-CA-C 109.912 -0.403 . . . . 73.22 109.912 -177.343 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 45' ' ' THR . . . . . 0.496 ' HA ' ' HG2' ' A' ' 48' ' ' GLU . 3.2 t -67.44 -33.63 75.55 Favored 'General case' 0 N--CA 1.473 0.71 0 CA-C-N 114.864 -1.062 . . . . 63.32 111.158 179.622 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -63.39 -52.24 62.48 Favored 'General case' 0 N--CA 1.477 0.882 0 C-N-CA 123.461 0.705 . . . . 73.4 111.356 176.388 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 10.8 mp -67.08 -46.33 74.59 Favored 'General case' 0 N--CA 1.478 0.964 0 C-N-CA 123.01 0.524 . . . . 73.03 112.156 -179.887 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . 0.496 ' HG2' ' HA ' ' A' ' 45' ' ' THR . 11.1 pt-20 -67.51 -33.55 75.32 Favored 'General case' 0 N--CA 1.487 1.398 0 CA-C-N 117.935 0.334 . . . . 72.23 111.22 -176.407 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 48.2 t -74.86 -32.97 62.03 Favored 'General case' 0 N--CA 1.478 0.961 0 C-N-CA 123.242 0.617 . . . . 73.44 111.031 175.951 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -70.63 -44.36 67.33 Favored 'General case' 0 N--CA 1.489 1.512 0 CA-C-O 121.207 0.527 . . . . 72.23 110.722 -178.674 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 51' ' ' PHE . . . . . . . . . . . . . 58.1 m-85 -74.96 -20.98 59.44 Favored 'General case' 0 CA--C 1.549 0.93 0 CA-C-N 115.238 -0.892 . . . . 73.41 111.614 175.703 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -71.01 -40.54 71.74 Favored 'General case' 0 N--CA 1.484 1.27 0 C-N-CA 122.688 0.395 . . . . 64.13 110.497 171.141 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 82.9 m-20 -66.34 -49.82 65.67 Favored 'General case' 0 CA--C 1.547 0.848 0 C-N-CA 123.508 0.723 . . . . 73.41 111.252 175.768 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 38.8 t70 -140.24 146.15 38.26 Favored 'General case' 0 N--CA 1.48 1.057 0 CA-C-O 121.371 0.605 . . . . 61.44 112.47 -171.808 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 20.0 mm-40 -131.94 24.39 4.62 Favored 'General case' 0 N--CA 1.483 1.183 0 C-N-CA 124.521 1.128 . . . . 73.05 111.419 -179.404 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 67.3 p -101.0 75.0 1.64 Allowed 'General case' 0 N--CA 1.495 1.776 0 CA-C-O 122.039 0.924 . . . . 74.0 110.787 178.343 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 94.8 m-85 -129.9 84.4 60.9 Favored Pre-proline 0 N--CA 1.488 1.433 0 C-N-CA 124.056 0.942 . . . . 73.14 109.829 -179.392 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 86.7 Cg_endo -75.3 133.99 16.79 Favored 'Trans proline' 0 C--N 1.38 2.191 0 C-N-CA 122.664 2.243 . . . . 65.42 113.243 -174.617 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 74.8 Cg_endo -75.19 88.94 1.21 Allowed 'Trans proline' 0 C--N 1.382 2.322 0 C-N-CA 122.819 2.346 . . . . 70.24 111.873 177.021 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 33.2 mt-10 -73.58 -45.73 51.53 Favored 'General case' 0 N--CA 1.487 1.419 0 C-N-CA 123.665 0.786 . . . . 75.02 112.7 -172.225 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 58.2 m . . . . . 0 N--CA 1.492 1.648 0 C-N-CA 123.342 0.657 . . . . 53.04 110.56 179.168 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 1' ' ' PHE . . . . . . . . . . . . . 93.4 m-85 . . . . . 0 N--CA 1.486 1.343 0 N-CA-C 110.477 -0.194 . . . . 73.34 110.477 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 57.5 p -73.88 170.79 14.63 Favored 'General case' 0 N--CA 1.487 1.377 0 C-N-CA 123.055 0.542 . . . . 51.24 111.206 173.413 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 9.3 tt -61.07 -23.45 65.48 Favored 'General case' 0 N--CA 1.486 1.369 0 C-N-CA 123.347 0.659 . . . . 73.13 110.32 171.603 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 51.4 mm -83.0 -43.42 18.47 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.692 0 CA-C-N 115.586 -0.734 . . . . 72.25 110.001 -178.542 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 70.7 mm-40 -56.76 -42.83 80.03 Favored 'General case' 0 N--CA 1.483 1.203 0 C-N-CA 123.55 0.74 . . . . 65.12 111.658 173.943 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 2.4 pp -71.19 -37.91 72.13 Favored 'General case' 0 N--CA 1.476 0.869 0 O-C-N 123.31 0.382 . . . . 74.31 110.924 178.651 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -61.48 -46.66 89.1 Favored 'General case' 0 CA--C 1.551 1.011 0 C-N-CA 122.941 0.496 . . . . 74.54 110.765 177.978 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 95.2 mt -67.65 -49.88 66.08 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.721 0 C-N-CA 123.857 0.863 . . . . 70.43 112.341 -177.938 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 7.2 p -60.38 -41.13 86.21 Favored 'Isoleucine or valine' 0 CA--C 1.555 1.137 0 CA-C-N 118.194 0.452 . . . . 52.1 111.852 -177.05 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 74.1 t -68.81 -39.83 80.57 Favored 'Isoleucine or valine' 0 CA--C 1.555 1.16 0 C-N-CA 122.909 0.484 . . . . 72.33 111.307 174.858 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -64.27 -51.57 62.91 Favored 'General case' 0 N--CA 1.487 1.379 0 C-N-CA 122.835 0.454 . . . . 64.23 111.855 -178.733 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 12' ' ' ILE . . . . . 0.549 ' O ' ' HG ' ' A' ' 16' ' ' LEU . 22.9 pt -62.28 -48.14 89.76 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.776 0 C-N-CA 123.533 0.733 . . . . 73.52 111.471 -176.464 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 86.2 mt -63.69 -31.72 54.13 Favored 'Isoleucine or valine' 0 C--N 1.361 1.097 0 C-N-CA 123.306 0.642 . . . . 63.12 110.925 177.99 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -60.92 -40.66 98.68 Favored Glycine 0 C--N 1.35 1.341 0 CA-C-N 115.562 -0.745 . . . . 74.04 112.961 174.134 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . 0.529 HD12 ' HA ' ' A' ' 12' ' ' ILE . 14.5 mt -71.35 -43.78 73.09 Favored 'Isoleucine or valine' 0 C--N 1.355 0.811 0 C-N-CA 123.282 0.633 . . . . 73.11 110.465 177.061 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.549 ' HG ' ' O ' ' A' ' 12' ' ' ILE . 34.5 mt -58.23 -39.62 79.59 Favored 'General case' 0 N--CA 1.486 1.356 0 C-N-CA 123.54 0.736 . . . . 73.22 111.283 -177.578 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -73.49 -48.68 31.49 Favored 'General case' 0 N--CA 1.478 0.97 0 C-N-CA 123.016 0.526 . . . . 74.52 110.913 177.559 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -63.96 -23.9 67.52 Favored 'General case' 0 N--CA 1.482 1.149 0 N-CA-C 113.53 0.937 . . . . 62.14 113.53 -176.756 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 2.8 pp -89.76 -38.26 10.86 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.28 0 CA-C-N 118.213 0.461 . . . . 70.31 111.359 172.362 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -63.6 -47.63 80.67 Favored 'General case' 0 N--CA 1.486 1.373 0 C-N-CA 123.429 0.692 . . . . 65.22 112.789 -175.177 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 27.5 mt -57.43 -54.62 53.03 Favored Pre-proline 0 CA--C 1.563 1.462 0 CA-C-O 118.097 -0.954 . . . . 74.44 113.281 -176.692 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 39.4 Cg_endo -66.13 -37.42 25.41 Favored 'Trans proline' 0 C--N 1.378 2.09 0 CA-C-N 121.504 1.573 . . . . 64.42 113.093 174.149 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 23.8 tt0 -63.34 -37.1 85.95 Favored 'General case' 0 N--CA 1.49 1.573 0 C-N-CA 123.519 0.728 . . . . 71.52 110.802 -177.671 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 24' ' ' PHE . . . . . . . . . . . . . 70.1 t80 -93.8 -36.46 12.25 Favored 'General case' 0 N--CA 1.487 1.407 0 CA-C-N 114.685 -1.143 . . . . 71.54 111.315 -173.055 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . 0.505 ' O ' HG23 ' A' ' 29' ' ' VAL . 39.5 t -59.55 -53.26 60.1 Favored 'General case' 0 N--CA 1.486 1.334 0 N-CA-C 110.05 -0.352 . . . . 61.01 110.05 170.983 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -65.13 -28.15 69.23 Favored 'General case' 0 N--CA 1.488 1.474 0 C-N-CA 123.668 0.787 . . . . 61.35 112.518 176.866 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 84.6 t80 -63.25 -51.07 67.68 Favored 'General case' 0 N--CA 1.487 1.38 0 CA-C-O 120.835 0.35 . . . . 75.41 110.209 172.697 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 57.0 mtp180 -65.82 -24.63 66.95 Favored 'General case' 0 N--CA 1.47 0.571 0 CA-C-N 115.465 -0.789 . . . . 74.23 111.721 179.475 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . 0.505 HG23 ' O ' ' A' ' 25' ' ' SER . 79.6 t -68.98 -56.29 12.52 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.09 0 N-CA-C 109.871 -0.418 . . . . 74.45 109.871 174.341 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 48.4 pttt -67.6 -24.68 65.51 Favored 'General case' 0 CA--C 1.546 0.814 0 CA-C-N 115.491 -0.777 . . . . 73.44 111.545 -176.85 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -81.65 -37.64 27.17 Favored 'General case' 0 N--CA 1.485 1.305 0 CA-C-O 121.313 0.578 . . . . 71.41 110.002 -178.522 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 21.4 t80 -76.94 -16.03 59.49 Favored 'General case' 0 N--CA 1.483 1.178 0 CA-C-N 115.048 -0.978 . . . . 74.4 111.079 -179.85 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 85.6 m-20 -94.89 -50.76 4.98 Favored 'General case' 0 N--CA 1.478 0.95 0 C-N-CA 123.798 0.839 . . . . 71.42 111.857 173.957 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 46.9 t -70.54 -52.8 19.23 Favored 'General case' 0 N--CA 1.501 2.085 0 N-CA-C 111.864 0.32 . . . . 70.33 111.864 -172.16 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -66.44 -29.78 70.0 Favored 'General case' 0 N--CA 1.479 0.99 0 C-N-CA 122.998 0.519 . . . . 54.44 111.706 179.089 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -65.99 -59.02 4.23 Favored 'General case' 0 N--CA 1.482 1.161 0 C-N-CA 122.848 0.459 . . . . 61.35 111.136 174.144 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 66.2 m -53.65 -40.55 65.96 Favored 'General case' 0 N--CA 1.482 1.143 0 C-N-CA 123.846 0.858 . . . . 74.12 111.984 179.174 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 47.7 t -76.0 -38.31 57.5 Favored 'General case' 0 N--CA 1.48 1.072 0 C-N-CA 123.105 0.562 . . . . 74.32 112.446 -176.945 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 38.5 t70 -63.72 -47.02 82.77 Favored 'General case' 0 N--CA 1.483 1.183 0 CA-C-O 121.266 0.555 . . . . 72.44 111.435 176.981 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 70.0 mt -78.66 -32.63 47.26 Favored 'General case' 0 N--CA 1.476 0.849 0 CA-C-N 115.113 -0.948 . . . . 73.33 110.78 -172.658 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 17.3 ttp180 -71.68 -35.28 70.25 Favored 'General case' 0 N--CA 1.479 1.002 0 C-N-CA 122.602 0.361 . . . . 71.13 110.244 174.643 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 28.6 t-20 -61.23 -39.76 91.49 Favored 'General case' 0 N--CA 1.485 1.316 0 C-N-CA 123.232 0.613 . . . . 71.11 111.258 171.903 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 87.2 mt -69.58 -34.12 73.69 Favored 'General case' 0 N--CA 1.48 1.026 0 C-N-CA 122.757 0.423 . . . . 52.0 111.072 177.849 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 55.8 tptt -80.58 -35.41 34.27 Favored 'General case' 0 CA--C 1.548 0.866 0 C-N-CA 123.574 0.749 . . . . 74.43 111.214 -176.636 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 3.2 t -74.35 -38.57 63.2 Favored 'General case' 0 N--CA 1.482 1.129 0 CA-C-O 121.226 0.536 . . . . 62.04 110.389 -178.022 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -71.69 -35.66 70.33 Favored 'General case' 0 N--CA 1.478 0.961 0 CA-C-N 115.193 -0.912 . . . . 61.42 111.21 174.012 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 69.8 tp -57.77 -62.65 1.65 Allowed 'General case' 0 C--N 1.359 1.021 0 O-C-N 123.89 0.744 . . . . 73.52 110.705 175.118 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 33.4 mm-40 -59.89 -32.92 71.18 Favored 'General case' 0 N--CA 1.489 1.502 0 C-N-CA 123.661 0.784 . . . . 71.34 112.583 -173.435 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 25.3 t -61.63 -52.23 65.22 Favored 'General case' 0 CA--C 1.551 1.004 0 CA-C-N 115.439 -0.8 . . . . 70.14 111.18 178.267 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -78.38 -34.1 48.42 Favored 'General case' 0 N--CA 1.486 1.36 0 C-N-CA 123.43 0.692 . . . . 41.45 112.33 -179.018 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 51' ' ' PHE . . . . . . . . . . . . . 75.1 t80 -65.09 -32.94 74.9 Favored 'General case' 0 N--CA 1.488 1.456 0 C-N-CA 125.25 1.42 . . . . 72.44 110.572 -176.146 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -79.22 -35.44 41.62 Favored 'General case' 0 CA--C 1.545 0.767 0 CA-C-N 115.592 -0.731 . . . . 73.22 110.797 176.57 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 32.8 t70 -62.44 -50.94 69.48 Favored 'General case' 0 N--CA 1.481 1.076 0 C-N-CA 123.797 0.839 . . . . 65.31 112.788 -174.817 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 6.7 p-10 -64.82 -33.12 75.23 Favored 'General case' 0 N--CA 1.49 1.525 0 C-N-CA 122.599 0.36 . . . . 74.33 111.845 -177.518 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 76.2 mt-30 -69.19 -45.02 70.97 Favored 'General case' 0 N--CA 1.484 1.245 0 C-N-CA 123.573 0.749 . . . . 73.55 111.345 176.361 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 69.4 p -97.55 76.65 2.54 Favored 'General case' 0 N--CA 1.48 1.053 0 CA-C-O 122.326 1.06 . . . . 72.31 110.157 -179.108 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 47.2 p90 -100.14 153.99 37.46 Favored Pre-proline 0 N--CA 1.485 1.276 0 CA-C-N 114.94 -1.027 . . . . 75.52 111.546 -176.72 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 52.5 Cg_endo -67.03 145.19 72.81 Favored 'Trans proline' 0 C--N 1.379 2.157 0 C-N-CA 122.069 1.846 . . . . 63.44 111.419 171.326 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 24.5 Cg_endo -58.53 102.41 0.14 Allowed 'Trans proline' 0 C--N 1.379 2.178 0 C-N-CA 123.066 2.511 . . . . 62.05 112.98 -178.137 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -66.48 96.42 0.37 Allowed 'General case' 0 CA--C 1.552 1.044 0 C-N-CA 123.42 0.688 . . . . 62.02 110.148 -177.878 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 49.0 m . . . . . 0 CA--C 1.555 1.158 0 C-N-CA 124.028 0.931 . . . . 63.34 110.986 179.617 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 1' ' ' PHE . . . . . . . . . . . . . 93.0 m-85 . . . . . 0 N--CA 1.48 1.064 0 N-CA-C 110.142 -0.318 . . . . 61.13 110.142 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 72.4 p -131.0 154.41 48.2 Favored 'General case' 0 N--CA 1.491 1.598 0 C-N-CA 123.781 0.832 . . . . 74.51 110.851 177.403 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 2.4 pt? -60.72 -21.33 62.83 Favored 'General case' 0 N--CA 1.489 1.494 0 C-N-CA 123.567 0.747 . . . . 75.3 111.348 171.179 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 49.2 mm -69.33 -47.57 72.56 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.087 0 C-N-CA 123.821 0.848 . . . . 73.31 110.316 176.353 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 22.9 mm-40 -59.94 -42.22 93.55 Favored 'General case' 0 N--CA 1.484 1.229 0 C-N-CA 123.441 0.696 . . . . 74.14 111.355 175.41 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 83.4 mt -63.75 -37.34 86.98 Favored 'General case' 0 N--CA 1.487 1.408 0 C-N-CA 123.19 0.596 . . . . 72.44 111.835 176.508 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 6.7 tt -64.51 -43.09 95.16 Favored 'General case' 0 CA--C 1.548 0.883 0 C-N-CA 124.026 0.931 . . . . 63.32 110.108 176.416 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 96.0 mt -67.95 -42.1 85.26 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.943 0 C-N-CA 123.546 0.738 . . . . 74.54 111.762 179.193 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 79.1 t -63.48 -45.72 97.1 Favored 'Isoleucine or valine' 0 CA--C 1.556 1.177 0 C-N-CA 123.325 0.65 . . . . 73.33 111.601 176.764 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 3.1 p -69.36 -26.48 31.58 Favored 'Isoleucine or valine' 0 CA--C 1.56 1.338 0 C-N-CA 122.368 0.267 . . . . 74.22 111.603 177.864 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -73.89 -55.35 6.29 Favored 'General case' 0 N--CA 1.48 1.046 0 C-N-CA 123.242 0.617 . . . . 73.23 111.272 178.673 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 12' ' ' ILE . . . . . 0.535 ' O ' ' HG ' ' A' ' 16' ' ' LEU . 16.3 pt -57.3 -53.28 45.81 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.039 0 C-N-CA 122.943 0.497 . . . . 72.3 111.435 -179.853 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 80.1 mt -66.6 -32.81 59.71 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.967 0 C-N-CA 123.777 0.831 . . . . 71.12 110.869 -179.56 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -60.81 -42.37 99.49 Favored Glycine 0 C--N 1.353 1.481 0 O-C-N 123.628 0.58 . . . . 74.44 113.651 176.796 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 1.8 mp -75.74 -34.93 29.57 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.255 0 C-N-CA 122.856 0.462 . . . . 62.54 110.408 177.249 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.535 ' HG ' ' O ' ' A' ' 12' ' ' ILE . 19.3 mt -62.31 -39.06 91.79 Favored 'General case' 0 N--CA 1.489 1.523 0 C-N-CA 122.377 0.271 . . . . 73.55 111.089 176.409 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -74.28 -39.9 62.66 Favored 'General case' 0 N--CA 1.477 0.888 0 C-N-CA 123.529 0.732 . . . . 71.43 110.944 177.501 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -62.48 -24.06 67.25 Favored 'General case' 0 N--CA 1.483 1.176 0 C-N-CA 123.894 0.878 . . . . 74.3 112.947 178.835 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 2.8 pp -96.85 -37.63 7.25 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.208 0 N-CA-C 111.846 0.313 . . . . 72.54 111.846 171.723 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -67.62 -48.47 66.67 Favored 'General case' 0 N--CA 1.493 1.713 0 N-CA-C 112.891 0.701 . . . . 73.14 112.891 -173.011 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 27.9 mt -58.79 -52.56 73.85 Favored Pre-proline 0 CA--C 1.556 1.199 0 CA-C-O 118.059 -0.972 . . . . 74.21 113.18 -178.565 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 42.9 Cg_endo -67.09 -36.96 20.16 Favored 'Trans proline' 0 C--N 1.378 2.101 0 CA-C-N 121.77 1.668 . . . . 54.44 113.123 174.115 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 28.6 tt0 -66.64 -32.45 73.78 Favored 'General case' 0 N--CA 1.491 1.599 0 C-N-CA 122.854 0.462 . . . . 64.32 110.52 -177.627 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 24' ' ' PHE . . . . . . . . . . . . . 85.5 t80 -90.09 -40.06 12.51 Favored 'General case' 0 N--CA 1.487 1.396 0 CA-C-N 115.366 -0.833 . . . . 63.11 111.406 -178.5 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 34.8 t -56.91 -55.24 37.08 Favored 'General case' 0 N--CA 1.488 1.449 0 C-N-CA 122.849 0.459 . . . . 55.3 110.837 172.645 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -61.89 -26.32 68.08 Favored 'General case' 0 N--CA 1.487 1.399 0 C-N-CA 123.357 0.663 . . . . 74.53 112.571 175.336 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 57.5 t80 -70.81 -51.74 24.89 Favored 'General case' 0 N--CA 1.48 1.052 0 C-N-CA 123.119 0.568 . . . . 72.43 111.104 178.534 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 13.6 ptm180 -70.53 -21.57 62.71 Favored 'General case' 0 N--CA 1.475 0.824 0 C-N-CA 123.184 0.593 . . . . 74.32 111.108 -177.707 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 49.1 t -73.96 -52.79 19.39 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.969 0 CA-C-N 115.989 -0.551 . . . . 64.24 109.884 172.939 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 21.1 ptmt -70.74 -15.92 62.73 Favored 'General case' 0 N--CA 1.489 1.485 0 C-N-CA 122.773 0.429 . . . . 74.43 111.379 179.17 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -76.64 -36.46 57.39 Favored 'General case' 0 N--CA 1.481 1.1 0 CA-C-O 121.547 0.689 . . . . 64.01 109.737 172.964 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 33.4 t80 -83.61 -19.04 36.2 Favored 'General case' 0 N--CA 1.48 1.036 0 CA-C-N 115.133 -0.94 . . . . 74.31 111.87 -179.735 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -92.63 -56.46 3.01 Favored 'General case' 0 N--CA 1.473 0.722 0 CA-C-N 115.556 -0.747 . . . . 75.2 111.069 175.97 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 46.0 t -88.97 -51.71 5.47 Favored 'General case' 0 N--CA 1.497 1.882 0 CA-C-N 116.247 -0.433 . . . . 64.05 111.585 -168.802 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -71.7 -24.8 61.88 Favored 'General case' 0 N--CA 1.484 1.275 0 C-N-CA 122.656 0.382 . . . . 64.43 111.966 -178.148 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -79.43 -37.25 37.5 Favored 'General case' 0 N--CA 1.481 1.1 0 C-N-CA 122.478 0.311 . . . . 71.04 110.805 174.246 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 37.9 t -61.62 -43.47 98.8 Favored 'General case' 0 N--CA 1.494 1.748 0 C-N-CA 123.075 0.55 . . . . 75.15 111.507 173.245 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 80.1 p -75.83 -27.51 57.89 Favored 'General case' 0 N--CA 1.481 1.107 0 C-N-CA 124.127 0.971 . . . . 54.15 111.637 -177.909 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 16.8 t70 -63.08 -48.03 80.35 Favored 'General case' 0 CA--C 1.553 1.071 0 O-C-N 123.419 0.449 . . . . 64.35 110.712 169.159 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 0.471 HD23 HD12 ' A' ' 43' ' ' LEU . 96.2 mt -71.04 -26.94 63.31 Favored 'General case' 0 N--CA 1.484 1.253 0 C-N-CA 123.199 0.6 . . . . 64.44 111.244 179.317 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 27.9 tpt180 -72.22 -37.84 69.09 Favored 'General case' 0 CA--C 1.548 0.883 0 C-N-CA 123.894 0.878 . . . . 64.11 110.136 174.845 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 44.7 t-20 -65.95 -38.89 89.77 Favored 'General case' 0 CA--C 1.56 1.329 0 C-N-CA 124.197 0.999 . . . . 55.35 110.36 174.447 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . 0.471 HD12 HD23 ' A' ' 40' ' ' LEU . 96.0 mt -69.5 -33.08 72.33 Favored 'General case' 0 N--CA 1.482 1.125 0 C-N-CA 123.167 0.587 . . . . 65.01 110.979 175.97 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . 0.451 ' O ' ' HG2' ' A' ' 48' ' ' GLU . 60.7 tttp -73.78 -46.42 45.71 Favored 'General case' 0 N--CA 1.474 0.767 0 CA-C-N 116.102 -0.499 . . . . 65.33 110.51 179.93 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 3.7 t -64.01 -32.27 73.75 Favored 'General case' 0 N--CA 1.487 1.389 0 C-N-CA 123.573 0.749 . . . . 70.3 111.168 -174.58 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -68.88 -43.46 75.28 Favored 'General case' 0 N--CA 1.478 0.945 0 CA-C-N 115.035 -0.984 . . . . 74.3 111.679 171.521 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 9.7 tt -60.7 -39.89 90.21 Favored 'General case' 0 N--CA 1.483 1.179 0 C-N-CA 123.976 0.911 . . . . 70.32 110.609 176.514 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . 0.451 ' HG2' ' O ' ' A' ' 44' ' ' LYS . 60.8 mm-40 -65.31 -47.87 75.06 Favored 'General case' 0 N--CA 1.476 0.85 0 C-N-CA 123.244 0.618 . . . . 74.53 110.499 179.988 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 59.5 m -61.33 -31.92 71.79 Favored 'General case' 0 N--CA 1.483 1.186 0 C-N-CA 123.356 0.663 . . . . 74.45 112.08 179.543 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -78.5 -52.1 9.01 Favored 'General case' 0 N--CA 1.482 1.156 0 C-N-CA 123.205 0.602 . . . . 72.52 111.965 -178.507 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 51' ' ' PHE . . . . . . . . . . . . . 70.6 m-85 -85.68 -13.7 47.73 Favored 'General case' 0 N--CA 1.482 1.138 0 N-CA-C 113.482 0.919 . . . . 55.24 113.482 -170.207 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -79.16 -15.12 58.56 Favored 'General case' 0 N--CA 1.491 1.595 0 N-CA-C 111.774 0.287 . . . . 64.05 111.774 175.036 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 20.0 t70 -117.32 -36.49 3.74 Favored 'General case' 0 N--CA 1.481 1.086 0 C-N-CA 122.574 0.35 . . . . 73.33 111.137 178.832 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 8.6 m-20 -122.77 120.21 32.91 Favored 'General case' 0 N--CA 1.491 1.587 0 CA-C-O 121.7 0.762 . . . . 63.05 112.885 -177.051 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 26.2 mp0 -97.61 12.46 33.48 Favored 'General case' 0 N--CA 1.484 1.243 0 C-N-CA 124.379 1.072 . . . . 71.15 110.073 163.48 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 22.2 m -53.8 -38.51 64.61 Favored 'General case' 0 N--CA 1.492 1.652 0 C-N-CA 125.26 1.424 . . . . 72.3 112.321 -179.671 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 49.9 t80 -108.12 93.59 11.38 Favored Pre-proline 0 CA--C 1.555 1.158 0 C-N-CA 124.237 1.015 . . . . 73.31 108.68 172.057 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 95.3 Cg_endo -84.41 131.52 4.84 Favored 'Trans proline' 0 CA--C 1.565 2.049 0 C-N-CA 121.889 1.726 . . . . 75.14 112.463 175.82 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 87.7 Cg_endo -91.07 110.36 0.33 Allowed 'Trans proline' 0 C--N 1.374 1.884 0 C-N-CA 122.736 2.291 . . . . 54.32 112.241 174.571 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 11.1 pt-20 -75.29 119.37 19.31 Favored 'General case' 0 N--CA 1.482 1.163 0 CA-C-O 121.242 0.544 . . . . 71.41 111.163 179.69 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 35.2 t . . . . . 0 N--CA 1.486 1.354 0 C-N-CA 123.376 0.67 . . . . 75.11 110.849 -177.186 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 1' ' ' PHE . . . . . . . . . . . . . 53.2 m-85 . . . . . 0 N--CA 1.484 1.253 0 N-CA-C 109.741 -0.466 . . . . 74.53 109.741 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 38.8 p -126.32 152.08 46.69 Favored 'General case' 0 N--CA 1.495 1.775 0 C-N-CA 123.384 0.674 . . . . 75.44 111.229 -179.481 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 44.4 mt -67.84 -19.04 65.01 Favored 'General case' 0 N--CA 1.484 1.271 0 C-N-CA 124.112 0.965 . . . . 75.51 111.846 178.64 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 46.6 mm -87.65 -48.96 14.96 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.167 0 CA-C-N 115.437 -0.801 . . . . 74.14 111.083 -175.362 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 9.0 tp10 -54.12 -47.66 71.61 Favored 'General case' 0 N--CA 1.475 0.78 0 C-N-CA 124.046 0.938 . . . . 55.02 110.959 175.941 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 3.0 pp -64.7 -37.08 86.37 Favored 'General case' 0 N--CA 1.48 1.069 0 C-N-CA 122.843 0.457 . . . . 74.34 111.951 -178.539 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 61.2 tp -59.31 -45.66 90.69 Favored 'General case' 0 CA--C 1.547 0.864 0 C-N-CA 123.495 0.718 . . . . 74.2 111.36 175.093 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 94.1 mt -68.4 -39.74 81.26 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.039 0 C-N-CA 124.272 1.029 . . . . 74.31 111.967 178.779 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 48.5 t -60.82 -47.9 91.23 Favored 'Isoleucine or valine' 0 CA--C 1.554 1.13 0 C-N-CA 123.645 0.778 . . . . 73.32 111.454 175.485 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 76.7 t -64.39 -32.16 56.49 Favored 'Isoleucine or valine' 0 CA--C 1.558 1.269 0 C-N-CA 123.323 0.649 . . . . 74.43 111.571 176.086 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -65.73 -57.22 8.54 Favored 'General case' 0 N--CA 1.482 1.156 0 C-N-CA 122.983 0.513 . . . . 72.14 111.584 176.181 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 12' ' ' ILE . . . . . 0.574 ' HA ' HD12 ' A' ' 15' ' ' ILE . 22.5 pt -66.14 -42.39 91.17 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.011 0 C-N-CA 123.548 0.739 . . . . 62.42 112.054 -175.122 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 58.2 mt -65.2 -34.88 73.57 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.13 0 C-N-CA 123.764 0.825 . . . . 71.12 110.57 174.149 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -60.67 -37.33 93.31 Favored Glycine 0 C--N 1.353 1.525 0 CA-C-N 115.674 -0.694 . . . . 42.11 112.67 174.402 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . 0.574 HD12 ' HA ' ' A' ' 12' ' ' ILE . 21.8 mt -71.31 -46.96 62.45 Favored 'Isoleucine or valine' 0 C--N 1.353 0.742 0 C-N-CA 123.577 0.751 . . . . 72.42 110.976 175.872 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.481 ' HG ' ' O ' ' A' ' 12' ' ' ILE . 21.4 mt -56.2 -43.47 78.51 Favored 'General case' 0 N--CA 1.488 1.472 0 C-N-CA 123.378 0.671 . . . . 73.4 111.35 -178.554 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -74.78 -47.53 30.4 Favored 'General case' 0 CA--C 1.544 0.749 0 C-N-CA 123.36 0.664 . . . . 40.3 111.209 -178.078 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -63.91 -23.01 67.18 Favored 'General case' 0 N--CA 1.484 1.253 0 N-CA-C 113.037 0.755 . . . . 70.44 113.037 -177.926 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 2.7 pp -90.3 -38.19 10.58 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.195 0 CA-C-N 118.151 0.432 . . . . 72.34 111.502 171.973 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -63.96 -50.31 69.1 Favored 'General case' 0 N--CA 1.487 1.401 0 C-N-CA 123.549 0.74 . . . . 70.34 112.704 -175.309 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 28.5 mt -55.44 -55.51 39.21 Favored Pre-proline 0 CA--C 1.558 1.271 0 CA-C-O 118.149 -0.929 . . . . 53.35 113.308 -175.621 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 40.4 Cg_endo -66.31 -40.77 13.91 Favored 'Trans proline' 0 C--N 1.379 2.171 0 CA-C-N 121.323 1.508 . . . . 63.12 112.991 175.979 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 21.3 tt0 -62.56 -38.03 88.44 Favored 'General case' 0 N--CA 1.486 1.366 0 C-N-CA 123.273 0.629 . . . . 74.05 111.034 -175.595 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 24' ' ' PHE . . . . . . . . . . . . . 26.7 m-85 -96.28 -32.39 12.44 Favored 'General case' 0 N--CA 1.485 1.316 0 CA-C-N 115.082 -0.963 . . . . 63.15 112.104 -173.348 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 47.0 t -62.96 -55.11 28.72 Favored 'General case' 0 N--CA 1.49 1.567 0 N-CA-C 109.853 -0.425 . . . . 74.11 109.853 171.181 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -62.18 -27.06 68.71 Favored 'General case' 0 N--CA 1.483 1.204 0 C-N-CA 123.913 0.885 . . . . 43.33 112.495 177.749 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 87.9 t80 -65.42 -54.07 33.95 Favored 'General case' 0 N--CA 1.484 1.275 0 C-N-CA 122.745 0.418 . . . . 72.23 110.726 175.053 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 49.8 mtp180 -69.99 -24.3 63.29 Favored 'General case' 0 N--CA 1.481 1.121 0 C-N-CA 123.485 0.714 . . . . 73.21 111.8 -178.578 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 24.7 t -72.48 -46.17 56.72 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.266 0 CA-C-N 116.02 -0.537 . . . . 75.32 110.6 175.471 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 18.8 ptmt -79.02 -16.9 56.23 Favored 'General case' 0 N--CA 1.48 1.029 0 CA-C-N 115.715 -0.675 . . . . 72.31 111.114 178.178 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -81.9 -29.18 32.49 Favored 'General case' 0 N--CA 1.486 1.364 0 C-N-CA 123.233 0.613 . . . . 61.11 110.129 174.013 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 62.5 t80 -62.79 -53.77 49.14 Favored 'General case' 0 C--O 1.21 -1.013 0 N-CA-C 108.945 -0.761 . . . . 72.43 108.945 168.559 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 3.4 m-20 -57.23 -43.24 82.69 Favored 'General case' 0 N--CA 1.487 1.384 0 C-N-CA 123.898 0.879 . . . . 73.41 112.334 175.477 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 35.5 t -62.54 -65.94 0.61 Allowed 'General case' 0 N--CA 1.484 1.258 0 C-N-CA 123.17 0.588 . . . . 74.33 111.11 -179.86 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -65.09 -31.36 72.54 Favored 'General case' 0 N--CA 1.481 1.081 0 N-CA-C 113.016 0.747 . . . . 73.21 113.016 -176.165 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -69.46 -60.57 2.25 Favored 'General case' 0 N--CA 1.492 1.668 0 CA-C-N 117.608 0.186 . . . . 65.14 111.248 177.29 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 48.7 m -66.37 -25.06 66.62 Favored 'General case' 0 N--CA 1.484 1.257 0 C-N-CA 123.023 0.529 . . . . 72.33 112.401 -177.909 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 42.4 t -75.98 -39.26 56.28 Favored 'General case' 0 N--CA 1.491 1.603 0 C-N-CA 123.021 0.528 . . . . 64.03 111.088 176.163 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 28.2 t70 -58.01 -50.73 72.4 Favored 'General case' 0 N--CA 1.481 1.116 0 C-N-CA 123.059 0.544 . . . . 74.13 110.369 170.186 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 95.1 mt -65.01 -38.81 92.15 Favored 'General case' 0 N--CA 1.478 0.943 0 CA-C-N 115.066 -0.97 . . . . 71.44 110.937 -176.155 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 36.4 ttt180 -71.37 -54.49 10.58 Favored 'General case' 0 CA--C 1.542 0.644 0 C-N-CA 123.385 0.674 . . . . 64.22 110.678 -179.134 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 2.8 t-20 -57.55 -41.64 81.37 Favored 'General case' 0 N--CA 1.488 1.473 0 C-N-CA 124.059 0.943 . . . . 70.0 112.348 -175.06 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 98.1 mt -72.44 -47.14 51.35 Favored 'General case' 0 N--CA 1.48 1.069 0 C-N-CA 122.924 0.49 . . . . 70.23 111.083 -179.675 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 36.4 ttpt -67.27 -46.33 73.97 Favored 'General case' 0 N--CA 1.481 1.09 0 C-N-CA 123.525 0.73 . . . . 73.43 110.967 -173.893 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 45' ' ' THR . . . . . 0.519 ' HA ' ' HG2' ' A' ' 48' ' ' GLU . 1.8 t -71.76 -33.86 68.99 Favored 'General case' 0 N--CA 1.472 0.655 0 CA-C-N 115.056 -0.974 . . . . 72.24 111.357 -173.936 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -68.81 -43.06 76.38 Favored 'General case' 0 N--CA 1.475 0.791 0 CA-C-N 115.885 -0.598 . . . . 71.52 110.492 176.513 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 1.8 pp -75.96 -32.99 59.78 Favored 'General case' 0 N--CA 1.481 1.104 0 C-N-CA 122.653 0.381 . . . . 74.4 111.61 -177.073 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . 0.519 ' HG2' ' HA ' ' A' ' 45' ' ' THR . 11.0 pt-20 -78.6 -36.07 44.81 Favored 'General case' 0 N--CA 1.489 1.513 0 CA-C-N 117.756 0.253 . . . . 53.05 111.314 -178.208 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 67.8 m -68.59 -35.0 76.75 Favored 'General case' 0 N--CA 1.485 1.315 0 C-N-CA 123.083 0.553 . . . . 74.53 110.326 173.334 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . 0.48 ' HB1' ' HG3' ' A' ' 55' ' ' GLN . . . -65.83 -42.9 89.99 Favored 'General case' 0 N--CA 1.474 0.739 0 CA-C-N 115.397 -0.819 . . . . 73.52 110.657 172.825 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 51' ' ' PHE . . . . . . . . . . . . . 61.0 t80 -71.31 -26.38 62.83 Favored 'General case' 0 N--CA 1.483 1.182 0 C-N-CA 123.783 0.833 . . . . 74.31 111.468 178.994 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -69.95 -38.31 76.08 Favored 'General case' 0 N--CA 1.485 1.313 0 C-N-CA 123.605 0.762 . . . . 72.45 110.942 178.28 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 16.3 t70 -95.77 -8.5 34.22 Favored 'General case' 0 CA--C 1.56 1.364 0 C-N-CA 123.383 0.673 . . . . 54.31 111.215 177.751 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 14.5 t70 75.97 130.68 0.05 OUTLIER 'General case' 0 CA--C 1.568 1.67 0 C-N-CA 126.463 1.905 . . . . 73.21 110.989 -173.625 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . 0.48 ' HG3' ' HB1' ' A' ' 50' ' ' ALA . 22.1 mp0 -70.68 -1.58 11.79 Favored 'General case' 0 N--CA 1.493 1.678 0 N-CA-C 114.283 1.216 . . . . 62.22 114.283 -171.393 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 93.8 m -65.51 -38.14 88.83 Favored 'General case' 0 N--CA 1.49 1.541 0 CA-C-N 118.282 0.492 . . . . 74.14 110.997 173.69 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 59.1 t80 -91.81 120.62 67.93 Favored Pre-proline 0 CA--C 1.558 1.267 0 C-N-CA 122.561 0.344 . . . . 74.13 110.68 175.718 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 69.1 Cg_endo -85.19 148.39 10.38 Favored 'Trans proline' 0 CA--C 1.567 2.128 0 C-N-CA 122.575 2.183 . . . . 53.54 113.098 169.736 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 43.9 Cg_exo -60.3 154.35 53.26 Favored 'Trans proline' 0 C--N 1.38 2.218 0 C-N-CA 122.971 2.447 . . . . 62.22 112.479 168.673 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 44.0 tt0 -61.09 108.15 0.84 Allowed 'General case' 0 N--CA 1.485 1.289 0 C-N-CA 123.195 0.598 . . . . 74.0 111.98 -176.37 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 36.8 t . . . . . 0 N--CA 1.487 1.414 0 C-N-CA 123.706 0.802 . . . . 72.33 110.27 176.811 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 1' ' ' PHE . . . . . . . . . . . . . 67.5 m-85 . . . . . 0 N--CA 1.486 1.354 0 CA-C-O 121.107 0.48 . . . . 71.41 110.492 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 2' ' ' THR . . . . . 0.595 HG22 ' H ' ' A' ' 4' ' ' ILE . 22.1 m -92.05 141.81 28.21 Favored 'General case' 0 N--CA 1.482 1.165 0 C-N-CA 123.947 0.899 . . . . 73.34 111.3 -179.686 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 2.8 mm? -64.63 -18.16 64.68 Favored 'General case' 0 N--CA 1.49 1.563 0 C-N-CA 123.923 0.889 . . . . 73.43 111.908 178.859 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . 0.595 ' H ' HG22 ' A' ' 2' ' ' THR . 50.6 mm -71.18 -39.68 73.78 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.267 0 C-N-CA 123.599 0.76 . . . . 72.22 110.276 175.223 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 43.3 mt-10 -54.82 -48.26 73.04 Favored 'General case' 0 N--CA 1.485 1.275 0 C-N-CA 123.044 0.538 . . . . 65.23 111.407 175.671 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -60.96 -37.29 81.86 Favored 'General case' 0 N--CA 1.488 1.454 0 O-C-N 123.567 0.542 . . . . 73.5 110.733 -179.311 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 34.0 tp -68.6 -34.06 75.12 Favored 'General case' 0 CA--C 1.551 1.016 0 C-N-CA 123.455 0.702 . . . . 73.3 112.222 179.77 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 89.1 mt -73.62 -45.69 50.25 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.639 0 C-N-CA 123.355 0.662 . . . . 72.05 110.943 175.392 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 73.3 t -62.1 -42.93 96.93 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.868 0 C-N-CA 123.624 0.77 . . . . 51.32 111.618 179.493 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 6.1 p -68.93 -31.45 50.59 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.074 0 O-C-N 122.205 -0.309 . . . . 74.14 111.519 177.321 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -69.07 -53.49 20.07 Favored 'General case' 0 C--N 1.361 1.087 0 C-N-CA 122.775 0.43 . . . . 73.1 111.437 178.661 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 12' ' ' ILE . . . . . 0.587 ' HA ' HD12 ' A' ' 15' ' ' ILE . 29.6 pt -65.17 -45.57 93.58 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.953 0 C-N-CA 123.306 0.643 . . . . 63.25 111.636 -178.346 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 1.7 mp -61.93 -32.89 55.6 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.532 0 C-N-CA 123.717 0.807 . . . . 74.4 110.457 174.253 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -58.91 -40.3 95.11 Favored Glycine 0 C--N 1.355 1.614 0 O-C-N 123.5 0.5 . . . . 53.11 112.618 174.146 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . 0.587 HD12 ' HA ' ' A' ' 12' ' ' ILE . 19.2 mt -72.13 -46.81 57.09 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.748 0 C-N-CA 124.049 0.94 . . . . 71.14 110.902 175.843 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.527 ' HG ' ' O ' ' A' ' 12' ' ' ILE . 25.6 mt -59.74 -37.77 79.89 Favored 'General case' 0 N--CA 1.482 1.137 0 C-N-CA 123.549 0.739 . . . . 63.11 111.6 -176.749 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -75.97 -48.03 22.7 Favored 'General case' 0 N--CA 1.474 0.756 0 C-N-CA 123.103 0.561 . . . . 63.21 110.381 178.344 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -56.92 -26.85 60.09 Favored 'General case' 0 N--CA 1.481 1.087 0 N-CA-C 113.249 0.833 . . . . 70.44 113.249 -179.139 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 2.8 pp -91.18 -38.27 10.37 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.982 0 N-CA-C 111.758 0.281 . . . . 63.13 111.758 172.117 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -64.72 -50.41 67.04 Favored 'General case' 0 N--CA 1.489 1.483 0 N-CA-C 113.204 0.816 . . . . 71.13 113.204 -171.374 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 2.4 mp -63.78 -53.06 53.21 Favored Pre-proline 0 CA--C 1.563 1.451 0 CA-C-O 118.544 -0.741 . . . . 71.22 112.461 -174.035 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 36.7 Cg_endo -63.7 -35.49 57.68 Favored 'Trans proline' 0 C--N 1.38 2.194 0 C-N-CA 121.895 1.73 . . . . 70.03 113.374 175.025 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 29.9 tt0 -66.14 -38.78 88.96 Favored 'General case' 0 N--CA 1.487 1.382 0 C-N-CA 123.034 0.533 . . . . 71.32 110.259 179.899 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 24' ' ' PHE . . . . . . . . . . . . . 79.9 t80 -79.69 -38.79 32.75 Favored 'General case' 0 N--CA 1.487 1.423 0 CA-C-N 114.742 -1.117 . . . . 71.13 110.67 -176.241 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . 0.404 ' O ' HG23 ' A' ' 29' ' ' VAL . 47.8 t -56.44 -59.19 5.33 Favored 'General case' 0 N--CA 1.475 0.798 0 C-N-CA 123.696 0.798 . . . . 75.02 109.244 172.25 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -57.56 -29.31 64.32 Favored 'General case' 0 N--CA 1.48 1.057 0 C-N-CA 124.141 0.976 . . . . 54.1 112.652 177.444 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 64.3 t80 -75.19 -47.92 26.04 Favored 'General case' 0 N--CA 1.483 1.196 0 C-N-CA 123.173 0.589 . . . . 62.32 111.361 -177.145 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 40.6 ptt180 -78.28 -21.38 49.84 Favored 'General case' 0 N--CA 1.48 1.044 0 CA-C-N 115.589 -0.732 . . . . 72.05 110.935 -178.92 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . 0.404 HG23 ' O ' ' A' ' 25' ' ' SER . 42.9 t -72.99 -54.42 15.83 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.027 0 N-CA-C 109.485 -0.561 . . . . 72.33 109.485 172.797 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 14.3 ptmm? -65.29 -20.27 66.33 Favored 'General case' 0 N--CA 1.489 1.519 0 C-N-CA 122.49 0.316 . . . . 64.43 111.235 178.541 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -68.62 -44.86 73.34 Favored 'General case' 0 N--CA 1.476 0.859 0 CA-C-O 121.404 0.621 . . . . 64.23 109.94 170.531 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 30.9 t80 -83.8 -12.02 56.24 Favored 'General case' 0 N--CA 1.481 1.108 0 CA-C-N 114.97 -1.013 . . . . 73.31 112.543 -177.066 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -96.57 -54.11 3.35 Favored 'General case' 0 N--CA 1.478 0.971 0 C-N-CA 123.441 0.696 . . . . 73.34 110.432 176.874 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 46.6 t -77.7 -51.24 10.89 Favored 'General case' 0 N--CA 1.494 1.754 0 CA-C-N 115.98 -0.555 . . . . 72.02 111.658 -171.139 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -68.72 -28.73 67.09 Favored 'General case' 0 N--CA 1.483 1.182 0 C-N-CA 122.602 0.361 . . . . 53.33 111.567 179.647 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -69.98 -42.82 72.62 Favored 'General case' 0 N--CA 1.482 1.14 0 C-N-CA 122.49 0.316 . . . . 62.42 111.024 175.122 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . 0.42 ' O ' ' HG2' ' A' ' 41' ' ' ARG . 71.1 m -59.86 -46.84 88.02 Favored 'General case' 0 N--CA 1.482 1.169 0 C-N-CA 122.807 0.443 . . . . 61.21 110.797 173.406 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 50.6 m -66.69 -31.55 72.29 Favored 'General case' 0 N--CA 1.481 1.113 0 C-N-CA 123.664 0.785 . . . . 72.43 112.031 -178.354 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 28.8 t70 -60.21 -51.03 71.29 Favored 'General case' 0 N--CA 1.477 0.882 0 C-N-CA 123.24 0.616 . . . . 75.44 110.454 171.052 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 85.7 mt -70.89 -30.93 67.42 Favored 'General case' 0 N--CA 1.481 1.119 0 C-N-CA 123.388 0.675 . . . . 51.42 111.585 -175.769 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 41' ' ' ARG . . . . . 0.42 ' HG2' ' O ' ' A' ' 37' ' ' SER . 14.7 mmt180 -78.32 -32.74 49.41 Favored 'General case' 0 N--CA 1.48 1.067 0 CA-C-N 115.777 -0.647 . . . . 72.31 110.408 177.853 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 64.1 t30 -64.93 -38.87 92.4 Favored 'General case' 0 N--CA 1.484 1.248 0 C-N-CA 123.14 0.576 . . . . 74.3 110.432 172.56 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . 0.491 ' O ' HD13 ' A' ' 47' ' ' LEU . 94.3 mt -70.42 -42.69 71.29 Favored 'General case' 0 N--CA 1.479 1.0 0 C-N-CA 123.304 0.641 . . . . 64.14 110.407 178.607 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . 0.483 ' O ' ' HG2' ' A' ' 48' ' ' GLU . 3.7 tppp? -68.84 -51.06 44.55 Favored 'General case' 0 N--CA 1.466 0.353 0 CA-C-N 115.934 -0.576 . . . . 63.13 110.074 -175.487 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 1.7 t -61.84 -33.6 74.46 Favored 'General case' 0 N--CA 1.486 1.328 0 C-N-CA 123.933 0.893 . . . . 60.32 111.786 -178.392 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -63.62 -47.69 80.35 Favored 'General case' 0 N--CA 1.482 1.165 0 C-N-CA 123.757 0.823 . . . . 72.12 111.41 174.926 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 47' ' ' LEU . . . . . 0.491 HD13 ' O ' ' A' ' 43' ' ' LEU . 9.2 mp -65.49 -41.22 93.49 Favored 'General case' 0 CA--C 1.554 1.118 0 CA-C-N 115.51 -0.768 . . . . 75.13 111.791 176.559 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . 0.483 ' HG2' ' O ' ' A' ' 44' ' ' LYS . 11.2 mm-40 -65.48 -41.96 92.73 Favored 'General case' 0 N--CA 1.482 1.161 0 C-N-CA 122.553 0.341 . . . . 75.24 110.839 -178.346 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 68.1 m -69.79 -28.01 65.38 Favored 'General case' 0 N--CA 1.485 1.315 0 C-N-CA 123.191 0.596 . . . . 63.32 112.037 177.725 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -75.66 -53.15 9.02 Favored 'General case' 0 N--CA 1.48 1.036 0 C-N-CA 122.891 0.476 . . . . 72.32 110.765 -178.15 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 51' ' ' PHE . . . . . . . . . . . . . 44.9 m-85 -77.55 -19.7 55.31 Favored 'General case' 0 N--CA 1.482 1.15 0 CA-C-N 115.176 -0.92 . . . . 71.32 112.569 -174.868 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -81.73 -26.66 34.37 Favored 'General case' 0 N--CA 1.489 1.516 0 C-N-CA 122.668 0.387 . . . . 63.13 111.654 176.223 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 4.5 t70 -85.43 -52.42 5.87 Favored 'General case' 0 CA--C 1.549 0.94 0 CA-C-O 121.268 0.556 . . . . 75.2 109.643 177.826 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 16.6 m-20 -135.49 102.94 5.29 Favored 'General case' 0 N--CA 1.48 1.056 0 C-N-CA 124.916 1.286 . . . . 71.35 109.575 177.176 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 6.6 tp-100 -69.04 -20.36 64.12 Favored 'General case' 0 CA--C 1.559 1.299 0 CA-C-O 121.283 0.563 . . . . 71.52 110.853 173.939 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 82.5 p -72.61 -29.37 63.43 Favored 'General case' 0 N--CA 1.482 1.129 0 C-N-CA 124.33 1.052 . . . . 74.21 112.55 174.9 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 17.9 m-85 -93.16 151.47 40.47 Favored Pre-proline 0 N--CA 1.489 1.504 0 C-N-CA 123.232 0.613 . . . . 75.41 112.648 -176.169 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 51.3 Cg_endo -80.95 174.64 10.72 Favored 'Trans proline' 0 C--N 1.384 2.441 0 C-N-CA 123.459 2.773 . . . . 62.42 112.224 173.976 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 74.4 Cg_endo -73.04 164.24 36.06 Favored 'Trans proline' 0 C--N 1.382 2.296 0 C-N-CA 121.924 1.749 . . . . 73.22 112.95 173.694 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 37.3 mt-10 -74.7 -27.4 60.37 Favored 'General case' 0 N--CA 1.488 1.468 0 C-N-CA 123.456 0.702 . . . . 74.04 111.681 -177.584 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 70.6 p . . . . . 0 C--O 1.251 1.166 0 C-N-CA 124.065 0.946 . . . . 38.18 110.203 179.879 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 1' ' ' PHE . . . . . . . . . . . . . 74.8 t80 . . . . . 0 N--CA 1.491 1.603 0 N-CA-C 111.533 0.197 . . . . 53.23 111.533 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 66.2 p -57.49 149.63 20.6 Favored 'General case' 0 N--CA 1.494 1.751 0 N-CA-C 112.066 0.395 . . . . 72.24 112.066 -179.173 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . 0.403 HD23 HD12 ' A' ' 6' ' ' LEU . 63.0 mt -57.33 -23.41 48.64 Favored 'General case' 0 N--CA 1.487 1.396 0 C-N-CA 123.828 0.851 . . . . 64.1 111.54 174.285 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 50.7 mm -66.79 -53.29 36.08 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.873 0 CA-C-N 115.155 -0.929 . . . . 72.33 110.339 172.83 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 48.2 mm-40 -64.45 -31.76 73.11 Favored 'General case' 0 N--CA 1.485 1.318 0 C-N-CA 123.546 0.738 . . . . 65.42 112.366 179.654 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . 0.403 HD12 HD23 ' A' ' 3' ' ' LEU . 92.9 mt -66.59 -45.33 79.57 Favored 'General case' 0 N--CA 1.481 1.085 0 C-N-CA 123.242 0.617 . . . . 43.43 110.923 173.935 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 40.9 tp -58.85 -43.28 90.75 Favored 'General case' 0 CA--C 1.551 1.004 0 C-N-CA 123.411 0.685 . . . . 72.11 111.488 175.378 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 96.6 mt -67.99 -47.36 79.26 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.866 0 C-N-CA 124.227 1.011 . . . . 71.34 112.927 179.626 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 8.3 p -64.67 -40.24 88.39 Favored 'Isoleucine or valine' 0 C--N 1.357 0.901 0 CA-C-N 118.44 0.563 . . . . 35.32 111.481 -177.812 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 76.6 t -66.67 -39.14 83.07 Favored 'Isoleucine or valine' 0 CA--C 1.555 1.141 0 C-N-CA 123.13 0.572 . . . . 73.11 111.026 173.827 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -64.91 -47.42 77.84 Favored 'General case' 0 N--CA 1.482 1.133 0 C-N-CA 122.941 0.497 . . . . 74.2 111.853 -179.84 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 12' ' ' ILE . . . . . 0.618 ' HA ' HD12 ' A' ' 15' ' ' ILE . 2.7 pp -68.89 -40.16 80.81 Favored 'Isoleucine or valine' 0 C--N 1.355 0.81 0 CA-C-O 119.042 -0.504 . . . . 72.32 111.416 -177.261 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 58.5 mt -60.92 -33.32 55.11 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.253 0 C-N-CA 123.564 0.746 . . . . 75.32 110.95 173.289 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -59.87 -43.44 98.01 Favored Glycine 0 C--N 1.352 1.444 0 CA-C-N 115.882 -0.599 . . . . 74.43 112.548 173.111 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . 0.618 HD12 ' HA ' ' A' ' 12' ' ' ILE . 18.7 mt -70.33 -43.94 77.97 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.738 0 C-N-CA 123.528 0.731 . . . . 74.02 111.066 178.455 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.513 ' HG ' ' O ' ' A' ' 12' ' ' ILE . 23.8 mt -57.62 -41.67 81.8 Favored 'General case' 0 N--CA 1.483 1.18 0 C-N-CA 123.346 0.658 . . . . 64.44 111.121 -177.996 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -70.72 -51.16 29.22 Favored 'General case' 0 N--CA 1.474 0.757 0 CA-C-O 121.239 0.543 . . . . 60.33 110.8 178.592 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -61.35 -21.59 64.15 Favored 'General case' 0 CA--C 1.55 0.979 0 N-CA-C 113.372 0.878 . . . . 73.22 113.372 -177.266 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 2.7 pp -94.2 -39.18 10.19 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.09 0 CA-C-N 118.004 0.366 . . . . 72.01 111.782 172.387 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -69.56 -52.78 23.03 Favored 'General case' 0 N--CA 1.485 1.295 0 N-CA-C 112.42 0.526 . . . . 62.51 112.42 -171.415 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 2.4 mp -54.51 -54.97 42.72 Favored Pre-proline 0 CA--C 1.568 1.641 0 CA-C-O 118.119 -0.943 . . . . 73.12 112.272 -176.722 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 29.0 Cg_endo -63.2 -42.75 21.44 Favored 'Trans proline' 0 C--N 1.381 2.282 0 C-N-CA 121.963 1.775 . . . . 74.15 113.64 176.823 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 6.3 tt0 -62.76 -42.29 99.61 Favored 'General case' 0 N--CA 1.486 1.366 0 C-N-CA 124.061 0.944 . . . . 75.51 110.996 -175.333 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 24' ' ' PHE . . . . . . . . . . . . . 44.4 m-85 -90.62 -25.68 20.02 Favored 'General case' 0 N--CA 1.482 1.128 0 CA-C-N 114.27 -1.332 . . . . 72.33 111.136 -174.764 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 43.9 t -63.62 -59.23 4.87 Favored 'General case' 0 N--CA 1.48 1.04 0 N-CA-C 108.644 -0.872 . . . . 52.45 108.644 170.069 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -55.84 -32.65 63.81 Favored 'General case' 0 N--CA 1.479 1.019 0 C-N-CA 123.841 0.856 . . . . 72.13 112.971 177.222 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 19.6 t80 -72.74 -49.6 30.02 Favored 'General case' 0 N--CA 1.486 1.353 0 C-N-CA 123.168 0.587 . . . . 62.43 111.822 -179.6 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 70.4 mtp180 -81.36 -16.19 53.05 Favored 'General case' 0 N--CA 1.48 1.072 0 C-N-CA 123.286 0.635 . . . . 62.54 111.62 -177.076 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 73.5 t -90.17 -32.43 5.52 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.635 0 C-N-CA 122.651 0.381 . . . . 74.42 110.828 175.365 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 19.3 ptmt -74.14 -23.83 59.33 Favored 'General case' 0 N--CA 1.488 1.464 0 N-CA-C 109.279 -0.637 . . . . 72.43 109.279 170.121 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -72.74 -36.56 67.77 Favored 'General case' 0 C--N 1.359 0.988 0 C-N-CA 122.778 0.431 . . . . 63.15 110.094 171.887 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 83.1 t80 -60.02 -56.41 22.05 Favored 'General case' 0 N--CA 1.478 0.926 0 CA-C-N 115.688 -0.687 . . . . 64.2 110.02 171.71 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 5.4 m-20 -55.49 -53.71 52.92 Favored 'General case' 0 N--CA 1.48 1.057 0 C-N-CA 124.505 1.122 . . . . 71.11 112.683 177.985 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 32.1 t -66.87 -52.33 44.8 Favored 'General case' 0 N--CA 1.492 1.63 0 C-N-CA 122.92 0.488 . . . . 62.22 111.811 -173.821 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -64.0 -42.51 97.14 Favored 'General case' 0 N--CA 1.475 0.82 0 CA-C-O 119.094 -0.479 . . . . 62.32 111.832 179.347 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -66.33 -48.38 70.45 Favored 'General case' 0 N--CA 1.495 1.825 0 N-CA-C 111.942 0.349 . . . . 64.04 111.942 -177.931 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . 0.494 ' O ' ' HG2' ' A' ' 41' ' ' ARG . 70.9 m -63.38 -49.44 73.81 Favored 'General case' 0 N--CA 1.483 1.183 0 C-N-CA 123.284 0.634 . . . . 74.32 111.612 179.689 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 47.1 t -72.78 -26.63 61.6 Favored 'General case' 0 N--CA 1.486 1.365 0 N-CA-C 112.337 0.495 . . . . 63.12 112.337 -177.678 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 27.6 t70 -62.52 -49.79 73.94 Favored 'General case' 0 N--CA 1.482 1.131 0 C-N-CA 122.758 0.423 . . . . 64.02 111.206 171.514 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 0.417 ' HG ' ' O ' ' A' ' 37' ' ' SER . 4.0 pp -72.34 -21.92 61.25 Favored 'General case' 0 N--CA 1.488 1.44 0 CA-C-O 120.758 0.314 . . . . 72.31 111.315 -175.274 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 41' ' ' ARG . . . . . 0.494 ' HG2' ' O ' ' A' ' 37' ' ' SER . 27.1 mmt180 -80.1 -39.72 29.01 Favored 'General case' 0 N--CA 1.485 1.281 0 C-N-CA 123.13 0.572 . . . . 75.51 110.758 171.95 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 42' ' ' ASN . . . . . 0.411 ' O ' HG22 ' A' ' 45' ' ' THR . 61.1 t30 -68.02 -40.77 82.88 Favored 'General case' 0 N--CA 1.488 1.464 0 C-N-CA 123.534 0.734 . . . . 74.11 112.408 -178.095 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 4.3 pp -72.89 -29.87 63.49 Favored 'General case' 0 N--CA 1.485 1.318 0 O-C-N 122.083 -0.386 . . . . 52.54 110.727 177.025 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . 0.653 ' HE2' ' HB2' ' A' ' 57' ' ' TYR . 44.5 tttm -67.86 -40.22 83.68 Favored 'General case' 0 N--CA 1.471 0.612 0 C-N-CA 123.517 0.727 . . . . 64.42 109.81 174.708 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 45' ' ' THR . . . . . 0.54 ' HA ' ' HG2' ' A' ' 48' ' ' GLU . 0.9 OUTLIER -77.97 -31.49 50.82 Favored 'General case' 0 N--CA 1.483 1.18 0 CA-C-N 115.414 -0.812 . . . . 70.11 111.258 -171.501 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -63.57 -46.77 84.36 Favored 'General case' 0 CA--C 1.547 0.836 0 C-N-CA 123.986 0.914 . . . . 51.35 110.888 171.306 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 87.2 mt -67.83 -43.6 79.18 Favored 'General case' 0 N--CA 1.481 1.123 0 C-N-CA 123.729 0.811 . . . . 73.31 112.581 179.354 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . 0.54 ' HG2' ' HA ' ' A' ' 45' ' ' THR . 11.3 pt-20 -71.95 -26.74 62.4 Favored 'General case' 0 N--CA 1.483 1.207 0 O-C-N 122.153 -0.342 . . . . 43.13 111.395 -176.246 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 57.1 m -73.05 -30.0 63.39 Favored 'General case' 0 N--CA 1.49 1.559 0 C-N-CA 122.954 0.501 . . . . 73.5 111.209 169.823 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -76.52 -27.7 56.1 Favored 'General case' 0 N--CA 1.482 1.17 0 C-N-CA 124.151 0.981 . . . . 55.15 112.428 -176.41 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 51' ' ' PHE . . . . . . . . . . . . . 96.5 m-85 -107.69 -16.37 14.35 Favored 'General case' 0 N--CA 1.483 1.211 0 C-N-CA 123.965 0.906 . . . . 74.34 111.04 177.711 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . 71.29 -18.89 0.26 Allowed 'General case' 0 N--CA 1.5 2.054 0 C-N-CA 125.498 1.519 . . . . 73.43 115.079 177.454 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 32.7 t70 -95.97 -26.4 15.58 Favored 'General case' 0 CA--C 1.558 1.253 0 C-N-CA 123.71 0.804 . . . . 73.24 112.385 -172.323 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 24.3 t0 61.38 78.56 0.28 Allowed 'General case' 0 N--CA 1.486 1.35 0 C-N-CA 124.503 1.121 . . . . 73.54 112.329 -172.304 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 1.1 pm0 -109.0 10.87 26.15 Favored 'General case' 0 N--CA 1.484 1.241 0 CA-C-N 114.912 -1.04 . . . . 75.14 110.178 170.838 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 69.0 p -69.05 -60.31 2.44 Favored 'General case' 0 N--CA 1.482 1.159 0 C-N-CA 123.267 0.627 . . . . 74.52 110.026 177.464 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 57' ' ' TYR . . . . . 0.653 ' HB2' ' HE2' ' A' ' 44' ' ' LYS . 74.0 m-85 -144.06 104.41 4.81 Favored Pre-proline 0 CA--C 1.547 0.856 0 C-N-CA 125.127 1.371 . . . . 71.22 107.454 170.967 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 62.8 Cg_exo -43.29 140.85 3.51 Favored 'Trans proline' 0 C--N 1.385 2.477 0 C-N-CA 123.94 3.094 . . . . 74.32 113.701 176.161 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 19.8 Cg_exo -32.97 92.34 0.01 OUTLIER 'Trans proline' 0 C--N 1.395 3.015 1 C-N-CA 125.439 4.093 . . . . 61.53 116.14 -174.097 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 38.0 tt0 -72.81 -55.78 6.2 Favored 'General case' 0 CA--C 1.548 0.872 0 C-N-CA 124.005 0.922 . . . . 75.23 110.466 178.717 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 53.0 p . . . . . 0 CA--C 1.562 1.419 0 C-N-CA 124.431 1.092 . . . . 74.43 110.909 -179.907 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 1' ' ' PHE . . . . . . . . . . . . . 33.9 p90 . . . . . 0 N--CA 1.485 1.305 0 N-CA-C 111.863 0.32 . . . . 71.24 111.863 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 2' ' ' THR . . . . . 0.603 HG22 ' H ' ' A' ' 4' ' ' ILE . 16.6 m -62.97 145.48 55.26 Favored 'General case' 0 N--CA 1.487 1.385 0 C-N-CA 124.076 0.95 . . . . 73.43 112.462 -174.085 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 49.7 tp -57.5 -26.51 61.41 Favored 'General case' 0 N--CA 1.483 1.179 0 C-N-CA 124.124 0.97 . . . . 71.54 111.808 175.649 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . 0.603 ' H ' HG22 ' A' ' 2' ' ' THR . 52.1 mm -67.37 -41.97 86.91 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.148 0 CA-C-N 115.959 -0.564 . . . . 75.32 110.717 175.622 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . 0.409 ' HA ' HD12 ' A' ' 8' ' ' ILE . 44.3 mt-10 -64.68 -36.35 84.0 Favored 'General case' 0 N--CA 1.488 1.461 0 C-N-CA 123.543 0.737 . . . . 64.13 111.123 175.854 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . 0.448 ' HA ' HG12 ' A' ' 9' ' ' VAL . 77.2 mt -69.11 -33.49 73.57 Favored 'General case' 0 N--CA 1.476 0.83 0 CA-C-N 115.524 -0.762 . . . . 74.22 111.296 174.289 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 26.9 tp -69.55 -33.35 72.64 Favored 'General case' 0 CA--C 1.56 1.327 0 C-N-CA 123.156 0.582 . . . . 74.42 111.346 174.522 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . 0.439 HG13 ' O ' ' A' ' 4' ' ' ILE . 77.8 mt -68.68 -49.39 65.0 Favored 'Isoleucine or valine' 0 C--N 1.363 1.178 0 C-N-CA 123.399 0.68 . . . . 71.15 111.412 175.935 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . 0.448 HG12 ' HA ' ' A' ' 6' ' ' LEU . 8.6 p -63.31 -38.1 81.23 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.972 0 C-N-CA 122.787 0.435 . . . . 61.12 111.852 -179.33 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 44.4 t -66.9 -36.57 77.49 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.064 0 C-N-CA 123.155 0.582 . . . . 75.21 111.889 172.418 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -66.94 -56.42 10.29 Favored 'General case' 0 N--CA 1.485 1.286 0 N-CA-C 111.821 0.304 . . . . 74.44 111.821 178.284 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 12' ' ' ILE . . . . . 0.526 ' O ' ' HG ' ' A' ' 16' ' ' LEU . 28.8 pt -59.9 -50.82 78.65 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.913 0 C-N-CA 122.992 0.517 . . . . 61.42 111.83 -175.473 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 81.4 mt -69.73 -31.12 47.33 Favored 'Isoleucine or valine' 0 C--N 1.36 1.064 0 C-N-CA 123.589 0.756 . . . . 63.23 110.092 -179.233 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -61.28 -34.27 87.56 Favored Glycine 0 C--N 1.349 1.284 0 CA-C-N 115.894 -0.594 . . . . 73.02 113.533 174.335 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 1.7 mp -79.85 -44.61 23.05 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.99 0 C-N-CA 122.934 0.494 . . . . 61.33 110.085 175.484 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.526 ' HG ' ' O ' ' A' ' 12' ' ' ILE . 31.9 mt -54.52 -42.64 71.06 Favored 'General case' 0 N--CA 1.488 1.43 0 C-N-CA 123.13 0.572 . . . . 74.14 111.324 -179.463 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -77.06 -48.73 17.03 Favored 'General case' 0 CA--C 1.55 0.969 0 C-N-CA 123.356 0.662 . . . . 75.42 111.378 179.337 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -55.78 -27.19 49.79 Favored 'General case' 0 N--CA 1.493 1.711 0 N-CA-C 113.182 0.808 . . . . 44.4 113.182 -178.863 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 2.8 pp -90.54 -35.85 7.71 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.105 0 N-CA-C 112.067 0.395 . . . . 71.5 112.067 173.097 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -67.63 -45.71 74.58 Favored 'General case' 0 N--CA 1.484 1.228 0 C-N-CA 123.224 0.609 . . . . 50.51 111.972 -172.639 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 1.9 mp -59.4 -52.98 70.46 Favored Pre-proline 0 CA--C 1.571 1.766 0 CA-C-O 118.486 -0.768 . . . . 60.4 112.478 -177.141 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 40.1 Cg_endo -66.66 -36.4 25.19 Favored 'Trans proline' 0 C--N 1.381 2.27 0 C-N-CA 121.911 1.74 . . . . 71.23 113.498 173.356 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 28.8 tt0 -66.58 -30.93 71.34 Favored 'General case' 0 N--CA 1.495 1.815 0 C-N-CA 123.133 0.573 . . . . 71.03 111.16 -178.096 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 24' ' ' PHE . . . . . . . . . . . . . 75.1 t80 -91.15 -40.13 11.75 Favored 'General case' 0 N--CA 1.489 1.482 0 CA-C-N 115.179 -0.919 . . . . 65.44 110.782 -176.6 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . 0.442 ' O ' HG23 ' A' ' 29' ' ' VAL . 48.2 t -60.41 -55.47 33.15 Favored 'General case' 0 N--CA 1.479 1.003 0 C-N-CA 123.204 0.602 . . . . 64.45 110.051 174.669 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -64.7 -22.64 67.03 Favored 'General case' 0 N--CA 1.483 1.21 0 C-N-CA 123.74 0.816 . . . . 74.34 112.525 177.252 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 80.4 t80 -66.95 -47.59 71.17 Favored 'General case' 0 N--CA 1.48 1.063 0 CA-C-O 121.088 0.471 . . . . 64.25 110.206 172.92 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 19.9 mtp180 -72.41 -23.1 61.04 Favored 'General case' 0 N--CA 1.474 0.759 0 CA-C-N 115.196 -0.911 . . . . 65.0 111.173 179.806 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . 0.442 HG23 ' O ' ' A' ' 25' ' ' SER . 68.7 t -69.59 -50.79 47.43 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.184 0 N-CA-C 109.909 -0.404 . . . . 63.15 109.909 173.791 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . 0.469 ' HA ' ' HB3' ' A' ' 33' ' ' ASN . 14.7 ptmm? -75.71 -13.96 60.33 Favored 'General case' 0 N--CA 1.484 1.246 0 C-N-CA 122.862 0.465 . . . . 71.44 111.782 178.836 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -74.14 -40.69 62.45 Favored 'General case' 0 N--CA 1.481 1.088 0 CA-C-O 121.647 0.737 . . . . 65.11 109.593 172.393 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 32' ' ' TYR . . . . . 0.444 ' O ' ' HB3' ' A' ' 36' ' ' ALA . 36.2 t80 -85.77 -18.83 31.88 Favored 'General case' 0 N--CA 1.48 1.034 0 CA-C-N 115.068 -0.969 . . . . 73.31 111.582 -179.29 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . 0.469 ' HB3' ' HA ' ' A' ' 30' ' ' LYS . 27.8 t-20 -84.6 -63.24 1.37 Allowed 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 115.585 -0.734 . . . . 63.33 109.971 174.965 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 20.3 m -80.45 -51.46 8.79 Favored 'General case' 0 N--CA 1.487 1.409 0 CA-C-N 115.258 -0.883 . . . . 70.35 111.379 -166.539 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -70.21 -38.64 75.34 Favored 'General case' 0 N--CA 1.481 1.097 0 N-CA-C 111.613 0.227 . . . . 63.15 111.613 -178.281 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . 0.444 ' HB3' ' O ' ' A' ' 32' ' ' TYR . . . -69.82 -41.11 75.42 Favored 'General case' 0 N--CA 1.482 1.17 0 N-CA-C 111.425 0.157 . . . . 71.25 111.425 -179.07 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 68.0 m -67.38 -28.76 68.2 Favored 'General case' 0 N--CA 1.487 1.377 0 C-N-CA 122.45 0.3 . . . . 72.12 111.807 172.776 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 43.0 t -72.14 -37.88 69.34 Favored 'General case' 0 N--CA 1.484 1.256 0 C-N-CA 122.69 0.396 . . . . 44.34 111.128 176.399 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 33.1 m-20 -62.85 -49.05 76.42 Favored 'General case' 0 CA--C 1.544 0.72 0 C-N-CA 123.253 0.621 . . . . 75.24 111.084 170.013 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 73.5 mt -66.56 -32.69 74.2 Favored 'General case' 0 N--CA 1.487 1.405 0 C-N-CA 122.473 0.309 . . . . 62.53 111.066 -176.139 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 33.7 ttm180 -73.08 -47.68 42.42 Favored 'General case' 0 CA--C 1.537 0.444 0 C-N-CA 123.353 0.661 . . . . 74.1 110.016 177.871 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 66.2 t30 -62.71 -33.51 75.27 Favored 'General case' 0 N--CA 1.484 1.271 0 CA-C-N 115.436 -0.802 . . . . 63.5 112.162 179.748 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 91.7 mt -79.57 -37.8 35.56 Favored 'General case' 0 N--CA 1.481 1.1 0 C-N-CA 123.0 0.52 . . . . 72.21 110.717 179.938 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . 0.463 ' O ' ' HG2' ' A' ' 48' ' ' GLU . 0.8 OUTLIER -74.31 -43.54 56.33 Favored 'General case' 0 N--CA 1.476 0.845 0 N-CA-C 109.645 -0.502 . . . . 63.43 109.645 -176.077 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 3.0 t -65.82 -31.12 71.91 Favored 'General case' 0 N--CA 1.483 1.201 0 C-N-CA 123.428 0.691 . . . . 60.35 110.916 178.141 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -69.36 -31.92 70.65 Favored 'General case' 0 N--CA 1.479 1.001 0 CA-C-N 115.209 -0.905 . . . . 72.32 111.477 173.605 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 97.9 mt -67.45 -50.35 59.58 Favored 'General case' 0 N--CA 1.483 1.212 0 C-N-CA 122.768 0.427 . . . . 65.12 110.779 170.842 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . 0.463 ' HG2' ' O ' ' A' ' 44' ' ' LYS . 5.7 mm-40 -60.76 -35.05 75.44 Favored 'General case' 0 N--CA 1.493 1.702 0 C-N-CA 122.954 0.502 . . . . 73.25 110.797 -179.438 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 37.9 t -67.41 -58.77 4.16 Favored 'General case' 0 CA--C 1.54 0.583 0 CA-C-N 115.457 -0.792 . . . . 44.53 110.499 175.272 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . 0.472 ' O ' ' HB3' ' A' ' 54' ' ' ASP . . . -60.85 -38.13 84.46 Favored 'General case' 0 N--CA 1.487 1.415 0 C-N-CA 123.813 0.845 . . . . 74.1 112.17 -172.03 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 51' ' ' PHE . . . . . . . . . . . . . 2.7 m-85 -70.76 -35.64 72.72 Favored 'General case' 0 CA--C 1.542 0.65 0 CA-C-N 115.061 -0.972 . . . . 73.32 110.366 178.968 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -76.16 -51.8 11.39 Favored 'General case' 0 N--CA 1.48 1.053 0 N-CA-C 111.929 0.344 . . . . 55.1 111.929 -175.692 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 2.6 p30 -82.27 -38.07 24.96 Favored 'General case' 0 N--CA 1.482 1.137 0 N-CA-C 113.052 0.76 . . . . 54.41 113.052 -171.753 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . 0.472 ' HB3' ' O ' ' A' ' 50' ' ' ALA . 19.3 t70 -78.69 -74.04 0.3 Allowed 'General case' 0 N--CA 1.484 1.236 0 C-N-CA 122.911 0.484 . . . . 51.03 111.043 -178.397 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 23.5 pt20 -85.26 4.36 35.2 Favored 'General case' 0 N--CA 1.494 1.73 0 N-CA-C 113.291 0.849 . . . . 73.12 113.291 -174.302 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 6.7 m 65.37 28.21 11.78 Favored 'General case' 0 N--CA 1.494 1.742 0 C-N-CA 124.296 1.038 . . . . 74.1 112.158 171.52 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 44.8 t80 -103.18 92.39 3.76 Favored Pre-proline 0 N--CA 1.491 1.594 0 C-N-CA 123.975 0.91 . . . . 71.21 110.625 171.286 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 58' ' ' PRO . . . . . 0.46 ' HA ' ' HD3' ' A' ' 59' ' ' PRO . 81.3 Cg_endo -84.6 139.35 7.7 Favored 'Trans proline' 0 CA--C 1.563 1.926 0 C-N-CA 122.398 2.065 . . . . 64.31 112.519 174.341 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 59' ' ' PRO . . . . . 0.46 ' HD3' ' HA ' ' A' ' 58' ' ' PRO . 20.2 Cg_exo -65.37 94.45 0.25 Allowed 'Trans proline' 0 C--N 1.377 2.029 0 C-N-CA 122.969 2.446 . . . . 72.33 112.648 179.224 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 43.6 mt-10 55.46 28.38 11.57 Favored 'General case' 0 N--CA 1.494 1.759 0 C-N-CA 124.6 1.16 . . . . 75.35 113.738 176.721 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 33.9 t . . . . . 0 N--CA 1.494 1.727 0 C-N-CA 123.137 0.575 . . . . 71.23 111.566 -174.113 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 1' ' ' PHE . . . . . . . . . . . . . 94.6 m-85 . . . . . 0 N--CA 1.492 1.641 0 N-CA-C 111.748 0.277 . . . . 73.14 111.748 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 2' ' ' THR . . . . . 0.477 HG23 ' H ' ' A' ' 5' ' ' GLU . 4.1 t -116.01 142.85 46.24 Favored 'General case' 0 N--CA 1.488 1.449 0 C-N-CA 123.269 0.627 . . . . 73.14 110.982 -178.501 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 4.6 pp -63.36 -18.18 63.38 Favored 'General case' 0 N--CA 1.481 1.078 0 C-N-CA 123.942 0.897 . . . . 74.13 111.391 177.423 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 50.2 mm -64.06 -54.68 28.4 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.807 0 C-N-CA 123.436 0.695 . . . . 75.12 110.325 174.702 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . 0.477 ' H ' HG23 ' A' ' 2' ' ' THR . 42.7 mm-40 -66.84 -29.84 69.87 Favored 'General case' 0 N--CA 1.481 1.087 0 C-N-CA 122.958 0.503 . . . . 63.13 112.113 178.476 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 95.0 mt -67.62 -42.1 82.92 Favored 'General case' 0 N--CA 1.481 1.122 0 C-N-CA 122.966 0.507 . . . . 64.24 111.403 174.068 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -60.69 -50.37 73.76 Favored 'General case' 0 CA--C 1.555 1.172 0 C-N-CA 123.817 0.847 . . . . 65.35 109.962 176.283 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 96.5 mt -63.79 -46.37 94.61 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.869 0 C-N-CA 124.207 1.003 . . . . 55.02 112.603 -178.749 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 6.4 p -65.37 -38.83 83.49 Favored 'Isoleucine or valine' 0 CA--C 1.551 1.011 0 C-N-CA 122.694 0.398 . . . . 72.15 111.181 -178.482 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 8.9 t -66.12 -37.41 79.7 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.083 0 C-N-CA 123.403 0.681 . . . . 41.43 111.578 172.485 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -66.27 -51.68 55.05 Favored 'General case' 0 N--CA 1.48 1.031 0 C-N-CA 123.02 0.528 . . . . 51.43 111.546 -179.066 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 12' ' ' ILE . . . . . 0.545 ' HA ' HD12 ' A' ' 15' ' ' ILE . 20.8 pt -67.49 -44.71 86.5 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.935 0 C-N-CA 123.231 0.613 . . . . 73.23 111.823 -176.878 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 82.4 mt -64.37 -32.67 58.59 Favored 'Isoleucine or valine' 0 C--N 1.361 1.099 0 C-N-CA 123.614 0.766 . . . . 73.15 110.427 174.35 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -61.77 -36.95 93.5 Favored Glycine 0 C--N 1.349 1.291 0 CA-C-N 115.558 -0.746 . . . . 63.14 112.914 175.169 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . 0.545 HD12 ' HA ' ' A' ' 12' ' ' ILE . 22.9 mt -70.76 -42.91 77.62 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.904 0 C-N-CA 123.852 0.861 . . . . 74.52 110.705 175.343 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.508 ' HG ' ' O ' ' A' ' 12' ' ' ILE . 28.6 mt -60.99 -38.36 85.71 Favored 'General case' 0 N--CA 1.482 1.137 0 C-N-CA 123.361 0.664 . . . . 63.23 111.256 -179.948 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -74.36 -48.32 28.8 Favored 'General case' 0 CA--C 1.55 0.966 0 C-N-CA 123.218 0.607 . . . . 72.41 110.754 176.251 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -57.74 -22.83 48.85 Favored 'General case' 0 N--CA 1.487 1.379 0 N-CA-C 113.602 0.964 . . . . 61.14 113.602 -179.287 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 2.8 pp -94.79 -35.56 6.22 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.218 0 N-CA-C 112.07 0.396 . . . . 73.2 112.07 171.687 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -66.71 -46.66 74.83 Favored 'General case' 0 N--CA 1.484 1.275 0 C-N-CA 123.381 0.673 . . . . 74.25 112.471 -172.586 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 2.2 mp -61.78 -53.67 58.35 Favored Pre-proline 0 CA--C 1.574 1.881 0 CA-C-O 118.739 -0.648 . . . . 75.14 112.533 -177.053 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 34.3 Cg_endo -64.53 -37.53 37.58 Favored 'Trans proline' 0 C--N 1.384 2.411 0 C-N-CA 122.256 1.97 . . . . 74.21 113.523 175.013 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 26.0 tt0 -64.98 -38.89 92.45 Favored 'General case' 0 N--CA 1.487 1.381 0 C-N-CA 123.196 0.598 . . . . 50.23 110.502 -178.098 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 24' ' ' PHE . . . . . . . . . . . . . 72.8 t80 -81.99 -34.28 29.74 Favored 'General case' 0 N--CA 1.487 1.393 0 CA-C-N 114.998 -1.001 . . . . 72.05 110.291 -176.068 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . 0.513 ' O ' HG23 ' A' ' 29' ' ' VAL . 48.4 t -53.76 -59.21 4.92 Favored 'General case' 0 N--CA 1.478 0.97 0 C-N-CA 123.108 0.563 . . . . 64.34 109.868 168.866 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -65.18 -21.32 66.75 Favored 'General case' 0 N--CA 1.482 1.132 0 C-N-CA 124.319 1.047 . . . . 72.2 112.784 179.302 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 57.4 t80 -72.37 -45.02 61.66 Favored 'General case' 0 N--CA 1.483 1.188 0 C-N-CA 123.06 0.544 . . . . 74.24 111.076 174.911 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 27.8 mmm180 -70.2 -25.86 63.61 Favored 'General case' 0 N--CA 1.482 1.153 0 C-N-CA 123.545 0.738 . . . . 73.32 110.334 176.366 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . 0.513 HG23 ' O ' ' A' ' 25' ' ' SER . 91.1 t -69.5 -48.02 68.81 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.152 0 CA-C-N 115.75 -0.659 . . . . 75.15 109.41 172.359 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . 0.517 ' O ' ' HB3' ' A' ' 34' ' ' SER . 55.9 mttp -66.44 -21.28 66.2 Favored 'General case' 0 N--CA 1.488 1.455 0 C-N-CA 123.293 0.637 . . . . 72.41 112.297 175.799 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -68.1 -53.05 28.23 Favored 'General case' 0 N--CA 1.473 0.685 0 O-C-N 121.893 -0.504 . . . . 75.11 109.685 171.719 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 62.9 t80 -69.2 -64.08 0.94 Allowed 'General case' 0 C--O 1.219 -0.53 0 CA-C-N 115.274 -0.875 . . . . 73.14 111.235 -177.435 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 2.8 m-20 -56.91 -55.43 34.69 Favored 'General case' 0 N--CA 1.482 1.137 0 C-N-CA 125.213 1.405 . . . . 53.32 113.518 -177.414 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . 0.517 ' HB3' ' O ' ' A' ' 30' ' ' LYS . 44.1 t -73.76 -44.62 55.58 Favored 'General case' 0 N--CA 1.493 1.712 0 N-CA-C 111.685 0.254 . . . . 52.41 111.685 -170.486 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -68.18 -30.3 69.37 Favored 'General case' 0 N--CA 1.479 1.008 0 CA-C-O 119.596 -0.24 . . . . 71.1 111.445 176.856 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -64.48 -46.92 80.95 Favored 'General case' 0 N--CA 1.494 1.76 0 N-CA-C 111.908 0.336 . . . . 74.4 111.908 170.529 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 71.1 m -63.62 -41.94 98.24 Favored 'General case' 0 N--CA 1.489 1.504 0 C-N-CA 123.374 0.67 . . . . 45.23 111.742 -179.562 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 80.9 p -77.64 -26.45 50.47 Favored 'General case' 0 N--CA 1.48 1.043 0 C-N-CA 123.441 0.696 . . . . 50.41 111.638 -179.211 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 31.2 t70 -62.48 -51.62 66.74 Favored 'General case' 0 N--CA 1.479 0.998 0 C-N-CA 123.17 0.588 . . . . 55.34 110.011 169.265 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 95.3 mt -64.14 -36.92 85.61 Favored 'General case' 0 N--CA 1.479 1.004 0 CA-C-N 115.498 -0.774 . . . . 73.55 110.859 -178.266 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 20.6 tpt85 -66.98 -44.15 81.17 Favored 'General case' 0 CA--C 1.547 0.83 0 C-N-CA 123.788 0.835 . . . . 74.44 110.475 176.647 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 63.5 t30 -66.94 -35.46 80.04 Favored 'General case' 0 N--CA 1.482 1.132 0 C-N-CA 123.762 0.825 . . . . 74.31 111.591 179.739 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 92.2 mt -72.71 -36.9 67.91 Favored 'General case' 0 N--CA 1.482 1.171 0 C-N-CA 123.135 0.574 . . . . 73.13 110.18 177.665 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 23.2 tptm -73.59 -41.65 62.6 Favored 'General case' 0 CA--C 1.538 0.505 0 CA-C-O 121.383 0.611 . . . . 73.21 110.077 -174.18 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 5.1 t -73.62 -32.58 64.13 Favored 'General case' 0 CA--C 1.547 0.846 0 CA-C-N 115.899 -0.592 . . . . 71.13 111.876 -177.419 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -79.96 -60.67 2.25 Favored 'General case' 0 N--CA 1.482 1.169 0 C-N-CA 123.383 0.673 . . . . 74.22 111.938 179.889 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -65.14 -44.31 89.03 Favored 'General case' 0 N--CA 1.479 1.02 0 C-N-CA 123.038 0.535 . . . . 54.55 112.034 -175.616 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 56.8 mm-40 -73.9 -16.31 61.11 Favored 'General case' 0 N--CA 1.485 1.324 0 CA-C-N 118.215 0.462 . . . . 74.32 112.12 -177.837 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 36.8 t -71.13 -36.25 72.04 Favored 'General case' 0 N--CA 1.485 1.298 0 CA-C-O 121.048 0.451 . . . . 75.01 110.058 168.88 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -69.86 -40.66 75.62 Favored 'General case' 0 N--CA 1.48 1.03 0 C-N-CA 123.756 0.823 . . . . 70.53 111.152 178.681 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 51' ' ' PHE . . . . . 0.46 ' O ' ' HG2' ' A' ' 55' ' ' GLN . 60.5 m-85 -71.0 -41.96 70.24 Favored 'General case' 0 N--CA 1.478 0.967 0 CA-C-N 115.863 -0.608 . . . . 74.4 110.358 176.217 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -76.68 -0.11 22.34 Favored 'General case' 0 N--CA 1.495 1.783 0 C-N-CA 123.166 0.586 . . . . 70.43 112.344 -179.279 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 23.0 t70 -70.0 -48.05 59.7 Favored 'General case' 0 CA--C 1.553 1.08 0 C-N-CA 123.267 0.627 . . . . 75.13 110.236 170.201 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 9.5 m-20 -87.41 -62.18 1.56 Allowed 'General case' 0 N--CA 1.483 1.198 0 C-N-CA 123.579 0.752 . . . . 73.43 111.701 -176.218 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . 0.46 ' HG2' ' O ' ' A' ' 51' ' ' PHE . 10.2 pt20 -73.97 -16.79 61.07 Favored 'General case' 0 N--CA 1.49 1.574 0 C-N-CA 123.068 0.547 . . . . 41.42 112.368 -175.732 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 21.3 m 75.9 -45.42 0.53 Allowed 'General case' 0 N--CA 1.496 1.835 0 C-N-CA 125.734 1.613 . . . . 72.14 112.423 -177.718 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 75.4 t80 -67.43 118.84 60.58 Favored Pre-proline 0 CA--C 1.559 1.323 0 C-N-CA 124.758 1.223 . . . . 73.15 112.52 -179.48 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 59.0 Cg_endo -89.52 169.08 4.88 Favored 'Trans proline' 0 CA--C 1.562 1.921 0 C-N-CA 122.811 2.341 . . . . 70.22 110.821 162.822 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 21.8 Cg_exo -68.26 15.02 0.16 Allowed 'Trans proline' 0 N--CA 1.509 2.417 0 C-N-CA 122.729 2.286 . . . . 73.43 115.419 179.766 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 28.9 tt0 64.21 -75.39 0.04 OUTLIER 'General case' 0 CA--C 1.554 1.1 0 C-N-CA 125.76 1.624 . . . . 73.42 111.715 -176.583 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 32.3 t . . . . . 0 CA--C 1.563 1.452 0 CA-C-O 118.128 -0.939 . . . . 73.25 110.146 172.517 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 1' ' ' PHE . . . . . . . . . . . . . 30.4 p90 . . . . . 0 N--CA 1.48 1.048 0 N-CA-C 111.712 0.264 . . . . 64.32 111.712 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 2' ' ' THR . . . . . 0.477 HG23 ' H ' ' A' ' 5' ' ' GLU . 5.7 t -113.63 149.22 34.9 Favored 'General case' 0 N--CA 1.488 1.443 0 CA-C-O 121.207 0.527 . . . . 65.43 111.732 -175.222 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . 0.494 HD13 HD12 ' A' ' 6' ' ' LEU . 3.2 mm? -68.8 -17.99 64.11 Favored 'General case' 0 N--CA 1.479 0.995 0 CA-C-N 115.038 -0.983 . . . . 70.21 111.028 175.913 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 50.4 mm -65.05 -51.21 69.22 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.216 0 C-N-CA 123.194 0.598 . . . . 63.1 110.572 176.886 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . 0.477 ' H ' HG23 ' A' ' 2' ' ' THR . 18.9 mm-40 -62.76 -41.09 99.06 Favored 'General case' 0 N--CA 1.481 1.097 0 C-N-CA 123.001 0.52 . . . . 75.42 111.689 177.725 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . 0.494 HD12 HD13 ' A' ' 3' ' ' LEU . 90.9 mt -62.54 -37.33 85.69 Favored 'General case' 0 N--CA 1.489 1.524 0 C-N-CA 123.051 0.541 . . . . 73.41 111.96 174.182 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 34.4 tp -64.75 -41.15 96.13 Favored 'General case' 0 N--CA 1.476 0.861 0 C-N-CA 123.817 0.847 . . . . 51.4 111.736 178.504 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 93.4 mt -69.47 -43.81 80.44 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.768 0 C-N-CA 123.654 0.781 . . . . 74.21 111.226 178.333 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 82.9 t -61.92 -47.25 94.11 Favored 'Isoleucine or valine' 0 CA--C 1.556 1.18 0 C-N-CA 122.976 0.511 . . . . 63.33 111.465 176.041 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 2.5 p -68.07 -29.44 44.66 Favored 'Isoleucine or valine' 0 CA--C 1.556 1.179 0 C-N-CA 122.572 0.349 . . . . 74.11 111.6 179.656 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -70.75 -53.63 14.79 Favored 'General case' 0 C--N 1.365 1.258 0 C-N-CA 122.698 0.399 . . . . 70.1 111.164 177.558 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 12' ' ' ILE . . . . . 0.53 ' O ' ' HG ' ' A' ' 16' ' ' LEU . 21.4 pt -63.83 -42.14 94.87 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.101 0 C-N-CA 123.168 0.587 . . . . 65.32 111.794 -176.554 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 65.7 mt -66.08 -32.76 59.55 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.047 0 C-N-CA 123.697 0.799 . . . . 74.14 110.275 173.809 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -63.75 -32.78 85.32 Favored Glycine 0 C--N 1.351 1.412 0 CA-C-N 116.029 -0.532 . . . . 22.34 113.179 172.23 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 18.8 mm -72.55 -44.91 60.39 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.202 0 N-CA-C 109.216 -0.661 . . . . 73.34 109.216 175.116 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.53 ' HG ' ' O ' ' A' ' 12' ' ' ILE . 26.3 mt -59.77 -36.09 75.95 Favored 'General case' 0 N--CA 1.484 1.25 0 C-N-CA 123.655 0.782 . . . . 61.43 111.257 -179.316 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -70.62 -51.96 24.59 Favored 'General case' 0 N--CA 1.476 0.872 0 C-N-CA 123.232 0.613 . . . . 60.24 110.808 174.48 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -61.84 -22.9 65.9 Favored 'General case' 0 N--CA 1.481 1.095 0 N-CA-C 113.618 0.97 . . . . 60.32 113.618 -176.635 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 19' ' ' ILE . . . . . 0.404 HD12 ' N ' ' A' ' 20' ' ' ALA . 2.8 pp -92.4 -38.87 10.76 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.292 0 N-CA-C 111.835 0.309 . . . . 74.01 111.835 173.907 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . 0.404 ' N ' HD12 ' A' ' 19' ' ' ILE . . . -67.86 -43.39 79.55 Favored 'General case' 0 N--CA 1.485 1.323 0 N-CA-C 112.726 0.639 . . . . 65.23 112.726 -173.613 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 27.9 mt -61.06 -52.83 69.1 Favored Pre-proline 0 CA--C 1.563 1.454 0 CA-C-O 118.09 -0.957 . . . . 64.45 113.194 -177.071 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 46.2 Cg_endo -67.39 -35.78 22.58 Favored 'Trans proline' 0 C--N 1.377 2.077 0 CA-C-N 121.521 1.579 . . . . 74.41 112.956 173.765 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 29.3 tt0 -69.84 -31.08 68.75 Favored 'General case' 0 N--CA 1.483 1.201 0 CA-C-O 121.13 0.49 . . . . 63.52 111.106 -177.067 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 24' ' ' PHE . . . . . . . . . . . . . 16.4 t80 -95.22 -30.61 13.91 Favored 'General case' 0 N--CA 1.491 1.58 0 CA-C-N 115.796 -0.638 . . . . 74.41 110.781 -176.668 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . 0.438 ' O ' HG23 ' A' ' 29' ' ' VAL . 41.6 t -57.02 -56.88 16.07 Favored 'General case' 0 N--CA 1.486 1.337 0 N-CA-C 109.87 -0.418 . . . . 70.22 109.87 165.446 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -67.26 -17.55 64.84 Favored 'General case' 0 N--CA 1.486 1.362 0 C-N-CA 123.965 0.906 . . . . 65.32 112.843 177.996 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 93.2 t80 -67.01 -46.71 73.69 Favored 'General case' 0 N--CA 1.485 1.306 0 C-N-CA 123.286 0.634 . . . . 73.22 110.273 171.422 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 39.9 mtt180 -70.91 -29.64 65.75 Favored 'General case' 0 N--CA 1.478 0.966 0 CA-C-N 115.716 -0.675 . . . . 71.34 110.591 177.225 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . 0.438 HG23 ' O ' ' A' ' 25' ' ' SER . 73.2 t -67.65 -54.08 26.09 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.409 0 CA-C-N 116.033 -0.53 . . . . 71.33 110.398 177.4 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 12.4 ptmm? -68.96 -21.45 64.18 Favored 'General case' 0 N--CA 1.479 0.999 0 CA-C-N 115.659 -0.701 . . . . 61.32 110.803 177.645 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -69.1 -39.27 79.08 Favored 'General case' 0 N--CA 1.482 1.171 0 O-C-N 121.931 -0.481 . . . . 75.52 110.114 173.551 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 92.9 t80 -66.42 -43.72 84.9 Favored 'General case' 0 N--CA 1.474 0.727 0 CA-C-N 115.539 -0.755 . . . . 65.43 111.769 -179.552 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 22.3 m120 -83.87 -45.83 12.81 Favored 'General case' 0 N--CA 1.476 0.851 0 C-N-CA 123.627 0.771 . . . . 62.23 112.701 -175.233 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 30.3 t -77.6 -47.01 20.43 Favored 'General case' 0 N--CA 1.494 1.739 0 N-CA-C 111.49 0.182 . . . . 65.32 111.49 -171.506 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -62.28 -35.51 79.23 Favored 'General case' 0 N--CA 1.481 1.077 0 C-N-CA 122.473 0.309 . . . . 72.35 111.203 174.915 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -63.01 -49.89 72.88 Favored 'General case' 0 N--CA 1.486 1.343 0 O-C-N 123.418 0.449 . . . . 75.21 111.619 175.348 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 71.2 m -57.1 -38.68 73.74 Favored 'General case' 0 N--CA 1.491 1.59 0 C-N-CA 122.871 0.468 . . . . 71.03 112.2 -178.688 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 33.5 t -85.96 -31.59 22.0 Favored 'General case' 0 N--CA 1.487 1.397 0 C-N-CA 123.625 0.77 . . . . 61.24 112.648 -177.619 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 38.8 t70 -70.07 -44.61 68.77 Favored 'General case' 0 N--CA 1.48 1.052 0 CA-C-O 120.846 0.355 . . . . 71.11 110.616 176.406 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 97.0 mt -71.99 -27.53 62.81 Favored 'General case' 0 N--CA 1.475 0.79 0 CA-C-N 115.702 -0.681 . . . . 71.13 110.242 -178.732 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 20.5 tpp180 -71.63 -43.13 66.68 Favored 'General case' 0 N--CA 1.475 0.787 0 C-N-CA 123.604 0.762 . . . . 70.43 110.483 173.319 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 58.2 t30 -61.66 -44.07 97.65 Favored 'General case' 0 N--CA 1.486 1.335 0 C-N-CA 124.076 0.95 . . . . 72.5 111.944 177.218 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 94.6 mt -75.15 -33.11 61.48 Favored 'General case' 0 N--CA 1.479 1.001 0 CA-C-N 115.923 -0.581 . . . . 75.21 111.142 -179.05 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . 0.413 ' O ' ' HG2' ' A' ' 48' ' ' GLU . 22.4 ttmm -71.44 -48.1 51.63 Favored 'General case' 0 N--CA 1.475 0.799 0 N-CA-C 109.747 -0.464 . . . . 71.11 109.747 179.789 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 3.4 t -61.76 -36.0 79.76 Favored 'General case' 0 N--CA 1.484 1.256 0 C-N-CA 123.025 0.53 . . . . 55.1 111.197 -176.354 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -63.71 -50.49 68.96 Favored 'General case' 0 N--CA 1.477 0.879 0 C-N-CA 123.586 0.754 . . . . 60.21 111.634 175.397 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 8.3 mp -66.91 -42.05 86.08 Favored 'General case' 0 N--CA 1.488 1.473 0 C-N-CA 123.503 0.721 . . . . 73.3 112.715 -179.024 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . 0.413 ' HG2' ' O ' ' A' ' 44' ' ' LYS . 36.9 mm-40 -67.85 -45.8 73.57 Favored 'General case' 0 N--CA 1.477 0.886 0 C-N-CA 123.363 0.665 . . . . 73.01 110.755 -178.596 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 49' ' ' SER . . . . . 0.401 ' O ' ' HB2' ' A' ' 53' ' ' ASP . 62.3 m -66.07 -37.16 85.11 Favored 'General case' 0 N--CA 1.482 1.165 0 C-N-CA 122.626 0.37 . . . . 74.32 111.599 179.439 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -68.02 -49.63 60.31 Favored 'General case' 0 N--CA 1.489 1.512 0 C-N-CA 123.264 0.626 . . . . 73.21 112.135 179.113 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 51' ' ' PHE . . . . . . . . . . . . . 28.9 t80 -72.44 -28.81 63.17 Favored 'General case' 0 N--CA 1.484 1.263 0 C-N-CA 123.491 0.717 . . . . 72.12 111.563 -176.948 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -91.26 -11.65 37.51 Favored 'General case' 0 N--CA 1.488 1.461 0 C-N-CA 123.286 0.634 . . . . 54.2 112.208 177.997 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 53' ' ' ASP . . . . . 0.401 ' HB2' ' O ' ' A' ' 49' ' ' SER . 18.2 t70 -62.66 -50.49 70.98 Favored 'General case' 0 N--CA 1.484 1.246 0 C-N-CA 123.223 0.609 . . . . 74.43 109.93 175.846 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 35.0 t70 -136.82 99.68 4.1 Favored 'General case' 0 CA--C 1.551 0.992 0 CA-C-N 115.319 -0.855 . . . . 70.32 109.156 174.882 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 22.1 tt0 -124.34 24.06 8.12 Favored 'General case' 0 N--CA 1.487 1.389 0 C-N-CA 124.203 1.001 . . . . 61.23 109.731 -178.12 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 69.1 p -79.5 -5.96 55.94 Favored 'General case' 0 N--CA 1.485 1.305 0 C-N-CA 124.125 0.97 . . . . 74.4 113.106 -175.466 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 12.2 p90 -64.79 131.94 95.3 Favored Pre-proline 0 CA--C 1.563 1.477 0 C-N-CA 123.254 0.622 . . . . 73.54 110.866 179.037 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 23.8 Cg_exo -67.02 166.69 22.07 Favored 'Trans proline' 0 CA--C 1.565 2.037 0 C-N-CA 122.938 2.425 . . . . 64.31 112.779 173.323 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 36.3 Cg_endo -62.76 -1.99 3.13 Favored 'Trans proline' 0 C--N 1.387 2.566 0 C-N-CA 122.868 2.378 . . . . 74.43 114.849 174.612 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 45.2 mt-10 64.11 41.76 6.08 Favored 'General case' 0 N--CA 1.491 1.607 0 C-N-CA 125.081 1.352 . . . . 72.22 112.237 173.962 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 23.6 m . . . . . 0 N--CA 1.495 1.815 0 C-N-CA 125.514 1.526 . . . . 61.4 112.121 178.514 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 1' ' ' PHE . . . . . . . . . . . . . 59.5 m-85 . . . . . 0 N--CA 1.485 1.322 0 CA-C-O 120.61 0.243 . . . . 73.12 110.707 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 2' ' ' THR . . . . . 0.632 HG22 ' H ' ' A' ' 4' ' ' ILE . 36.7 m -108.13 134.7 50.64 Favored 'General case' 0 N--CA 1.484 1.226 0 C-N-CA 123.85 0.86 . . . . 70.24 110.93 -178.926 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 2.5 pt? -61.22 -17.46 53.36 Favored 'General case' 0 N--CA 1.49 1.57 0 C-N-CA 124.123 0.969 . . . . 75.01 113.202 179.175 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . 0.632 ' H ' HG22 ' A' ' 2' ' ' THR . 50.6 mm -86.17 -45.05 16.88 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.735 0 C-N-CA 123.369 0.668 . . . . 60.11 110.322 179.461 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 20.1 mm-40 -64.16 -33.77 76.55 Favored 'General case' 0 N--CA 1.481 1.08 0 C-N-CA 123.304 0.642 . . . . 72.21 111.799 -179.812 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . 0.4 ' HA ' HG12 ' A' ' 9' ' ' VAL . 3.5 pp -70.07 -34.0 72.64 Favored 'General case' 0 N--CA 1.477 0.921 0 O-C-N 123.156 0.285 . . . . 53.52 111.332 174.245 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -67.7 -37.69 82.63 Favored 'General case' 0 CA--C 1.561 1.398 0 C-N-CA 123.814 0.846 . . . . 74.12 110.904 176.759 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 87.4 mt -70.39 -49.37 54.09 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.707 0 C-N-CA 123.292 0.637 . . . . 62.4 111.99 178.996 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . 0.4 HG12 ' HA ' ' A' ' 6' ' ' LEU . 9.7 p -64.52 -39.66 86.36 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.901 0 C-N-CA 122.684 0.394 . . . . 74.33 111.789 -179.527 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 2.0 p -67.28 -30.0 47.71 Favored 'Isoleucine or valine' 0 CA--C 1.56 1.351 0 C-N-CA 122.435 0.294 . . . . 72.23 111.3 175.697 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -69.15 -52.76 24.89 Favored 'General case' 0 N--CA 1.483 1.219 0 C-N-CA 122.652 0.381 . . . . 54.13 111.583 177.533 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 12' ' ' ILE . . . . . 0.524 ' O ' ' HG ' ' A' ' 16' ' ' LEU . 21.3 pt -62.54 -41.5 92.24 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.967 0 C-N-CA 122.723 0.409 . . . . 71.13 111.46 -179.117 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 56.0 mt -62.15 -36.21 73.09 Favored 'Isoleucine or valine' 0 C--N 1.362 1.139 0 C-N-CA 124.277 1.031 . . . . 75.22 111.097 174.382 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -58.13 -36.43 81.94 Favored Glycine 0 C--N 1.355 1.596 0 O-C-N 123.553 0.533 . . . . 74.41 113.198 174.856 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 1.7 mp -75.98 -42.81 39.12 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.877 0 C-N-CA 123.06 0.544 . . . . 72.41 109.995 175.768 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.524 ' HG ' ' O ' ' A' ' 12' ' ' ILE . 37.9 mt -59.52 -36.59 76.4 Favored 'General case' 0 N--CA 1.489 1.488 0 C-N-CA 122.975 0.51 . . . . 71.53 112.006 -176.623 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -73.73 -52.43 13.23 Favored 'General case' 0 CA--C 1.546 0.826 0 C-N-CA 122.738 0.415 . . . . 62.02 110.228 175.143 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -53.87 -30.05 44.08 Favored 'General case' 0 N--CA 1.488 1.431 0 C-N-CA 124.226 1.01 . . . . 35.52 113.444 -178.168 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 19' ' ' ILE . . . . . 0.516 ' O ' ' HB3' ' A' ' 23' ' ' GLN . 2.8 pp -88.47 -35.94 8.55 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.297 0 N-CA-C 112.177 0.436 . . . . 73.04 112.177 175.501 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -71.74 -42.98 66.62 Favored 'General case' 0 N--CA 1.481 1.092 0 N-CA-C 112.872 0.693 . . . . 72.31 112.872 -170.985 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 1.9 mp -57.07 -54.13 57.83 Favored Pre-proline 0 CA--C 1.567 1.624 0 CA-C-O 118.723 -0.656 . . . . 64.53 111.591 -178.286 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 36.3 Cg_endo -64.72 -39.64 25.77 Favored 'Trans proline' 0 C--N 1.386 2.515 0 C-N-CA 121.493 1.462 . . . . 75.15 113.441 173.226 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 23' ' ' GLN . . . . . 0.516 ' HB3' ' O ' ' A' ' 19' ' ' ILE . 0.1 OUTLIER -64.94 -29.88 70.85 Favored 'General case' 0 N--CA 1.496 1.841 0 C-N-CA 122.77 0.428 . . . . 75.53 110.685 -175.669 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 24' ' ' PHE . . . . . . . . . . . . . 73.7 t80 -96.59 -37.94 10.17 Favored 'General case' 0 N--CA 1.485 1.276 0 CA-C-N 115.533 -0.758 . . . . 70.31 111.135 -173.61 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . 0.456 ' O ' HG23 ' A' ' 29' ' ' VAL . 46.2 t -61.09 -57.51 12.25 Favored 'General case' 0 N--CA 1.477 0.884 0 N-CA-C 109.167 -0.679 . . . . 60.43 109.167 174.524 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -63.34 -22.02 66.62 Favored 'General case' 0 N--CA 1.482 1.159 0 C-N-CA 123.632 0.773 . . . . 64.23 112.658 177.275 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 27' ' ' TYR . . . . . 0.442 ' HB2' ' O ' ' A' ' 23' ' ' GLN . 75.7 t80 -67.23 -48.73 66.93 Favored 'General case' 0 N--CA 1.489 1.497 0 CA-C-O 121.278 0.561 . . . . 74.35 110.502 173.488 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 74.4 mtp180 -73.28 -27.27 61.46 Favored 'General case' 0 N--CA 1.472 0.643 0 CA-C-N 115.612 -0.722 . . . . 74.2 111.617 178.26 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . 0.456 HG23 ' O ' ' A' ' 25' ' ' SER . 55.5 t -73.62 -42.65 55.29 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.4 0 O-C-N 123.347 0.404 . . . . 73.52 110.494 178.636 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . 0.438 ' HG2' ' O ' ' A' ' 27' ' ' TYR . 11.7 ptmm? -68.59 -30.32 69.05 Favored 'General case' 0 N--CA 1.476 0.869 0 CA-C-N 116.311 -0.404 . . . . 74.11 110.147 177.29 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -80.09 -34.83 37.66 Favored 'General case' 0 N--CA 1.482 1.138 0 C-N-CA 122.903 0.481 . . . . 74.1 110.837 -179.3 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 39.8 t80 -72.26 -21.56 61.35 Favored 'General case' 0 N--CA 1.485 1.291 0 C-N-CA 123.544 0.738 . . . . 74.25 110.922 -179.282 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 2.9 m-20 -94.49 -45.72 7.3 Favored 'General case' 0 N--CA 1.478 0.929 0 C-N-CA 123.872 0.869 . . . . 75.11 111.658 175.025 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 42.4 t -65.33 -55.33 18.82 Favored 'General case' 0 N--CA 1.495 1.817 0 C-N-CA 122.835 0.454 . . . . 61.14 111.75 -176.63 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -62.23 -39.29 92.31 Favored 'General case' 0 N--CA 1.474 0.747 0 CA-C-N 115.954 -0.566 . . . . 61.22 111.578 179.152 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -61.29 -60.57 3.54 Favored 'General case' 0 N--CA 1.485 1.318 0 C-N-CA 123.158 0.583 . . . . 51.34 111.569 178.695 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 37.7 t -53.26 -50.54 64.62 Favored 'General case' 0 N--CA 1.479 1.007 0 C-N-CA 123.937 0.895 . . . . 50.14 111.913 -179.713 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 30.5 t -72.01 -29.8 64.56 Favored 'General case' 0 N--CA 1.478 0.952 0 N-CA-C 112.621 0.6 . . . . 62.23 112.621 -175.967 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 37.0 t70 -63.93 -49.73 71.44 Favored 'General case' 0 N--CA 1.484 1.245 0 C-N-CA 122.64 0.376 . . . . 74.45 111.075 172.69 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 88.3 mt -67.78 -35.48 78.75 Favored 'General case' 0 N--CA 1.481 1.118 0 CA-C-N 115.622 -0.717 . . . . 74.43 110.782 -174.981 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 99.6 mtt180 -70.66 -42.24 71.03 Favored 'General case' 0 N--CA 1.48 1.064 0 CA-C-N 115.054 -0.976 . . . . 73.44 110.681 175.363 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 65.2 t30 -64.75 -36.13 83.31 Favored 'General case' 0 N--CA 1.489 1.516 0 C-N-CA 123.462 0.705 . . . . 43.35 111.671 179.774 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . 0.447 ' O ' HD13 ' A' ' 47' ' ' LEU . 93.6 mt -76.64 -34.77 58.28 Favored 'General case' 0 N--CA 1.478 0.97 0 C-N-CA 122.976 0.511 . . . . 71.51 110.974 179.632 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 79.4 tttt -70.98 -48.29 54.13 Favored 'General case' 0 N--CA 1.472 0.658 0 N-CA-C 109.822 -0.436 . . . . 64.41 109.822 -178.396 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 6.2 t -65.47 -31.76 73.01 Favored 'General case' 0 N--CA 1.478 0.973 0 C-N-CA 123.863 0.865 . . . . 75.41 111.674 -177.481 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -61.63 -46.48 89.62 Favored 'General case' 0 N--CA 1.481 1.121 0 C-N-CA 124.024 0.93 . . . . 64.44 111.243 172.149 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 47' ' ' LEU . . . . . 0.447 HD13 ' O ' ' A' ' 43' ' ' LEU . 8.4 mp -66.92 -39.15 87.3 Favored 'General case' 0 N--CA 1.479 1.002 0 CA-C-N 115.622 -0.717 . . . . 72.22 111.675 176.326 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 49.8 mt-10 -66.95 -38.2 85.7 Favored 'General case' 0 N--CA 1.484 1.247 0 C-N-CA 122.872 0.469 . . . . 61.14 111.147 179.647 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 34.2 t -69.04 -27.61 65.81 Favored 'General case' 0 N--CA 1.479 1.011 0 C-N-CA 123.509 0.723 . . . . 41.31 111.145 175.393 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -74.83 -53.58 8.86 Favored 'General case' 0 N--CA 1.477 0.881 0 C-N-CA 123.283 0.633 . . . . 62.51 110.341 178.057 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 51' ' ' PHE . . . . . . . . . . . . . 57.9 m-85 -72.46 -14.52 61.7 Favored 'General case' 0 N--CA 1.487 1.377 0 C-N-CA 123.961 0.905 . . . . 63.5 112.466 -177.404 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -67.67 -19.11 65.14 Favored 'General case' 0 N--CA 1.486 1.357 0 C-N-CA 123.455 0.702 . . . . 72.42 111.731 172.31 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 20.5 t70 -78.41 -27.34 46.64 Favored 'General case' 0 CA--C 1.558 1.253 0 C-N-CA 123.548 0.739 . . . . 62.44 110.871 174.232 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 36.6 t70 65.63 91.41 0.08 Allowed 'General case' 0 CA--C 1.558 1.27 0 C-N-CA 125.397 1.479 . . . . 74.12 111.338 -176.112 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -89.94 -25.43 20.93 Favored 'General case' 0 N--CA 1.485 1.285 0 C-N-CA 123.904 0.882 . . . . 70.32 111.424 -176.406 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 47.4 p -122.27 78.16 1.47 Allowed 'General case' 0 N--CA 1.481 1.108 0 C-N-CA 123.517 0.727 . . . . 73.11 110.739 -179.444 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 48.4 p90 -65.98 143.85 98.59 Favored Pre-proline 0 N--CA 1.489 1.489 0 CA-C-N 115.71 -0.677 . . . . 74.34 111.088 175.163 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 70.3 Cg_endo -72.63 130.94 16.58 Favored 'Trans proline' 0 CA--C 1.566 2.082 0 C-N-CA 121.529 1.486 . . . . 75.44 111.775 175.149 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 16.3 Cg_exo -71.01 -179.43 3.47 Favored 'Trans proline' 0 C--N 1.376 2.011 0 C-N-CA 122.963 2.442 . . . . 73.45 112.913 174.132 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 31.2 mm-40 -62.65 129.93 42.75 Favored 'General case' 0 N--CA 1.483 1.2 0 C-N-CA 123.175 0.59 . . . . 54.32 111.826 179.906 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 39.4 t . . . . . 0 C--O 1.254 1.315 0 C-N-CA 123.866 0.866 . . . . 50.2 110.24 -179.465 . . . . . . . . 0 0 . 1 stop_ save_